#METABOLOMICS WORKBENCH BaiRui_20210404_092204_mwtab.txt DATATRACK_ID:2566 STUDY_ID:ST001783 ANALYSIS_ID:AN002894 PROJECT_ID:000000
VERSION 1
CREATED_ON May 11, 2021, 4:01 pm
#PROJECT
PR:PROJECT_TYPE Original Research
PR:PROJECT_SUMMARY With the innovation of metabolite detection technology and the application of
PR:PROJECT_SUMMARY chemometrics in biomarker identification, metabolomics has been widely used to
PR:PROJECT_SUMMARY identify endogenous differential metabolites after drug poisoning. In this
PR:PROJECT_SUMMARY study, ultra-performance liquid chromatography-high resolution mass spectrometry
PR:PROJECT_SUMMARY (UPLC-HRMS) was combined with advanced chemometric approaches to identify
PR:PROJECT_SUMMARY differential metabolites that are associated with lethal chlorpromazine (CPZ)
PR:PROJECT_SUMMARY poisoning and associated perturbed metabolic pathways. Differential metabolite
PR:PROJECT_SUMMARY specificity and stability were assessed by comparing the CPZ samples to other
PR:PROJECT_SUMMARY antipsychotics, such as perphenazine (PER), clozapine (CLO) and olanzapine
PR:PROJECT_SUMMARY (OLA), that are associated with a high fatality frequency and by comparing them
PR:PROJECT_SUMMARY to non-drug related deaths (NDRDs) associated with hypoxia. The results
PR:PROJECT_SUMMARY implicated three candidate differential metabolites (acetyl-L-carnitine,
PR:PROJECT_SUMMARY propionyl-L-carnitine and succinic acid) with a high and relatively stable
PR:PROJECT_SUMMARY sensitivity (85.7–100%) following predictive analysis. Additionally, no
PR:PROJECT_SUMMARY differential metabolites were identified when comparing CPZ to PRE, OLA and CLO,
PR:PROJECT_SUMMARY but all of the drugs showed a similar pharmacodynamic receptor profile. Overall,
PR:PROJECT_SUMMARY this study provides a methodological and theoretical basis for biomarker
PR:PROJECT_SUMMARY identification in lethal CPZ poisoning (LCP) cases.
PR:INSTITUTE new
PR:FIRST_NAME rui
PR:ADDRESS Hebei Province, Shijiazhuang 050018, P.R. China
PR:EMAIL 15822925144@163.com
PR:PHONE 18522889554
PR:PROJECT_TITLE Examination of Candidate Differential Metabolites for Lethal Chlorpromazine
PR:PROJECT_TITLE Poisoning Using a LC-MS-based Metabolomics Approach in Mice (part V)
PR:LAST_NAME Bai
#STUDY
ST:STUDY_TITLE Performance of Three Differential Metabolites at Different TSS within 20 days
ST:STUDY_SUMMARY Examining the Identified Differential Metabolites (acetyl-L-carnitine,
ST:STUDY_SUMMARY propionyl-L-carnitine and succinic acid) in Other Antipsychotics.
ST:INSTITUTE Hebei medical university
ST:LAST_NAME Bai
ST:FIRST_NAME Rui
ST:ADDRESS No.9 Tiyu North Street, Chang'an District
ST:EMAIL 15822925144@163.com
ST:STUDY_TYPE original study
ST:PHONE 18522889554
#SUBJECT
SU:SUBJECT_TYPE Mammal
SU:SUBJECT_SPECIES Mus musculus
SU:TAXONOMY_ID 10090
SU:AGE_OR_AGE_RANGE 7-8 weeks
SU:GENDER Male and female
SU:SPECIES_GROUP Hsd:ICR(CD1) mice
#SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data
SUBJECT_SAMPLE_FACTORS - CPZ-0-1 Phenotype:Lethal chlorpromazine poisoning | Time:0 day RAW_FILE_NAME=CPZ-0-1
SUBJECT_SAMPLE_FACTORS - CPZ-0-2 Phenotype:Lethal chlorpromazine poisoning | Time:0 day RAW_FILE_NAME=CPZ-0-2
SUBJECT_SAMPLE_FACTORS - CPZ-0-3 Phenotype:Lethal chlorpromazine poisoning | Time:0 day RAW_FILE_NAME=CPZ-0-3
SUBJECT_SAMPLE_FACTORS - CPZ-0-4 Phenotype:Lethal chlorpromazine poisoning | Time:0 day RAW_FILE_NAME=CPZ-0-4
SUBJECT_SAMPLE_FACTORS - CPZ-0-6 Phenotype:Lethal chlorpromazine poisoning | Time:0 day RAW_FILE_NAME=CPZ-0-6
SUBJECT_SAMPLE_FACTORS - CPZ-0-7 Phenotype:Lethal chlorpromazine poisoning | Time:0 day RAW_FILE_NAME=CPZ-0-7
SUBJECT_SAMPLE_FACTORS - CPZ-1-1 Phenotype:Lethal chlorpromazine poisoning | Time:1st day RAW_FILE_NAME=CPZ-1-1
SUBJECT_SAMPLE_FACTORS - CPZ-1-2 Phenotype:Lethal chlorpromazine poisoning | Time:1st day RAW_FILE_NAME=CPZ-1-2
SUBJECT_SAMPLE_FACTORS - CPZ-1-3 Phenotype:Lethal chlorpromazine poisoning | Time:1st day RAW_FILE_NAME=CPZ-1-3
SUBJECT_SAMPLE_FACTORS - CPZ-1-4 Phenotype:Lethal chlorpromazine poisoning | Time:1st day RAW_FILE_NAME=CPZ-1-4
SUBJECT_SAMPLE_FACTORS - CPZ-1-6 Phenotype:Lethal chlorpromazine poisoning | Time:1st day RAW_FILE_NAME=CPZ-1-6
SUBJECT_SAMPLE_FACTORS - CPZ-1-7 Phenotype:Lethal chlorpromazine poisoning | Time:1st day RAW_FILE_NAME=CPZ-1-7
SUBJECT_SAMPLE_FACTORS - CPZ-2-1 Phenotype:Lethal chlorpromazine poisoning | Time:2nd day RAW_FILE_NAME=CPZ-2-1
SUBJECT_SAMPLE_FACTORS - CPZ-2-2 Phenotype:Lethal chlorpromazine poisoning | Time:2nd day RAW_FILE_NAME=CPZ-2-2
SUBJECT_SAMPLE_FACTORS - CPZ-2-3 Phenotype:Lethal chlorpromazine poisoning | Time:2nd day RAW_FILE_NAME=CPZ-2-3
SUBJECT_SAMPLE_FACTORS - CPZ-2-4 Phenotype:Lethal chlorpromazine poisoning | Time:2nd day RAW_FILE_NAME=CPZ-2-4
SUBJECT_SAMPLE_FACTORS - CPZ-2-6 Phenotype:Lethal chlorpromazine poisoning | Time:2nd day RAW_FILE_NAME=CPZ-2-6
SUBJECT_SAMPLE_FACTORS - CPZ-2-7 Phenotype:Lethal chlorpromazine poisoning | Time:2nd day RAW_FILE_NAME=CPZ-2-7
SUBJECT_SAMPLE_FACTORS - CPZ-5-1 Phenotype:Lethal chlorpromazine poisoning | Time:5th day RAW_FILE_NAME=CPZ-5-1
SUBJECT_SAMPLE_FACTORS - CPZ-5-2 Phenotype:Lethal chlorpromazine poisoning | Time:5th day RAW_FILE_NAME=CPZ-5-2
SUBJECT_SAMPLE_FACTORS - CPZ-5-3 Phenotype:Lethal chlorpromazine poisoning | Time:5th day RAW_FILE_NAME=CPZ-5-3
SUBJECT_SAMPLE_FACTORS - CPZ-5-4 Phenotype:Lethal chlorpromazine poisoning | Time:5th day RAW_FILE_NAME=CPZ-5-4
SUBJECT_SAMPLE_FACTORS - CPZ-5-6 Phenotype:Lethal chlorpromazine poisoning | Time:5th day RAW_FILE_NAME=CPZ-5-6
SUBJECT_SAMPLE_FACTORS - CPZ-5-7 Phenotype:Lethal chlorpromazine poisoning | Time:5th day RAW_FILE_NAME=CPZ-5-7
SUBJECT_SAMPLE_FACTORS - CPZ-10-1 Phenotype:Lethal chlorpromazine poisoning | Time:10th day RAW_FILE_NAME=CPZ-10-1
SUBJECT_SAMPLE_FACTORS - CPZ-10-2 Phenotype:Lethal chlorpromazine poisoning | Time:10th day RAW_FILE_NAME=CPZ-10-2
SUBJECT_SAMPLE_FACTORS - CPZ-10-3 Phenotype:Lethal chlorpromazine poisoning | Time:10th day RAW_FILE_NAME=CPZ-10-3
SUBJECT_SAMPLE_FACTORS - CPZ-10-4 Phenotype:Lethal chlorpromazine poisoning | Time:10th day RAW_FILE_NAME=CPZ-10-4
SUBJECT_SAMPLE_FACTORS - CPZ-10-6 Phenotype:Lethal chlorpromazine poisoning | Time:10th day RAW_FILE_NAME=CPZ-10-6
SUBJECT_SAMPLE_FACTORS - CPZ-10-7 Phenotype:Lethal chlorpromazine poisoning | Time:10th day RAW_FILE_NAME=CPZ-10-7
SUBJECT_SAMPLE_FACTORS - CPZ-20-1 Phenotype:Lethal chlorpromazine poisoning | Time:20th day RAW_FILE_NAME=CPZ-20-1
SUBJECT_SAMPLE_FACTORS - CPZ-20-2 Phenotype:Lethal chlorpromazine poisoning | Time:20th day RAW_FILE_NAME=CPZ-20-2
SUBJECT_SAMPLE_FACTORS - CPZ-20-3 Phenotype:Lethal chlorpromazine poisoning | Time:20th day RAW_FILE_NAME=CPZ-20-3
SUBJECT_SAMPLE_FACTORS - CPZ-20-4 Phenotype:Lethal chlorpromazine poisoning | Time:20th day RAW_FILE_NAME=CPZ-20-4
SUBJECT_SAMPLE_FACTORS - CPZ-20-6 Phenotype:Lethal chlorpromazine poisoning | Time:20th day RAW_FILE_NAME=CPZ-20-6
SUBJECT_SAMPLE_FACTORS - CPZ-20-7 Phenotype:Lethal chlorpromazine poisoning | Time:20th day RAW_FILE_NAME=CPZ-20-7
SUBJECT_SAMPLE_FACTORS - DROW-0-1 Phenotype:Drowning | Time:0 day RAW_FILE_NAME=DROW-0-1
SUBJECT_SAMPLE_FACTORS - DROW-0-2 Phenotype:Drowning | Time:0 day RAW_FILE_NAME=DROW-0-2
SUBJECT_SAMPLE_FACTORS - DROW-0-3 Phenotype:Drowning | Time:0 day RAW_FILE_NAME=DROW-0-3
SUBJECT_SAMPLE_FACTORS - DROW-0-4 Phenotype:Drowning | Time:0 day RAW_FILE_NAME=DROW-0-4
SUBJECT_SAMPLE_FACTORS - DROW-0-5 Phenotype:Drowning | Time:0 day RAW_FILE_NAME=DROW-0-5
SUBJECT_SAMPLE_FACTORS - DROW-1-1 Phenotype:Drowning | Time:1st day RAW_FILE_NAME=DROW-1-1
SUBJECT_SAMPLE_FACTORS - DROW-1-2 Phenotype:Drowning | Time:1st day RAW_FILE_NAME=DROW-1-2
SUBJECT_SAMPLE_FACTORS - DROW-1-3 Phenotype:Drowning | Time:1st day RAW_FILE_NAME=DROW-1-3
SUBJECT_SAMPLE_FACTORS - DROW-1-4 Phenotype:Drowning | Time:1st day RAW_FILE_NAME=DROW-1-4
SUBJECT_SAMPLE_FACTORS - DROW-1-5 Phenotype:Drowning | Time:1st day RAW_FILE_NAME=DROW-1-5
SUBJECT_SAMPLE_FACTORS - DROW-2-1 Phenotype:Drowning | Time:2nd day RAW_FILE_NAME=DROW-2-1
SUBJECT_SAMPLE_FACTORS - DROW-2-2 Phenotype:Drowning | Time:2nd day RAW_FILE_NAME=DROW-2-2
SUBJECT_SAMPLE_FACTORS - DROW-2-3 Phenotype:Drowning | Time:2nd day RAW_FILE_NAME=DROW-2-3
SUBJECT_SAMPLE_FACTORS - DROW-2-4 Phenotype:Drowning | Time:2nd day RAW_FILE_NAME=DROW-2-4
SUBJECT_SAMPLE_FACTORS - DROW-2-5 Phenotype:Drowning | Time:2nd day RAW_FILE_NAME=DROW-2-5
SUBJECT_SAMPLE_FACTORS - DROW-5-1 Phenotype:Drowning | Time:5th day RAW_FILE_NAME=DROW-5-1
SUBJECT_SAMPLE_FACTORS - DROW-5-2 Phenotype:Drowning | Time:5th day RAW_FILE_NAME=DROW-5-2
SUBJECT_SAMPLE_FACTORS - DROW-5-3 Phenotype:Drowning | Time:5th day RAW_FILE_NAME=DROW-5-3
SUBJECT_SAMPLE_FACTORS - DROW-5-4 Phenotype:Drowning | Time:5th day RAW_FILE_NAME=DROW-5-4
SUBJECT_SAMPLE_FACTORS - DROW-5-5 Phenotype:Drowning | Time:5th day RAW_FILE_NAME=DROW-5-5
SUBJECT_SAMPLE_FACTORS - DROW-10-1 Phenotype:Drowning | Time:10th day RAW_FILE_NAME=DROW-10-1
SUBJECT_SAMPLE_FACTORS - DROW-10-2 Phenotype:Drowning | Time:10th day RAW_FILE_NAME=DROW-10-2
SUBJECT_SAMPLE_FACTORS - DROW-10-3 Phenotype:Drowning | Time:10th day RAW_FILE_NAME=DROW-10-3
SUBJECT_SAMPLE_FACTORS - DROW-10-4 Phenotype:Drowning | Time:10th day RAW_FILE_NAME=DROW-10-4
SUBJECT_SAMPLE_FACTORS - DROW-10-5 Phenotype:Drowning | Time:10th day RAW_FILE_NAME=DROW-10-5
SUBJECT_SAMPLE_FACTORS - DROW-20-1 Phenotype:Drowning | Time:20th day RAW_FILE_NAME=DROW-20-1
SUBJECT_SAMPLE_FACTORS - DROW-20-2 Phenotype:Drowning | Time:20th day RAW_FILE_NAME=DROW-20-2
SUBJECT_SAMPLE_FACTORS - DROW-20-3 Phenotype:Drowning | Time:20th day RAW_FILE_NAME=DROW-20-3
SUBJECT_SAMPLE_FACTORS - DROW-20-4 Phenotype:Drowning | Time:20th day RAW_FILE_NAME=DROW-20-4
SUBJECT_SAMPLE_FACTORS - DROW-20-5 Phenotype:Drowning | Time:20th day RAW_FILE_NAME=DROW-20-5
SUBJECT_SAMPLE_FACTORS - SHOCK-0-1 Phenotype:Hemorrhagic shock | Time:0 day RAW_FILE_NAME=SHOCK-0-1
SUBJECT_SAMPLE_FACTORS - SHOCK-0-2 Phenotype:Hemorrhagic shock | Time:0 day RAW_FILE_NAME=SHOCK-0-2
SUBJECT_SAMPLE_FACTORS - SHOCK-0-3 Phenotype:Hemorrhagic shock | Time:0 day RAW_FILE_NAME=SHOCK-0-3
SUBJECT_SAMPLE_FACTORS - SHOCK-0-4 Phenotype:Hemorrhagic shock | Time:0 day RAW_FILE_NAME=SHOCK-0-4
SUBJECT_SAMPLE_FACTORS - SHOCK-0-5 Phenotype:Hemorrhagic shock | Time:0 day RAW_FILE_NAME=SHOCK-0-5
SUBJECT_SAMPLE_FACTORS - SHOCK-1-1 Phenotype:Hemorrhagic shock | Time:1st day RAW_FILE_NAME=SHOCK-1-1
SUBJECT_SAMPLE_FACTORS - SHOCK-1-2 Phenotype:Hemorrhagic shock | Time:1st day RAW_FILE_NAME=SHOCK-1-2
SUBJECT_SAMPLE_FACTORS - SHOCK-1-3 Phenotype:Hemorrhagic shock | Time:1st day RAW_FILE_NAME=SHOCK-1-3
SUBJECT_SAMPLE_FACTORS - SHOCK-1-4 Phenotype:Hemorrhagic shock | Time:1st day RAW_FILE_NAME=SHOCK-1-4
SUBJECT_SAMPLE_FACTORS - SHOCK-1-5 Phenotype:Hemorrhagic shock | Time:1st day RAW_FILE_NAME=SHOCK-1-5
SUBJECT_SAMPLE_FACTORS - SHOCK-2-1 Phenotype:Hemorrhagic shock | Time:2nd day RAW_FILE_NAME=SHOCK-2-1
SUBJECT_SAMPLE_FACTORS - SHOCK-2-2 Phenotype:Hemorrhagic shock | Time:2nd day RAW_FILE_NAME=SHOCK-2-2
SUBJECT_SAMPLE_FACTORS - SHOCK-2-3 Phenotype:Hemorrhagic shock | Time:2nd day RAW_FILE_NAME=SHOCK-2-3
SUBJECT_SAMPLE_FACTORS - SHOCK-2-4 Phenotype:Hemorrhagic shock | Time:2nd day RAW_FILE_NAME=SHOCK-2-4
SUBJECT_SAMPLE_FACTORS - SHOCK-2-5 Phenotype:Hemorrhagic shock | Time:2nd day RAW_FILE_NAME=SHOCK-2-5
SUBJECT_SAMPLE_FACTORS - SHOCK-5-1 Phenotype:Hemorrhagic shock | Time:5th day RAW_FILE_NAME=SHOCK-5-1
SUBJECT_SAMPLE_FACTORS - SHOCK-5-2 Phenotype:Hemorrhagic shock | Time:5th day RAW_FILE_NAME=SHOCK-5-2
SUBJECT_SAMPLE_FACTORS - SHOCK-5-3 Phenotype:Hemorrhagic shock | Time:5th day RAW_FILE_NAME=SHOCK-5-3
SUBJECT_SAMPLE_FACTORS - SHOCK-5-4 Phenotype:Hemorrhagic shock | Time:5th day RAW_FILE_NAME=SHOCK-5-4
SUBJECT_SAMPLE_FACTORS - SHOCK-5-5 Phenotype:Hemorrhagic shock | Time:5th day RAW_FILE_NAME=SHOCK-5-5
SUBJECT_SAMPLE_FACTORS - SHOCK-10-1 Phenotype:Hemorrhagic shock | Time:10th day RAW_FILE_NAME=SHOCK-10-1
SUBJECT_SAMPLE_FACTORS - SHOCK-10-2 Phenotype:Hemorrhagic shock | Time:10th day RAW_FILE_NAME=SHOCK-10-2
SUBJECT_SAMPLE_FACTORS - SHOCK-10-3 Phenotype:Hemorrhagic shock | Time:10th day RAW_FILE_NAME=SHOCK-10-3
SUBJECT_SAMPLE_FACTORS - SHOCK-10-4 Phenotype:Hemorrhagic shock | Time:10th day RAW_FILE_NAME=SHOCK-10-4
SUBJECT_SAMPLE_FACTORS - SHOCK-10-5 Phenotype:Hemorrhagic shock | Time:10th day RAW_FILE_NAME=SHOCK-10-5
SUBJECT_SAMPLE_FACTORS - SHOCK-20-1 Phenotype:Hemorrhagic shock | Time:20th day RAW_FILE_NAME=SHOCK-20-1
SUBJECT_SAMPLE_FACTORS - SHOCK-20-2 Phenotype:Hemorrhagic shock | Time:20th day RAW_FILE_NAME=SHOCK-20-2
SUBJECT_SAMPLE_FACTORS - SHOCK-20-3 Phenotype:Hemorrhagic shock | Time:20th day RAW_FILE_NAME=SHOCK-20-3
SUBJECT_SAMPLE_FACTORS - SHOCK-20-4 Phenotype:Hemorrhagic shock | Time:20th day RAW_FILE_NAME=SHOCK-20-4
SUBJECT_SAMPLE_FACTORS - SHOCK-20-5 Phenotype:Hemorrhagic shock | Time:20th day RAW_FILE_NAME=SHOCK-20-5
#COLLECTION
CO:COLLECTION_SUMMARY whole blood were collected at different time (days).
CO:COLLECTION_PROTOCOL_FILENAME process protocol.pdf
CO:SAMPLE_TYPE Blood (whole)
#TREATMENT
TR:TREATMENT_SUMMARY Lethal poisoning animals were given different chlorpromazine through
TR:TREATMENT_SUMMARY gavage.Drowning and hemorrahgic shock animal models according to previous
TR:TREATMENT_SUMMARY study.Abdominal aortic blood was obtained after death.Abdominal aortic blood was
TR:TREATMENT_SUMMARY obtained and transferred to a heparin treated 1.5 ml centrifuge tube. When
TR:TREATMENT_SUMMARY accessing stability, 7 LCP (male) and 10 NDRD whole blood samples (drowning:
TR:TREATMENT_SUMMARY cervical dislocation = 1:1, male) were stored at 4°C for up to 5 days and then
TR:TREATMENT_SUMMARY transferred to -20°C for up to 20 days. Samples (70 µL) were then absorbed on
TR:TREATMENT_SUMMARY days 0, 1, 2, 5 10 and 20 on ice.
TR:TREATMENT_PROTOCOL_FILENAME process protocol.pdf
TR:TREATMENT drug
TR:TREATMENT_ROUTE gavage
TR:TREATMENT_DOSE 150mg/100g
TR:TREATMENT_DOSEVOLUME 300ul
TR:TREATMENT_DOSEDURATION once
TR:TREATMENT_VEHICLE Gavage needle
TR:ANIMAL_ACCLIMATION_DURATION one week
TR:ANIMAL_FASTING one night before experiment
TR:ANIMAL_ENDP_CLINICAL_SIGNS stop breathing
TR:TREATMENT_COMPOUND chlorpromazine
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY 70 μL of whole blood was added to tubes with ice-cold methanol (Vsample:
SP:SAMPLEPREP_SUMMARY Vextraction = 1:3). Each sample was then vortexed for 30 s, sonicated for 10 min
SP:SAMPLEPREP_SUMMARY in an ice-water bath, and incubated for 20 min at −20°C to allow protein
SP:SAMPLEPREP_SUMMARY precipitation. The mixtures were then centrifuged at 12,000 g for 10 min at
SP:SAMPLEPREP_SUMMARY 4°C.
SP:PROCESSING_STORAGE_CONDITIONS On ice
SP:EXTRACT_STORAGE On ice
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY Separation was performed using a reverse-phase (C18) column (HSS T3 column; 2.1
CH:CHROMATOGRAPHY_SUMMARY mm × 100 mm, 1.8 μm; Waters), with a gradient elution of solution A (0.1%
CH:CHROMATOGRAPHY_SUMMARY formic acid in water) and solution B (acetonitrile) of 0.3 mL/min and an
CH:CHROMATOGRAPHY_SUMMARY injection volume of 5 μL. The elution gradient was set as follows: 0 min, 98%
CH:CHROMATOGRAPHY_SUMMARY A; 1 min, 98% A; 12 min, 2% A; 16 min, 2% A; 16.1 min, 98% A; and 20 min, 98% A.
CH:CHROMATOGRAPHY_TYPE Reversed phase
CH:INSTRUMENT_NAME Thermo Dionex Ultimate 3000
CH:COLUMN_NAME Waters Acquity BEH HSS T3 (100 x 2.1mm, 1.8um)
CH:FLOW_RATE 300ul/min
CH:COLUMN_TEMPERATURE 40
CH:SOLVENT_A 0.1% formic acid
CH:SOLVENT_B 100% Acetonitrile
CH:ANALYTICAL_TIME 20min
#ANALYSIS
AN:ANALYSIS_TYPE MS
#MS
MS:INSTRUMENT_NAME Thermo Q Exactive Orbitrap
MS:INSTRUMENT_TYPE Orbitrap
MS:MS_TYPE ESI
MS:ION_MODE UNSPECIFIED
MS:MS_COMMENTS compound discovery 3.1
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS peak area
MS_METABOLITE_DATA_START
Samples CPZ-0-1 CPZ-0-2 CPZ-0-3 CPZ-0-4 CPZ-0-6 CPZ-0-7 CPZ-1-1 CPZ-1-2 CPZ-1-3 CPZ-1-4 CPZ-1-6 CPZ-1-7 CPZ-2-1 CPZ-2-2 CPZ-2-3 CPZ-2-4 CPZ-2-6 CPZ-2-7 CPZ-5-1 CPZ-5-2 CPZ-5-3 CPZ-5-4 CPZ-5-6 CPZ-5-7 CPZ-10-1 CPZ-10-2 CPZ-10-3 CPZ-10-4 CPZ-10-6 CPZ-10-7 CPZ-20-1 CPZ-20-2 CPZ-20-3 CPZ-20-4 CPZ-20-6 CPZ-20-7 DROW-0-1 DROW-0-2 DROW-0-3 DROW-0-4 DROW-0-5 DROW-1-1 DROW-1-2 DROW-1-3 DROW-1-4 DROW-1-5 DROW-2-1 DROW-2-2 DROW-2-3 DROW-2-4 DROW-2-5 DROW-5-1 DROW-5-2 DROW-5-3 DROW-5-4 DROW-5-5 DROW-10-1 DROW-10-2 DROW-10-3 DROW-10-4 DROW-10-5 DROW-20-1 DROW-20-2 DROW-20-3 DROW-20-4 DROW-20-5 SHOCK-0-1 SHOCK-0-2 SHOCK-0-3 SHOCK-0-4 SHOCK-0-5 SHOCK-1-1 SHOCK-1-2 SHOCK-1-3 SHOCK-1-4 SHOCK-1-5 SHOCK-2-1 SHOCK-2-2 SHOCK-2-3 SHOCK-2-4 SHOCK-2-5 SHOCK-5-1 SHOCK-5-2 SHOCK-5-3 SHOCK-5-4 SHOCK-5-5 SHOCK-10-1 SHOCK-10-2 SHOCK-10-3 SHOCK-10-4 SHOCK-10-5 SHOCK-20-1 SHOCK-20-2 SHOCK-20-3 SHOCK-20-4 SHOCK-20-5
Factors Phenotype:Lethal chlorpromazine poisoning | Time:0 day Phenotype:Lethal chlorpromazine poisoning | Time:0 day Phenotype:Lethal chlorpromazine poisoning | Time:0 day Phenotype:Lethal chlorpromazine poisoning | Time:0 day Phenotype:Lethal chlorpromazine poisoning | Time:0 day Phenotype:Lethal chlorpromazine poisoning | Time:0 day Phenotype:Lethal chlorpromazine poisoning | Time:1st day Phenotype:Lethal chlorpromazine poisoning | Time:1st day Phenotype:Lethal chlorpromazine poisoning | Time:1st day Phenotype:Lethal chlorpromazine poisoning | Time:1st day Phenotype:Lethal chlorpromazine poisoning | Time:1st day Phenotype:Lethal chlorpromazine poisoning | Time:1st day Phenotype:Lethal chlorpromazine poisoning | Time:2nd day Phenotype:Lethal chlorpromazine poisoning | Time:2nd day Phenotype:Lethal chlorpromazine poisoning | Time:2nd day Phenotype:Lethal chlorpromazine poisoning | Time:2nd day Phenotype:Lethal chlorpromazine poisoning | Time:2nd day Phenotype:Lethal chlorpromazine poisoning | Time:2nd day Phenotype:Lethal chlorpromazine poisoning | Time:5th day Phenotype:Lethal chlorpromazine poisoning | Time:5th day Phenotype:Lethal chlorpromazine poisoning | Time:5th day Phenotype:Lethal chlorpromazine poisoning | Time:5th day Phenotype:Lethal chlorpromazine poisoning | Time:5th day Phenotype:Lethal chlorpromazine poisoning | Time:5th day Phenotype:Lethal chlorpromazine poisoning | Time:10th day Phenotype:Lethal chlorpromazine poisoning | Time:10th day Phenotype:Lethal chlorpromazine poisoning | Time:10th day Phenotype:Lethal chlorpromazine poisoning | Time:10th day Phenotype:Lethal chlorpromazine poisoning | Time:10th day Phenotype:Lethal chlorpromazine poisoning | Time:10th day Phenotype:Lethal chlorpromazine poisoning | Time:20th day Phenotype:Lethal chlorpromazine poisoning | Time:20th day Phenotype:Lethal chlorpromazine poisoning | Time:20th day Phenotype:Lethal chlorpromazine poisoning | Time:20th day Phenotype:Lethal chlorpromazine poisoning | Time:20th day Phenotype:Lethal chlorpromazine poisoning | Time:20th day Phenotype:Drowning | Time:0 day Phenotype:Drowning | Time:0 day Phenotype:Drowning | Time:0 day Phenotype:Drowning | Time:0 day Phenotype:Drowning | Time:0 day Phenotype:Drowning | Time:1st day Phenotype:Drowning | Time:1st day Phenotype:Drowning | Time:1st day Phenotype:Drowning | Time:1st day Phenotype:Drowning | Time:1st day Phenotype:Drowning | Time:2nd day Phenotype:Drowning | Time:2nd day Phenotype:Drowning | Time:2nd day Phenotype:Drowning | Time:2nd day Phenotype:Drowning | Time:2nd day Phenotype:Drowning | Time:5th day Phenotype:Drowning | Time:5th day Phenotype:Drowning | Time:5th day Phenotype:Drowning | Time:5th day Phenotype:Drowning | Time:5th day Phenotype:Drowning | Time:10th day Phenotype:Drowning | Time:10th day Phenotype:Drowning | Time:10th day Phenotype:Drowning | Time:10th day Phenotype:Drowning | Time:10th day Phenotype:Drowning | Time:20th day Phenotype:Drowning | Time:20th day Phenotype:Drowning | Time:20th day Phenotype:Drowning | Time:20th day Phenotype:Drowning | Time:20th day Phenotype:Hemorrhagic shock | Time:0 day Phenotype:Hemorrhagic shock | Time:0 day Phenotype:Hemorrhagic shock | Time:0 day Phenotype:Hemorrhagic shock | Time:0 day Phenotype:Hemorrhagic shock | Time:0 day Phenotype:Hemorrhagic shock | Time:1st day Phenotype:Hemorrhagic shock | Time:1st day Phenotype:Hemorrhagic shock | Time:1st day Phenotype:Hemorrhagic shock | Time:1st day Phenotype:Hemorrhagic shock | Time:1st day Phenotype:Hemorrhagic shock | Time:2nd day Phenotype:Hemorrhagic shock | Time:2nd day Phenotype:Hemorrhagic shock | Time:2nd day Phenotype:Hemorrhagic shock | Time:2nd day Phenotype:Hemorrhagic shock | Time:2nd day Phenotype:Hemorrhagic shock | Time:5th day Phenotype:Hemorrhagic shock | Time:5th day Phenotype:Hemorrhagic shock | Time:5th day Phenotype:Hemorrhagic shock | Time:5th day Phenotype:Hemorrhagic shock | Time:5th day Phenotype:Hemorrhagic shock | Time:10th day Phenotype:Hemorrhagic shock | Time:10th day Phenotype:Hemorrhagic shock | Time:10th day Phenotype:Hemorrhagic shock | Time:10th day Phenotype:Hemorrhagic shock | Time:10th day Phenotype:Hemorrhagic shock | Time:20th day Phenotype:Hemorrhagic shock | Time:20th day Phenotype:Hemorrhagic shock | Time:20th day Phenotype:Hemorrhagic shock | Time:20th day Phenotype:Hemorrhagic shock | Time:20th day
Phenotype LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP LCP Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Drowning Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock Hemorrhagic shock
Time 0 day 0 day 0 day 0 day 0 day 0 day 1st day 1st day 1st day 1st day 1st day 1st day 2nd day 2nd day 2nd day 2nd day 2nd day 2nd day 5th day 5th day 5th day 5th day 5th day 5th day 10th day 10th day 10th day 10th day 10th day 10th day 20th day 20th day 20th day 20th day 20th day 20th day 0 day 0 day 0 day 0 day 0 day 1st day 1st day 1st day 1st day 1st day 2nd day 2nd day 2nd day 2nd day 2nd day 5th day 5th day 5th day 5th day 5th day 10th day 10th day 10th day 10th day 10th day 20th day 20th day 20th day 20th day 20th day 0 day 0 day 0 day 0 day 0 day 1st day 1st day 1st day 1st day 1st day 2nd day 2nd day 2nd day 2nd day 2nd day 5th day 5th day 5th day 5th day 5th day 10th day 10th day 10th day 10th day 10th day 20th day 20th day 20th day 20th day 20th day
(-)-Camphanic acid 527906.6471 333183.819 312757.2621 1017351.589 2182262.042 13933400.05 621123.6899 267661.7464 255582.0847 1304047.364 4575792.316 18057476.6 838930.4283 330942.3287 307519.1674 991821.7404 3808659.668 21621424.19 831851.1295 408858.1661 300569.392 1512843.051 3484142.293 17798267.03 680074.7091 311395.9925 200465.0189 811925.2917 2845781.854 14218043.96 503357.3031 228889.275 221267.7422 832937.6399 1497111.475 15121145.7 139154.3904 637587.4061 667700.8721 212143.4952 367962.0518 213297.2662 1600789.908 527214.6583 63298.44487 450985.1285 119373.7722 1541940.234 669823.1611 260580.1421 485748.3822 134081.0332 1021131.027 587554.2764 125489.7704 502948.9563 157778.9438 1114616.727 535242.879 93762.86309 457245.2859 101236.6822 434688.9057 432137.5358 217796.6501 327761.5314 1264204.509 1195215.351 458633.543 748812.61 379324.0683 1378494.057 1380824.353 347160.8273 1104714.691 290013.3703 1284009.549 1464309.32 360858.3332 302420.0646 302222.0286 995688.3265 1228845.361 422157.5598 818337.8448 218542.0297 899888.2352 1080390.757 34336.84853 513933.2296 237153.2465 1037423.721 188247.1298 334441.5327 727730.3856 285178.061
(-)-citrinin 5862644.11 3497502.724 5960244.064 3298403.726 5102156.898 3764269.912 3643744.457 6149476.161 6575685.876 4294997.262 3905290.564 2207314.232 4841468.098 4489307.357 6000101.745 3154325.108 4713948.012 4161325.332 5636564.127 4867967.969 7661749.912 5424127.773 5056865.038 5307739.039 2391778.845 6249029.587 2821304.291 6541418.216 6629419.209 6627431.732 7653249.191 6098368.975 2923183.27 7199526.741 8443159.233 11218858.99 3215565.277 1564704.834 2608394.353 6556595.298 7431344.653 1925492.121 3012703.816 3245456.333 1251793.234 3483031.822 7030940.174 4132610.618 5907617.523 3440509.206 7226078.676 5159478.031 4839951.611 5498242.33 5599893.307 4442998.235 4643114.834 6476038.421 4224524.875 6189194.053 6057314.256 6621888.355 3927342.598 6491772.397 9958536.512 7486697.355 3033105.823 3892648.134 6703442.143 4573436.426 5459533.998 4372800.538 9390749.215 3413983.77 7286397.459 7987608.372 3934571.086 11760602.33 3540689.042 3131376.573 6677006.259 8239146.785 7300595.333 3467710.884 6972929.018 5887043.112 6885170.844 3864723.246 183386.0189 4095638.277 2456600.837 8477251.437 1534452.963 7114736.507 3324629.498 3158517.48
(−)-nabilone 1183158.583 14836781.43 736453.8683 3175630.997 11794278.04 6606543.682 594838.7723 18182211.3 824466.934 3725710.49 18893437.92 11592299.18 480249.2733 20103579.98 1865475.041 3672228.209 17541018.22 8225942.711 603087.1514 18773722.32 743007.628 6019141.422 20211327.6 11588596.96 852587.9637 13412736.99 682546.9832 3190475.427 16739923.63 10432409.29 653364.2539 11855287.28 857472.6519 3461383.664 8507468.997 9611898.645 9479002.339 405098.6247 2108062.488 1633154.699 662188.0897 13774838.1 686417.4254 2503492.333 269527.7907 466127.8022 12817683.18 6770132.526 2737576.195 1772199.359 569042.7071 9940817.421 682775.0488 1356800.326 1811358.302 570160.7907 10729993.69 730706.9617 1750004.672 1330954.831 693239.9593 6779027.031 425925.4064 1712069.351 1182359.748 621335.8619 687369.2646 2295458.623 3576575.734 1421262.474 6379143.605 1595169.534 3131300.815 2653712.906 2228359.835 4619246.587 1449438.456 3666791.34 2234733.321 541760.0642 4708986.382 1026842.426 3485164.463 2677826.115 1066761.001 3131590.727 1260161.335 4035843.634 233465.2979 567203.7493 3817500.056 1407723.178 624224.159 2212103.751 1081637.82 5337886.251
(-)-Prostaglandin E2 503525.4814 272401.9326 510870.9557 257984.2945 920260.8746 514970.1991 205023.7476 243635.6146 741150.9912 385352.4199 536168.509 705307.5415 2984003.532 938267.0504 1335407.264 694151.5073 891599.1291 1365647.239 2949025.455 2858207.597 1862045.938 5392766.922 1915508.637 1520950.674 33963078.14 1956953.854 5850822.63 8142153.417 3362068.976 1755693.972 20019086.75 10961547.79 8841524.159 10230612.03 7454853.243 6856576.073 202099.6627 160932.7167 189257.9384 478906.6515 324339.6887 201534.7881 398692.6996 487637.9239 369080.1393 1208598.314 522478.5205 926297.3552 1607285.425 975087.0833 1059804.006 3130338.667 1638332.315 961049.512 1880984.527 2279335.945 5354593.2 12390298.54 12342667.17 2753521.354 3985108.891 33689624.06 17933474.02 18764825.54 5742226.999 5560881.711 640112.7228 873171.1959 731647.8298 790403.3962 690269.8214 2554734.579 2090454.323 2620314.332 2717453.805 2864625.622 1717557.635 964892.4111 4535267.789 684534.3009 4655871.87 13629853.41 13862706.38 12618632.99 16018952.66 8670069.704 11903020.65 13924543.31 1035605.524 2003396.882 11677438.13 14941873.47 2808671.35 10444503.28 11694745.85 12524287.59
(-)-secoisolariciresinol 10170891.76 5968218.288 9450637.244 6617808.836 8738773.1 5706404.778 6181198.493 7548927.528 6846378.635 4712914.91 6541872.083 5241217.534 5154198.498 5298989.126 5533652.177 5340400.095 6840553.124 5548316.435 5731169.613 6531014.277 5392055.596 6351012.571 5831483.514 6950206.847 4804400.628 6902672.169 5537829.16 4282422.836 4857897.076 6784515.289 6381047.243 2624269.62 6194720.201 6278686.413 7961671.364 15197373.24 6451476.131 2216287.993 3808128.511 5471248.069 9662303.901 5172273.583 6253276.244 4740776.22 873330.3317 6058508.776 6088682.976 6631578.476 6725398.473 6101432.425 5595161.346 6260067.434 6102233.719 5946592.202 5819142.453 4223734.592 4494378.893 6886144.808 4193422.268 4918639.993 4809521.919 2557583.495 4770523.944 7859244.152 7172840.65 5456830.116 5349243.855 8878437.374 7314084.031 5455593.695 8251639.664 5814982.453 6921314.984 5252151.752 6242619.474 4674312.115 8171996.876 5189504.269 6617101.714 1363620.797 5862864.693 4790132.404 4161426.411 6851984.466 6249261.837 6202135.959 5248450.721 7082504.31 345248.8914 3505627.248 7645091.197 5958239.589 1366839.573 6313643.939 8978953.727 6400355.503
(−)-trans-Methyl dihydrojasmonate 5508834.595 7189481.896 7787246.475 6470689.252 2384388.868 2668453.2 6663671.896 7639564.893 5629556.683 7544562.756 2510152.521 3475516.493 7964768.249 9083862.227 7353017.486 7302504.96 1007826.379 1350608.338 6833652.041 7831408.266 5122098.77 8014516.86 1670250.572 2117062.207 6949260.144 7249658.217 5186537.942 7879077.84 1422983.86 1334827.051 6635302.879 8610537.883 4821093.234 7648787.643 2574460.23 2414331.37 5494031.04 5640890.61 2732159.433 6609700.817 5378036.02 5978641.029 10725903.11 4819908.132 3570014.115 5722476.727 7818030.603 12830320.54 6705843.58 8713066.667 5958234.876 4760854.555 10136683.51 3449866.837 7056703.261 4196949.841 6012141.14 12647012.29 3385270.039 7065888.923 4833056.779 5444870.118 6498837.419 4628694.856 7069537.023 5109249.678 3229689 3477381.343 5357892.304 3689876.98 4304993.556 3666817.888 3119326.98 4165818.141 3798119.126 3908412.889 2180166.487 2692573.763 2415092.907 2113799.118 2623346.232 2447855.966 2613791.097 3144350.919 2942756.71 2226105.233 2448398.871 2229976.622 1664391.21 2840431.719 1617744.849 3096217.255 1865178.846 2921127.051 3471941.682 1779782.692
({5-[(2S)-2-Carboxy-2-(trimethylammonio)ethyl]-1H-imidazol-2-yl}sulfanyl)oxidanide 2358383.808 2511887.193 2148696.662 3482958.062 2576071.117 3674397.006 2105940.318 2670782.227 2994752.564 1813748.235 1350669.68 1535619.505 2407196.511 2163548.217 2934081.337 2725046.245 1365798.364 3125392.707 2216012.236 2652417.588 3074410.392 2586093.669 2305219.583 3111311.282 3322786.211 2882466.07 3914883.125 4401289.159 4491906.908 5726209.181 3367146.657 3011851.789 3240213.65 4192043.556 4565923.811 7047458.075 3603040.786 2292204.172 3358537.557 2743319.074 2869997.733 509717.2675 401765.787 2848214.071 650654.2025 3880302.891 2116613.696 1041978.592 3496824.306 2926268.669 3475732.07 2235039.49 1335034.162 2750331.04 2855585.711 2308148.721 3707282.156 2630345.097 3235323.16 3092189.731 2968870.803 3928933.386 2586466.388 3970187.491 4006290.696 3781196.767 2738226.277 2773421.757 3796241.066 2746866.742 3485489.362 3263300.223 3676359.321 2782887.601 3120277.543 3305562.638 2860480.074 3573531.818 2824035.127 1959865.778 2710592.737 2947745.89 3037737.239 2531375.986 2419256.269 3070390.749 3363944.914 3697424.871 697714.4639 2855740.443 3487306.254 3603794.853 1526206.012 3225093.681 3726578.179 3757601.586
(+)-10-Deoxymethynolide 249681.9095 186560.2511 182156.8145 166983.4966 163874.0374 185786.4028 211909.3913 222402.0272 208319.857 184046.536 207882.0105 175693.5976 232999.1939 187568.0918 221184.9407 167800.6253 193175.8867 235031.7162 412373.1501 361204.6715 459937.376 820619.7813 708492.0893 238761.6939 15776447.86 1404809.679 2421165.301 4818307.638 1136417.79 696187.9245 49038326.83 14543415.3 6228415.706 9348794.363 4484556.848 2361972.293 134049.0163 126209.4628 169932.9255 158783.6455 162282.4592 245202.3153 227856.8865 190673.9359 132513.6763 198341.4031 306477.5199 210572.9686 231544.9114 510571.1457 208614.5667 2647895.664 496196.7852 251587.7358 725435.5903 435300.5502 5028705.253 7993453.229 18792006.15 860910.2772 550097.7558 51743258.71 25999875.85 22973429.42 5113576.92 2805141.185 217569.2911 243133.1888 204198.6088 178704.0293 290119.4099 218678.6589 231927.8609 190294.7447 316325.8604 247151.8303 737199.9311 422744.0646 512366.193 168950.8082 693848.0745 1058909.393 1104007.943 1502663.122 578485.0065 548355.144 475723.0535 550459.1063 168546.4641 501058.287 814368.8719 3381378.344 237589.576 2987871.391 1049909.586 2237374.419
(+)-abscisic acid beta-D-glucopyranosyl ester 1015918.643 2058430.014 1376040.758 2932941.475 1171951.411 1043006.67 1409904.779 2499920.364 1131308.53 4114017.031 2467381.762 1781112.223 1750708.922 2793592.428 1115257.963 3305488.051 2908307.521 1851114.679 1543408.016 2196649.901 1248772.423 4771714.642 2108218.94 1825203.232 2109080.454 2120994.972 982743.3109 2336974.855 1647603.009 1310105.25 2272829.588 1019794.819 1043950.334 2204047.82 1065795.549 1508034.517 7466165.621 6987324.958 10498910.76 17646188.61 9347215.162 11173308.95 15651538.2 10141208.37 3758375.299 7929132.838 11336771.45 15435563.96 10643698.12 23287068.27 9680045.405 7291655.183 11398881.1 8819421.805 20451628.47 7823884.928 9010159.88 11856703.39 7605965.025 16159584.71 8536748.855 4847552.338 4628804.777 8561019.995 11424914.58 7903616.027 1556220.966 2199264.648 2300342.763 2246770.585 3460343.581 1527997.786 2501524.694 1573735.916 2698855.344 2227411.065 1512820.984 2300955.722 1619839.857 1189420.558 2392554.716 1342842.562 2377984.552 1944170.461 2458277.335 1560637.291 1287086.019 2014673.159 54440.63004 1409550.41 2524393.108 1512698.772 351838.931 1374906.224 1986397.398 2334375.839
(+)-calycanthidine 449558.5578 657297.1324 511510.0772 539844.4144 485958.0566 455594.3891 481111.7028 560754.6355 725910.7654 581339.5415 618635.6531 1351833.104 4123826.011 2449254.72 3224700.936 3318816.849 3042768.37 2564682.051 6642871.643 4547126.134 5763525.114 10322497.84 7529229.677 7118578.835 9791412.325 7328402.825 5757691.301 6964237.063 7472140.658 5171277.396 29290645.06 7769589.119 7424923.432 10474974.83 8638722.433 13276492.57 730979.2066 602503.438 670392.4959 777038.0573 769561.1608 1886916.35 750163.7221 590267.0843 321506.9545 860660.0144 2229043.447 3208595.881 1167703.239 4012688.582 2440947.056 2841346.86 2048179.172 2124761.082 5624421.219 4473354.191 6988354.181 5571320.935 6879394.511 5328457.866 4672959.148 22223063.09 17229839.25 13278672.04 7238562.949 9131552.189 1694020.83 581322.7324 1030709.205 514731.3904 1002273.078 3323052.435 2657672.983 2458553.143 2835427.955 2401479.009 10782444.57 6149252.46 10873670.71 4736573.617 14677433.73 16043575.45 16505314.28 20996027.6 25560661.79 17110756.94 15447676.57 20509563.45 1309887.723 18304005.38 27379798.85 21061147.73 7395426.71 24991215.96 30891816.46 30710015.3
(+)-castanospermine 2473615.741 9571257.688 3975944.701 4388167.115 1903054.576 1938737.864 2496919.409 7874347.182 4206300.377 4298561.065 3500582.407 2068331.533 3896526.498 9661425.522 4574683.288 3200471.429 3240711.623 3062474.981 3264791.318 9147408.709 5852534.673 7710529.197 3104312.544 3361434.981 3761182.611 6488417.181 5288264.009 4344407.307 2888726.988 2751352.988 4303451.912 9034410.533 5646852.45 4501475.705 1617389.021 3355022.813 2181761.851 2426956.069 4103134.564 1629938.283 4635227.44 1948002.098 5266487.112 3675435.117 156598.2268 4270332.023 2494749.285 5716338.429 5011901.842 1892655.172 4821938.474 1982516.081 4166609.015 3759348.308 1885601.347 5083210.302 2267885.634 3850397.685 4250109.83 1566513.641 4466500.888 1692952.027 2373501.382 4633693.652 2081049.134 4516526.075 847512.6658 429203.5636 1706426.065 3251064.941 1682871.178 946782.8931 599339.6623 1555316.841 5070262.031 1489934.837 957968.7776 766548.6399 1735921.422 1417573.558 1847636.34 925413.34 682232.1761 1808624.322 5135773.061 1137000.979 831482.4041 636868.8349 94726.62631 2296900.595 1861654.368 953558.8147 140746.9072 1235389.551 4645633.031 2209857.508
(+/-)12(13)-DiHOME 88153887.45 136430540.3 56879986.93 78764290.46 55513091.58 101047152.6 114982267.7 138134561.7 63816724.39 93929009.39 83102798.82 87472783.26 163575833.8 161953641.9 32165534.49 86437617.72 77223236.07 104827034.9 154788347.7 160136369.1 74211722.81 156089314.3 74193377.06 102413472.6 155312993 158265181 36297530.58 112703549.5 69503128.36 88479092.23 148953081 167666285.4 93303252.17 108210128.2 91756402.8 121868580.6 94388070.67 41183218.43 70186698.47 84755373.61 72207625.18 128821086.9 93950075.79 70966051.16 18496533.58 99493336.06 142373463.1 120202624.5 99476109.74 115460678 120989924 117716039.8 108287749.1 83737917.75 134696403.1 116033112.3 156753340.3 114561212.3 92791326.25 114517468.8 147886424.8 131849463.6 79247544.74 109868265.6 134040176.6 162423730.2 52357274.68 61194649.25 55765684.5 43327444.46 55985405.89 57497352.81 70686589.18 46059424.54 94096029.58 60609883.32 64253641.58 81643420.93 63984512.28 48285432.15 72937569.59 94857629.97 82394758.84 77277258.68 106013871.6 57036409.87 83237961.16 84128168.5 4958522.564 78683688.1 91095671.25 84521378.29 22508141.73 75386062.85 103875496.5 104042179.5
(+/-)12-HpETE 3043854.99 2078409.38 2813570.514 2796613.19 1965222.344 2962881.992 2409141.163 2160463.128 3700034.794 2766611.077 3205892.006 2625423.035 10299449.57 3765029.848 3246811.887 5727780.87 7125835.714 5010762.358 14839630.81 5351484.478 6099149.304 27643882.48 14418084.43 25130840.25 9718947.778 6311082.355 6271613.685 12798673.73 6909245.14 23735869.53 9967608.062 10758008.24 10266734.57 20992351.73 8117385.403 41847098.99 2012372.951 1916177.859 2766577.127 2066110.138 2251157.612 2402125.554 2209520.382 2088432.758 1545398.492 2495182.049 2509955.108 3793611.477 3069805.493 3398102.352 2592701.11 3009872.297 3622236.092 2868817.347 4532670.279 3448910.807 3941682.715 4728914.259 4190904.842 5502027.081 4947871.51 7440651.566 17045728.04 7222741.099 3882434.298 7953527.655 2888370.948 3879181.844 3441876.888 2151394.885 2672957.85 6850363.681 5945881.525 5550725.691 8212338.627 6293157.108 42528079.98 19359245.14 38671677.35 28242604.94 60035723.11 89032021.29 136496497.1 150374696.6 139724096.1 93426192.2 52649488.55 59880401.53 3798947.322 90802891.87 91244563.07 20856869.76 9829570.496 30687058.54 96765377.66 45435352.39
(+/-)9,10-dihydroxy-12Z-octadecenoic acid 24777542.45 34564402.67 13339763.59 20462270.13 20525404 26632638.86 23750272.55 45255509.48 14225822.21 43662968.82 22958412.65 33209365.05 44664163.77 44442436.11 15987135.43 28444346.01 25640298.89 39094355.84 36175740.86 45548663.42 22991295.49 63238940.31 29654590.69 36225445.67 37364189.31 36889432.69 18640120.45 32930819.75 25729054.11 32105921.13 39702179.7 50138054.34 22330884.15 39110204.53 18819946.78 38632499.36 19478371.01 7057701.909 10979346.12 9288871.271 8038414.023 23523762.79 15075672.01 13699622.3 3288348.721 11127325.5 21954432.21 13511079.16 13227886.34 18759969.78 13882282.27 21647382.18 13534460.39 13327499.63 18304251.16 20109032.6 22156952.58 17001343.76 19218874.81 16107073.2 17894105.54 21671121.02 14366112.25 20732050.25 17542009.84 22713278.92 7277653.019 6303521.948 6317382.47 9169945.44 9561569.017 11933418.61 8821478.004 9427881.617 12411216.78 9720223.898 14704517.19 11648671.79 11153986.28 7556446.443 10961858.34 14055174.94 14609693.38 14248905.29 18080397.61 11288552.03 14062605.12 15621131.75 1251657.503 11526390 16132407.8 18607707.85 6698440.022 14073703.97 17513488.91 17829294.25
(+/-)-Metanephrine 745139.9554 2294269.261 2531176.468 2294410.451 2004440.452 2499829.718 2687205.072 11141818.5 1940562.594 2100408.303 2057200.586 2920441.624 3122848.439 22539774.84 4294434.544 2918281.902 2886624.199 1446743.922 3343265.235 30591771.98 7799288.961 1934340.981 2487994.552 3357791.839 3777118.65 19456385.78 5968936.244 1173648.225 2401359.555 3635865.708 4172654.43 22135162.1 7103137.905 1215022.785 1631865.947 4588158.271 1509604.994 2339113.017 2353829.626 2976333.726 2699960.593 4731527.733 1326690.077 1826472.418 1686644.774 3018814.757 14734829.14 3118512.917 4587100.224 10532501.68 1906805.085 12165311.16 1140535.164 3819287.471 13509800.42 2573285.734 14375851.97 1645625.547 5491835.704 10490716.48 1926065.241 13226809.67 1754611.921 5277396.934 15728748.05 2535895.21 2157257.113 2057980.959 1926586.128 1973917.189 1805524.155 2050166.965 2117121.879 1572779.118 1668100.457 1629288.644 2651391.233 1820485.182 914549.7813 1917648.403 783813.8547 1662841.139 2107640.929 849441.8457 2522906.906 1693283.773 1823075.633 756943.5322 1786261.109 700797.6349 2016301.135 1929282.142 1200299.649 1550652.455 1634113.137 598846.7625
(±)9-HpODE 14928630.07 15030972.41 9839808.927 11888840.67 9125762.401 9612712.517 10490590.34 13561970.65 10958940.08 9907494.084 11061150.89 7381296.742 16961350.34 16197401.52 10070850.07 12875684.98 11666728.33 7393329.39 18641640.95 18086500.8 14065750.44 26238832.73 13492721.11 19938015.27 30224220.76 14749801.55 16926209.53 27581008.25 21041246.01 14282520 69614792.05 51580535.81 29327783.36 57728867.1 29780862.71 34587858.76 9136178.185 7603142.584 9334901.091 11598143.27 10880381.23 8574847.888 7229513.287 8527138.878 4424481.402 12138269.71 12577329.08 12095827.3 9825901.535 13376220.07 13488558.48 12390240.51 11665589.44 14878944.54 15539447.28 16135607.87 25462522.8 15489592.15 27240335.47 21328813.52 19541629.78 77944073.45 45838363.15 56567542.38 32333528.14 29248114.03 10898324.31 10884354.27 15083946.15 10162606.05 9785831.05 7333094.748 13825829.6 12712172.53 18179376.21 10654158.86 18900956.01 19526059.35 14593257.65 14975045.9 10914539.6 24246068.69 21787961.23 29423445.13 28446452.36 23397101.3 48278602.22 20493071.1 5282804.314 28226393.69 38099356.77 68079417.37 26890941.2 67806979.81 43394546.91 53463064.37
(10S)-Juvenile hormone III diol 10088421.21 12376866.68 1848188.581 16346920.65 17730787.25 35746843.92 8465907.29 10032836.83 2088555.42 19650238.59 31379121.55 41548718.65 12506812.18 12695007.79 2682313.466 12680710.09 26693905.99 57214036.15 11705582.64 9190833.859 1673178.554 20246904.65 26897413.31 49210316.8 11215841.5 10071557.19 1509578.796 12657163.94 21389816.94 32128340.37 9473165.667 11418255.87 1954363.161 11520899.01 15497797.72 36633960.75 10365645.47 3905228.954 18707166.41 6109542.017 7442798.219 11750010.25 9554875.25 13062901.19 715341.4117 8466647.779 13038951.02 7426010.915 16976432.63 7356559.944 7472422.614 11802559.55 7548578.045 10267148.24 5315195.76 7043160.431 9415404.862 6593115.646 11248188.33 5221188.786 5354296.902 5176467.869 1873843.982 11865771.3 5582132.702 5923115.336 7060485.172 6409987.75 5233370.445 3731255.645 7237477.136 6299531.873 5460115.966 3571991.856 8273427.265 3308671.022 4543297.23 7048200.136 3338436.376 2051045.001 3689460.863 7194524.427 5907594.625 5249137.833 5708311.836 2007723.511 5970254.368 5124301.173 110638.0266 1893454.03 3371325.649 6154540.483 556979.8489 2527811.119 5935317.554 5859834.944
(12Z)-9,10,11-trihydroxyoctadec-12-enoic acid 5198344.784 5401301.198 4518639.851 6170613.719 5843865.612 5249571.027 4957937.641 6490855.729 5849601.251 6562678.877 7257097.39 5833953.444 8988927.994 9292272.142 6961125.029 7095399.861 4784493.809 4163669.106 14294170.33 11875495.34 11593142.16 17896041.69 9904242.507 8092149.004 43060679.53 13349976.67 17601293.82 18694037.29 14992827.55 6600108.988 110022908.8 38697160.57 31509300.36 35342315.63 29161237.49 14432229.45 4750226.601 5418126.441 5916753.819 4704901.223 5935144.756 5685505.919 6907735.905 5499025.59 5346102.267 8231789.759 8876353.74 7850804.88 8395988.565 9634223.288 9528018.11 19695036.76 8727259.183 7244023.071 12835714.56 13050104.99 39616711.9 19886330.7 22890035.64 12527272.79 15937878.21 112003220 47659678.31 70980674.42 27667516.63 24883142.23 6228648.596 4527399.095 6566682.254 5436319.537 5757638.302 7928119.744 8436571.954 9151739.371 9062235.608 8668468.849 7690555.352 9502720.568 9535481.153 9330300.185 9771071.656 20071277.16 22373489.77 28317043.92 26368371.24 18999938.57 21050603.5 21322808.49 3913651.972 17645876.91 27142111.53 38615918.91 9676638.363 33409148.52 28658498.08 36019090.8
(14R)-20-Amino-1-(3,4-dimethyl-5-propyl-2-furyl)-17-hydroxy-17-oxido-11-oxo-12,16,18-trioxa-17lambda~5~-phosphaicosan-14-yl 13-(3,4-dimethyl-5-pentyl-2-furyl)tridecanoate 11904238.21 40884626.48 21484061.7 31232100.78 30731609.05 40542337.81 2394416.393 20640790 20409970.06 11283484.19 15023249.85 6480655.536 28150788.17 36251660.48 18587400.86 31587713.53 32033959.23 40283307.9 14412374.3 28386228.57 32934882.09 36133149.34 26526011.82 35426262.66 13222435.25 6650457.343 11876863.7 16806823.67 18788036.75 28745507.06 15767488.32 4656867.236 30378912.12 20074235.85 6471115.93 44869711.97 33269073.76 28050516.92 38033885.24 15002668.19 36143846.38 4619000.339 20202152.68 4758884.889 670371.5043 10430756.94 24121069.82 29790901.85 12797280.24 7535750.235 32254128.12 4906759.092 9851862.253 9046823.789 14793088.39 16660625.32 10371384.26 21258909.87 5247634.855 3083605.85 18604461.64 12592431.42 11518906.59 5116062.492 40418479.02 19186454.93 20122214.78 18559476.24 52320954.72 17159031.75 40152709.89 19128014.97 25597198.61 6759986.081 18124667.67 9013432.973 5434322.147 25906158.91 25291508.49 3791923.917 17502695.09 3810840.046 24038247.18 16162442.01 11450706.17 5752241.975 7401213.754 17074666.24 1194868.022 12387729.19 9522112.65 53602794.76 4488727.883 9288539.605 20498666.13 26064987.7
(14R)-3beta,5,6beta,10,16-pentahydroxygrayanotoxan-14-yl acetate 64386940.98 51226600.09 65740614.55 48127146.8 97126285.7 46925173.5 49948910.07 61414748.49 106084112.5 96133639.98 28141745.74 78516757.17 45017339 65419251.66 73660816.16 37014210.01 64962773.51 71627297.26 54436919.41 44992609.45 61172119.8 81680986.96 56954114.97 53926022.29 75829998.33 70754853.2 114776254.6 87012728.61 72745120.76 86230865.15 21068818.74 31991717.58 27022931.6 22502602.89 32794947.04 26015972.65 83758000.74 30709960.95 111458427.1 68186615.57 89469815.99 50603306.88 41283557.15 79346874.44 12304239.54 66922201.21 80581290.22 68605469.88 58543762.08 97472363.27 68375400.77 52461778.26 77960757.52 46417433.99 69201148.98 55639061.94 68984970.53 74345547.72 99904193.4 102481911.2 74197272.46 28507331.54 20650287.42 26058224.05 19178424.27 16240219.28 71554636.22 89848458.37 51014864.26 45133673.12 54437966.72 66126446.39 52416769.17 72939603.01 63556495.62 89154645.67 98172537.91 102623751.6 52862387.04 35270228.44 81109594.84 60913484.28 57102491.73 69985990.4 54574523.92 67194383.88 97961867.48 76971903.4 4404935.523 39346178.74 101143996.2 20903647.79 4783491.44 35669083.93 20688314.48 14686711.12
(15Z)-9,12,13-Trihydroxy-15-octadecenoic acid 19201027.81 18794406.43 19926325.79 19402651.74 18896205.43 18470369.3 19345634.82 21777861.41 21993449.72 21585735.35 19702863.57 20259106.47 33876005.04 35578937.98 27184406.95 27809262.94 20091178.16 15188498.18 50185086.29 45168773.29 43043480.82 64922595.23 39621899.91 25032458.61 146154290.4 50913607.34 57885874 70427007.35 55239327.4 30537726.65 368888908.8 140224375 107293713.3 125415144.1 103601476.9 49447323.07 17603369.43 17263820.1 18502026.72 16688163.71 18990016.35 19426852.2 21450361.47 21048215.51 17933851.5 28870412.61 29883820.64 29365314.85 32124290.7 35599729.09 35324899.6 71458226.52 33046835.35 28890573.43 48032133.91 45103909.58 130690809.9 68583026.33 88157481.3 55736534.76 54343458.04 332945663.2 150924130.5 259735356.2 100667985.3 92746424.22 20614677.4 22288032.13 22683273.59 19023351.71 21733570.72 28463307.93 27977502.64 27796531.64 33523878.06 30117243.49 31692236.82 31594464.2 31851735.66 31357459.83 32169299 75105822.12 75317940.99 111739355.6 97975172.29 72021435.31 73106921.09 74598832.15 14978851.77 66630627.84 113884041.3 140138070.7 32054448.13 118981534 107830997.3 140786819.8
(1E)-5-Oxo-1,7-diphenyl-1-hepten-3-yl hydrogen sulfate 2175205.995 1705422.507 2884091.86 1589599.504 1788926.48 1727222.319 501686.7925 1869588.278 2370455.337 1629131.394 1725996.119 363719.3171 1625374.25 1122915.061 2375104.235 782906.5035 1971434.165 2083725.953 1268954.151 563606.1749 2035118.892 3774176.883 1628656.748 2132148.246 1031195.027 2384224.043 2637532.018 1414481.14 1780636.129 1801642.82 492485.8402 1645937.934 2996108.145 1608244.856 906250.2087 2939759.876 2318840.355 138594.1388 977706.4891 1009076.63 3213195.335 704014.3315 769080.3535 333391.2496 221022.3644 2797702.736 3225841.46 1260677.171 2526779.605 4014737.408 3443387.704 1825826.492 1667676.018 1214294.4 1515993.069 1052284.544 1327410.117 2045501.288 555952.1154 1725475.604 1780363.247 2272098.939 900216.6011 1776202.133 3208635.022 3187792.297 1938016.033 1719748.419 2586265.401 3934203.908 2101005.362 2232877.97 1061774.499 1849010.024 1863511.956 2231323.515 1404953.486 1797764.187 1625311.49 729177.1 1650546.83 1223887.284 578862.0955 1491246.201 4779809.327 1237552.179 503812.1065 2044810.513 79395.23164 1498085.436 2248807.838 2756432.307 97078.88838 819844.3774 4405567.873 3374947.69
(1E,2Z)-3-hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oic acid 288303719.7 343982607.6 19524496.37 10552832.21 73941204.03 51947985.59 130906645.1 5362392.117 2516168.28 41197831.89 203449081 3938050.123 2339099.511 7787232.307 47066711.48 146307982.9 278137027.3 5242047.888 82481885.65 11289555.86 1815832.51 105489065.4 8295473.063 4209498.356 1915138.172 12028604.49 131175409.4 9919004.063 8366710.057 10503647.03 1362070.004 12452479.72 1955874.222 8416643.918 100782841.6 5546775.272 200689284.3 2624676.642 369645252.9 240731898.4 194307791 39059204.53 5943403.417 261783100.3 84642693.06 120486830.4 18687679.28 281941313.7 219789778.4 206465419.6 308683368.3 154446475.7 115240873.8 15643769.41 2975537.952 4397791.227 16857317.14 8477844.849 1735294.76 97286770.81 6117276.062 2117883.22 2147299.996 1339123.005 1896450.185 96796913.34 2563152.45 83545148.43 455040398.6 8383604.774 104972388.7 255094243 153675940.1 92786052.96 2720963.513 6280938.393 106245663 115295340.1 409589056.9 1367109.943 2074022.321 1741048.51 1657299.994 11438923.32 1794425.44 40188137.96 79221073.85 62069689.84 1252426.545 1153896.902 13277456.57 1382557.782 8865978.034 9628674.583 34887862.83 20941769.52
(1R,2R,3S,6S,7R,9S,10S,11S,13R,14R)-11-(1-Hydroxy-2-propanyl)-3,7,10-trimethyl-15-oxapentacyclo[7.5.1.0~1,6~.0~7,13~.0~10,14~]pentadecane-2,6,9,11,13,14-hexol 1327788.609 1643748.871 312958.3389 321101.1487 603299.0431 490336.5955 823927.1082 394916.918 289109.6701 738452.8158 1035345.188 339709.1812 291856.7487 938763.103 507032.4652 965488.4058 1551472.639 540913.5262 832843.0161 531829.7084 786656.6892 1179295.543 471099.9116 503636.3061 5792469.722 479340.628 1114494.999 1333720.375 1356342.922 843617.8607 10941047.05 2807334.14 1871045.037 2013803.469 1567863.433 1603326.878 1090182.359 246245.0274 1585581.875 1163370.249 1001736.593 402387.5374 282745.0609 1284811.961 567004.1834 757038.0399 408834.1073 1707517.417 1253930.648 1186957.945 1590828.862 1172691.453 1363661.8 358692.5633 330620.0566 294961.1396 1431722.244 3616016.148 3646262.598 2537731.334 329580.7704 10194095.55 5247462.891 10305709.17 967151.9148 1067694.312 266051.4393 713136.9417 1965098.076 249478.971 708014.0657 1658943.253 908875.5339 630908.6071 290578.5101 269996.4369 893739.4425 972130.9968 2076020.633 252660.1789 300905.1672 297083.1705 352908.6555 742949.0725 1150182.426 1325837.829 940332.0368 2128361.688 284133.3365 270270.6557 862075.4173 2678495.691 281884.032 1090012.369 714661.6915 1152511.366
(1R,5R)-3,3,5-Trimethylcyclohexyl 5-oxo-L-prolinate 6487927.237 4860628.018 4789529.782 7239801.203 9756393.773 12501895.81 7577440.643 6837456.146 6739468.852 8957730.705 14609419.62 11882032.27 8557725.259 5485262.886 4416796.31 7337881.779 11127213.49 15063572.33 6302870.733 6291960.047 6037878.878 7829600.598 11148596.41 15140602.82 6909421.851 5551464.976 5267873.855 6329961.688 10344491.42 9929674.444 6308321.823 4368842.58 5042142.612 6406746.955 6987630.576 12057499.27 5625615.48 5032539.831 4760116.264 3897205.027 5519178.167 5328294.197 7571250.595 4400128.875 1789546.652 3579067.932 6236530.067 8260310.111 4829729.592 4675239.507 5067495.922 5798032.037 5821381.218 3920241.596 5050200.067 4362795.504 5029577.211 6564558.361 4157307.994 4656262.003 4794181.474 3320160.985 4098953.183 6381763.093 4672342.517 4497614.979 5920968.531 4329231.95 4836964.709 6389661.74 6851363.249 6375931.247 5974366.195 3943637.211 6462020.495 4298928.034 5681697.889 4931093.188 3486233.147 4289398.964 5212133.133 6586287.23 4451950.789 5745281.041 5629614.261 5170152.904 4574485.811 5108494.355 644772.7883 4497024.621 5356968.137 5374677.538 2029650.196 5794444.953 6497394.894 5723619.083
(1S)-1,5-Anhydro-1-benzyl-D-galactitol 51180.33426 52948.28823 51813.39195 75987.31127 46075.04429 55758.00596 41172.28719 120088.6179 45841.14674 42138.41109 106253.7322 46651.3935 106346.6606 51433.2524 108389.277 66055.04504 63629.42855 50855.93728 182418.3802 137111.9409 82335.49068 214164.5864 122523.1769 49047.88247 1131987.247 92507.39904 266513.948 330296.6696 84014.59618 122849.2675 1799756.919 474527.3528 367899.6378 385647.2794 229929.2453 211597.1117 50341.40396 79431.89422 53131.93153 48005.53647 51716.40016 169614.6573 212134.5984 45388.63184 32455.14353 43565.15202 70671.98767 50951.73311 50769.06522 84324.88268 87113.09654 767163.1184 54572.65774 112509.6861 82956.8822 62841.26706 716063.5982 608090.2138 749236.0065 364899.4407 189902.9808 1753275.376 562330.1908 1140161.104 305608.4267 179548.4195 116074.0892 106482.098 50764.03768 152457.5649 46623.69667 98921.88452 44705.95174 54878.3577 145545.3963 175387.6148 46917.81045 82756.79546 109016.0917 100021.4315 123551.8343 119107.8577 126650.7798 171285.0622 297355.6026 207942.2929 164432.9132 325622.4154 70228.98757 466463.8089 297037.1165 456424.1481 122641.8267 173756.5349 147302.6041 207812.407
(1S,2R,5S)-2-Isopropyl-5-methylcyclohexyl 3-oxobutanoate 1622433.893 2331775.142 1278846.807 2070342.809 1218748.612 1145125.357 1145271.381 1613126.892 2319224.726 2566504.931 1434507.25 1279686.681 1606862.769 2641550.793 1771839.975 2083416.864 1831932.831 1788625.351 1922390.441 2382208.958 1490365.44 2875234.83 1461352.585 1544056.85 1503192.771 2466918.485 1539110.952 1479969.994 1470363.122 741983.2549 1597788.896 2081105.028 1054909.962 1998225.304 1243697.385 778034.086 3120715.19 1454594.123 3972667.334 4603900.397 1412998.313 4570209.607 2285748.785 3405902.655 2027867.294 1164347.371 4857785.135 2433499.861 3274753.87 4261717.837 1495623.784 2909660.321 2206938.216 2616623.43 6128358.586 1526952.357 4787972.956 2074812.664 3161448.318 4008775.72 1827864.172 2241257.584 1345813.445 2846317.958 4037270.204 1376589.411 694465.2349 680156.3298 636455.4061 592834.0068 737050.516 1088757.202 1066415.81 807415.4951 712310.3594 1297341.018 1412542.793 1483001.079 1105184.169 943074.7408 811706.9326 1599430.884 726965.6115 1078841.434 1238748.143 1286484.383 1358281.784 833836.0554 1200578.154 1421075.75 1285261.33 1051414.861 1261198.26 1325926.112 884172.2419 1784202.408
(1S,3R,4R,5R)-1,3-Dihydroxy-7-oxo-6-oxabicyclo[3.2.1]oct-4-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)acrylate 35155431.66 20922964.94 27672319.34 18172676.36 30735642.25 22469271.02 17257597.65 29619421.32 28947987.21 19682088.24 26929411.36 9274739.727 17938982.97 10364531.18 19992172.37 12894092.9 27615900.99 25751335.95 18407417.54 10635391.06 23931783.77 17759924.01 15979058.08 28363392.94 20476457.69 21993938.46 24018374.28 30440905.61 27826778.41 30905400.57 14725371.08 9243715.295 28520685.81 25581169.09 20771520.08 56885411.85 27449665.66 5883508.844 12525323.58 14402376.14 30440271.44 11433953.1 13536331.79 8748199.789 3678965.018 21590723.45 30167354.65 20085364.64 26696175.67 23099614.77 18615476.71 18843212.77 22146110.36 20757304.44 19802703.38 8986590.09 10838585.89 31721485.96 12937055.87 20217809.87 22953372.78 12923573.5 14341238.04 31585306.98 26617592.36 23749601.44 28132676.2 36986911.31 23614403.17 22651889.2 22280101.07 30220824.49 22338325.82 20941540.52 11825469.13 16392637.51 27960669.03 25234771.7 23383481.53 9267775.582 18197029.27 19308689.4 8188600.84 26440803.11 15988406.03 22781159.06 10028721.9 32903330.85 769057.7772 9065048.655 19669662.76 18681037.59 4147571.342 16636783.38 29915310.97 30289076.35
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (11Z)-11-icosenoate 49118965.87 49653581.16 50065823.69 49315369.04 31642636 38923726.82 59893959.27 52558037.91 61624059.26 74916829.07 57402190.76 41241654.94 115314689.8 77954973.29 68358656.04 79975094.88 56403468.97 59621637.71 89762636.56 57810240.92 60492385.71 119405889.1 37097490.79 44183382.33 86886072.57 62319815.04 49812601.14 62773147.02 31454038.67 38512792.29 84945486.04 79655321.12 58040569.09 71839583.34 37707398.09 48364865.3 83859414.83 33167331.68 61459575.84 60001580.72 52824700.69 103823361.9 82513026.82 67024735.81 11480762.26 51968484.11 128271896 98368725.5 73643437.96 81050441.37 74052291.32 76095224.81 75954657.51 57017272.28 65932716.72 58137197.47 81458545.65 68706919.52 54094757.11 67018347.18 50360856.85 67481097.13 30705974.41 47898618.14 50787285.49 52627849.44 37994974.21 49948574.65 53958294.12 41593683.79 56421462.52 41824126.37 47586301.95 49669939.81 54447719.79 35563560.48 50012691.28 67199085.4 59465943.98 21893471.66 42791165.09 53842507.79 72274359.48 79967731.95 65664612.92 32270970.88 53654114 57257995.61 1918872.239 29697885.57 44999913.18 47821548.56 10551551.18 60904653.06 55081049.96 46302365.16
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoate 9704032.873 10205213.57 9121287.477 14444040.09 9406307.769 10577058.59 15820052.73 10351104.93 9646037.203 18377461.94 19014970.27 5333528.787 28388049.34 14915588.29 11528464.42 17716584.77 22580816.5 14314002.29 15345958.51 11477792.4 11899844.36 22707301.91 16945343.46 9554246.653 25460801.47 14553790.51 11918925.5 15160227.89 16043286.34 14170975.36 44203712.48 31328954.24 42294999.63 38604935.63 40621590.33 60854521.36 16391914.15 7415687.742 8976512.586 13481368.33 13385439.17 13995796.43 20758415.42 12522102.13 1838635.791 13695803.8 21515043.7 24554303.21 14816689.32 14884544.11 21131183.83 11115160.02 15492367.02 8104629.161 13662522.33 12942037.14 19861834.12 17285784.01 12878464.85 16277167.36 23661476 31138979.39 21405936.2 36473086.08 24856739.93 36165063.23 21313543.35 21839570.32 26578766.38 14421839.92 20893758.2 60271839.79 57576155.76 41329426.89 48528326.24 36903536.23 76228279.79 100394975.3 73674641.66 29070541.68 43679355.47 99387829.82 117682969.8 100055643.1 79517017.64 40153049.27 109812250.7 105775772.5 4353248.289 51832759.73 58503487.06 80671805.27 28919319.55 87459962.06 86355311.18 71798373.53
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (7Z,10Z,13Z,16Z)-7,10,13,16-docosatetraenoate 192608212.4 348041308.9 171952048.4 256486635.1 282232605.9 255963293.7 195117993.3 203804809.7 145065054.5 243836154.7 403472384.7 291931875.6 50869181.15 206023396.3 118980123.6 179939659.1 367951376.8 272559949.5 118276759.3 134611409.4 94676386.61 165289540.2 256372611.5 230669101.9 115246249.4 140665267.1 91060234.22 136928815.2 235499663.1 210585401.3 144745125.5 155771448.5 168272502.5 218346174.2 298741657.4 276153775.4 542905119.5 505891391.6 443478694.9 613614235.2 490893501.1 372757726 442423318.6 405866950 108594335 297316146.5 285693382.2 333029483.2 260693830.9 209899541.4 220494807.5 143275581.5 165146123 111115611.6 141006789.9 112929044 160269246.2 166891151.5 134737846.9 229244446.4 123388524.9 148005495.7 141054842.4 175314138.9 177844853.2 167425491.8 293877731.6 293188508.3 286140079 264685986.8 277744117.4 289021015.1 149174399.4 238736119.1 230022060.7 220299788.2 332506678.2 329156997 103451332 138111083 216058725.5 328045860.2 436763624.7 286532679.5 225697211.9 180938771.3 307142077.5 298266292 33242239.94 200136235.5 209236944 251176264.8 147711386.8 269815956.6 241172949.7 70358796
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (8Z,11Z,14Z)-8,11,14-icosatrienoate 18490980.73 18975024.44 19969238.07 26948726.84 20421047.22 16619780.83 28217587.21 22680140.69 21744768.21 32722060.07 32228543.65 12740367.58 49494713.13 32546120.01 26024417.05 33893543.01 39517138.08 26276013.32 28519902.36 20752497.44 22280159.16 43209386.4 28997888.78 21804326.68 48336953.61 32856384.47 29009085.69 35166607.71 24265634.84 25254412.55 74755454.91 63874696.08 65621131.26 65321220.77 44109025.34 74895133.09 24256141.17 15897441.29 20277485.84 15235366.18 23629661.21 23120078.31 35735849.6 25783999.19 4105163.625 19740895.1 41777833.09 45231939.09 28326847.35 29716838.7 30228714.86 24404492.15 27309672.14 19314367.04 24247246.61 18817469.36 43152571.95 41505455.69 35252119.41 35957731.68 41176263.58 68069894.15 48338758.33 64640315.17 46929545.91 49069156.54 32521037.9 34290821.62 39943934.66 25180165.54 33320572.47 48105466.87 50130107.28 43636718.78 53575599.86 41510730.42 55126849.64 81836759.02 63189868.23 30221291.47 51230872.33 95285162.48 109648501.4 98768064.03 80476177.48 47389209.43 87732375.91 98019628.84 4993748.346 58808529.3 80667424.17 66298488.6 29274503.05 82091449.99 84473322.69 80627772.42
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-hydroxypropyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate 9108112.252 6341840.138 7188821.714 9630908.929 5208566.773 5934328.521 19688743.24 12943476.5 10821675.71 14667343.23 6643740.287 5223114.591 37666915.02 17271399.19 11910439.6 17028007.63 7294725.737 8108494.282 25215202.37 19967477.18 8184464.489 22519943.89 4809823.228 5928952.447 36202932.6 15839247.12 12486707.53 16508357.89 7130662.094 11842058.81 53383039.86 50851708.54 39514275.21 45951020.47 26226048.77 50853490.39 11928893.62 8261614.397 10577822.44 9333603.186 11918732.57 17995026.82 35881106.52 12794186.03 4343775.552 16165889.7 20512218.9 34038986.04 19173851.69 33777443.91 24351432.24 11003560.16 18141098.63 9394491.8 22815215.43 13288653.16 25880430.71 26552315.89 22277729.09 24352222.09 24735003.27 48338632.15 24813657.08 34849718.88 36024932.3 35220444.76 14345861.77 12680376.08 14886465.7 11103316.37 14290552.51 35934134.52 40120370.72 30271346.75 35651100.81 25884261.77 47225766.9 54582559.7 47043444.88 18975970.51 29759212.33 73503913.73 57275663.75 65457265.01 44120465.79 20352021.23 62582231.86 61910892.93 3161718.163 40823700.13 39757758.62 53400564.9 16525184.89 64158769.94 54567182.05 60867777.89
(2R)-3-Hydroxy-2-[(9Z,12E)-9,12-octadecadienoyloxy]propyl 2-(trimethylammonio)ethyl phosphate 874584769 2044583385 1327853337 1299867916 992095410.8 968957060.9 861450808.9 1080677309 856706280.8 1047190422 889354920.6 507763730.6 914196194.7 1069003156 803601128.3 912866989.5 1075043495 708822039.5 949149867.2 1184189577 834472437.9 1519649837 1016618667 497165359 1196498690 1157336433 943099433.9 942937865.6 836359499.3 609031529.4 1217727794 947120780.4 1187164541 1539071881 995636235.4 867872479.7 3486873418 2058727449 2633696633 3725183892 2589370963 1945125314 1969077550 1921386878 657854596.5 1568043695 2386184242 1991540411 1595519452 1879829872 1885127829 1765193946 1667607867 1293483920 2017999504 1551451469 2063336137 1636128756 1431854507 2096527602 1405078830 1531462318 1289229479 1684052053 1567024470 1510971276 1645465074 1792835036 1459937703 1446327310 1539791660 1256437712 1436939424 1244319983 1090812751 1158544789 1848198642 2374310941 1853668714 1046578552 1449241175 2223900313 2389625815 2268917740 2083984071 1263804907 1814067838 1794427863 98446933.34 1448265399 1622689465 1711499282 571607506.2 1614489777 1922324023 1529382324
(2R,3R,4R)-2-Amino-3,4-dihydroxyoctadecyl dihydrogen phosphate 1065726.85 1381708.995 792956.2275 1605600.896 841195.8085 2292753.341 1140689.48 555522.9411 845054.7542 495170.3754 439875.7679 998625.9476 994809.7757 592484.7094 739297.4875 422443.8092 686337.1084 485095.0956 506079.922 617887.7687 624003.7163 479508.0535 426804.6552 604205.4167 728581.8666 556812.2958 549252.3822 580529.7655 269031.4449 495156.1449 70715.51033 564745.4865 204838.4319 59099.62712 665728.9944 355233.8372 2281935.617 570211.3181 2096908.366 2158903.036 691694.4086 711852.5078 264409.1125 1010349.278 116301.8748 925305.9923 724510.5725 327737.5656 935722.1554 704699.7973 707700.0205 866217.5762 396964.8023 675629.7205 587597.7214 700938.3495 463210.1294 1439705.458 713995.6097 578305.2296 735615.6345 73255.84361 354218.5223 601523.7288 437639.1489 274801.9904 441231.6304 501451.8732 455389.6983 436898.8143 546771.392 1387933.826 1350198.657 832624.8995 534616.6026 710129.7472 1998155.954 2200701.422 1210298.341 376142.649 662874.88 1723134.395 1620720.769 1059283.337 312077.8758 512038.0509 2237003.72 1578969.125 66108.1944 342598.9441 751758.6747 1636562.811 293149.8275 741481.9715 331760.5902 620220.3733
(2S)-3-Hydroxy-1,2-propanediyl dibutanoate 342885.0306 471355.4451 331561.5442 463368.5802 465478.3508 588305.589 269064.7137 360375.4326 256605.1249 547768.7294 587311.6199 548480.2573 4046973.098 499738.5412 361688.1938 304795.1147 582658.1258 848859.3001 558882.5792 610636.0442 396631.5169 620402.8682 641998.1085 635611.7298 665480.5935 589505.7856 387931.5739 426153.7056 604471.4787 600083.1805 1325520.448 675393.7519 534056.0731 590868.6175 651990.2403 658228.3709 682400.2304 298355.7391 474726.9318 509775.1036 711423.3629 688638.1514 653612.1111 522945.9173 209729.7025 510599.0411 780346.1267 715891.8751 531978.4892 396417.657 464278.9711 687999.3712 467934.7329 625067.0829 431673.725 567991.2996 1025809.016 682614.1914 703009.5546 526374.2001 658824.1375 1347066.62 621696.169 971262.1252 707211.8248 474582.5671 299859.3495 499747.3292 424952.0662 284469.0583 302307.2771 404360.0468 492018.7781 325596.0159 332905.108 309618.4553 470560.7471 608795.9023 356268.4982 492996.387 406725.9062 362441.3844 508954.3141 457449.1578 540731.1597 538665.3025 494728.0011 606763.51 245483.1893 276218.8746 509776.787 734651.5178 292418.9902 564205.4384 440353.9409 618288.9896
(2S)-4-Methyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)pentanoic acid (non-preferred name) 14970281.27 6761877.031 11504862.2 8123901.144 8496165.408 9374225.499 5971943.733 7852023.045 8706243.329 6984363.723 10718765.03 4102044.979 6012407.299 5562250.385 8055819.419 4210323.3 9280625.021 7558887.084 7307068.119 4794047.276 8992980.544 9378995.233 7856892.017 9536727.58 9534467.754 10416294.69 9500319.272 9138385.578 9157764.565 10495019.72 5687358.788 7081262.997 13230352.07 8186343.7 10077508.19 11990319.05 8549181.431 3192218.697 6057684.474 5559509.271 11213270.42 4535411.901 5112737.284 5849424.609 1289001.714 11499088.67 8196933.211 6988620.832 12851947.22 10519523.82 8510924.885 5712441.175 7075036.687 6848478.899 5794180.285 6700632.78 4691889.725 8069996.537 6733597.157 7938741.614 7048584.714 6413504.798 6810651.648 9568327.006 9923607.737 11590210.91 8669949.751 10788892.42 9148170.628 9355477.348 7941459.179 9705271.833 7084543.569 8627501.904 7243404.875 6733177.495 8912359.357 7390907.986 7667171.289 3838364.976 6486041.842 7523676.564 5109297.225 9662594.307 12476646.74 8657611.718 5624346.875 11358101.14 522410.9441 4694542.438 9873630.033 11194563.05 2490403.291 6321648.701 11348646.8 13161783.6
(2S,4S)-4-Amino-2-hydroxy-2-methylpentanedioic acid 2210102.025 2172810.894 1995919.764 1952202.593 1887672.125 2051171.416 2175955.685 2146081.139 1970587.996 1738979.829 1957109.318 1781143.991 2176823.698 2052907.233 1950839.655 1387939.65 2483785.513 2235004.854 2444057.573 2342654.94 2675597.881 2412991.992 2326698.364 2493345.174 2602586.08 2403687.177 2412006.493 2423476.04 2171690.416 3205972.976 2555570.078 2857336.204 2630771.862 3212679.846 2199985.595 17051206.04 2099109.22 1859682.345 1997982.407 2238185.659 2150903.111 2158301.905 2322242.342 1954274.087 1214437.313 2165385.458 2090180.744 2192526.728 2057664.508 2374617.606 2282711.019 2360904.099 2469177.401 2281713.835 2494830.678 2393745.64 2431141.703 2520085.486 2291270.011 2488362.257 2576247.504 2843566.655 3207223.845 2482586.964 2729883.143 2731561.381 1816534.834 1920905.15 2226280.89 1762245.507 1916046.052 1870152.065 1896866.669 1820406.052 1908036.01 1694318.037 2341950.012 2307355.126 2173105.852 1287224.002 2263057.707 3028439.517 2542525.554 2531633.857 2239345.565 1672753.719 4262274.213 2639550.225 1323562.554 1422955.436 4868493.077 12566411.93 6249947.878 11563216.15 3853426.311 15264758.09
(2xi)-D-gluco-heptonic acid 44403349.22 45319766.89 16660640.58 9610665.99 24639589.51 19370352.81 40697077.56 15116892.19 14796717.07 10539994.62 39111441.92 9824433.533 45031849.43 24049569.67 10601459.27 6944613.092 21640154.04 6581435.109 30583976.32 15511739.76 4955420.55 6015601.996 13702318.96 2824094.677 34462626.19 21447944.91 3760979.828 2676179.308 8051191.203 3324185.184 29040278.29 9922548.643 5521591.933 2481492.884 3985769.794 2854103.531 25573916.87 26165067.36 18007276.34 25252004.73 18419240.2 27975230.96 25297197.41 15124032.09 215130452.5 15083210.92 29066487.7 28445985.2 14382625.43 32032861.77 12165094 18693183.62 22858102.71 10464792.24 18287046.57 9355973.095 16359805.81 16896257.12 8702053.816 15829341.85 7130161.991 8191083.741 21013221.32 6857474.659 11892509.79 3670544.353 16933331.18 16107682.3 22534909.93 18838686.69 23087369.76 3210389.496 2024764.432 3162842.124 1723449.121 2944528.063 2374456.921 3508851.537 2600291.269 4901884.486 2882337.197 2053061.763 2909231.271 3262461.589 2475310.972 2853569.957 2912098.766 3946074.169 12468787.41 5089416.462 2276048.448 2798067.886 19052224.24 3255271.891 2873711.342 3883905.051
(2Z)-3,7-Dimethyl-2,6-octadien-1-yl 3-oxobutanoate 411181.7697 379263.3494 128822.5291 613784.4046 506687.0941 445683.8161 479032.5635 487204.6025 242881.1829 559338.2678 1362402.1 753030.9459 925746.3309 833969.6794 676636.1824 682556.2604 1624585.978 1145733.572 965308.3292 1105428.716 1070621.688 1902437.711 1892540.377 1079729.448 1080202.859 1018844.556 942804.0854 1222042.934 2023240.137 1290787.77 1912183.603 1451564.615 1368401.268 1658638.383 1852434.185 1724207.648 296675.4613 172148.6901 393677.091 214428.6951 331611.7417 382131.0003 326883.5186 477498.759 183753.4143 527990.1877 616375.1869 633836.1887 760922.241 1562979.078 894070.4759 756723.018 605817.2707 636211.0378 2228081.925 1603614.292 1023334.868 905263.5046 739094.3337 1933964.144 1458367.461 929903.0168 984141.2384 1209686.359 2831203.278 1711135.18 367516.1929 222072.3404 202819.1384 107625.9476 201092.1841 663902.3094 317547.8453 770858.5095 574858.4842 529866.2867 984395.2741 837243.5601 1139200.344 272971.1696 863714.0014 918129.1522 777190.6436 1723396.443 726537.0532 813697.5014 1006514.598 521087.1445 60440.72059 456434.1378 1189122.509 1200865.747 226413.5933 1270655.017 808301.7533 1178912.62
(3alpha,7alpha,12alpha)-3,7,12,26-Tetrahydroxycholestan-27-yl hydrogen sulfate 12042301.91 10194944.53 14124367.2 9962495.485 14678066.12 11107143.34 10650487.76 14414357.66 12410666.04 11238351.87 10373878.92 27589873.34 10257535.14 6838524.163 9835104.703 7087299.038 9639943.324 14266030.22 9046125.436 10734261.59 10861715.59 7878321.428 6397615.304 10241200.68 12192782.55 10327384.11 11595788.26 15976182.88 15205253.55 15550479.89 39858547.8 7120541.12 13603215.79 12607395.75 15764907.23 27483149.35 9718046.862 5807107.638 6023225.208 11372227.84 11760257.8 3081717.254 12795252.82 8708818.727 2605079.229 11548762.66 27368387.3 13422163.79 12285094.59 15333360.56 12213311.71 12760443.59 12701235.38 12604913.17 13939800.29 9153373.273 9816696.804 14052637.87 12488276.33 11340991.69 11679155.5 9394601.324 8369847.844 18812226.21 21193934.18 14276778.92 11853377.17 30338120.62 10952445.98 10758628.09 11114586.97 14655581.04 13372055.4 8986528.504 20477083.6 14154712.88 16830889.98 19121746.95 11952012.58 7617107.899 9609318.387 17435189.39 9748543.255 13110787.61 11947834.88 12658702.48 10381405.19 15786192.55 646649.7109 5476878.925 11426781.35 10993269.4 4317231.998 8368170.864 15750202.54 5714912.568
(3beta,5alpha,22beta)-Solanidan-3-yl beta-D-glucopyranosyl-(1->2)-[beta-D-xylopyranosyl-(1->3)]-beta-D-glucopyranosyl-(1->4)-beta-D-galactopyranoside 8061901.106 6652402.327 6916736.168 7511842.203 6532480.609 7338091.455 5007073.43 4845748.452 5642097.929 5960054.249 6593355.575 5830869.315 4513792.634 5582415.799 3671854.815 3504854.17 5234636.261 5612368.496 5931692.701 6156234.816 3942212.413 6091657.712 5886299.783 6390588.174 5614365.016 6038307.813 5399903.6 7424741.871 5329160.749 6380407.429 7584389.273 3366544.813 7008193.743 6920753.451 8459922.342 13183043.53 6436078.886 2489664.786 3712021.134 6004548.598 8002189.936 3956644.962 5015275.301 5483826.265 577153.9417 7478724.727 5737578.594 4428203.539 7017189.823 5499541.649 5131757.791 3654408.688 9107180.729 5672320.909 4336887.27 3489231.012 5244923.474 7648205.547 6079569.98 4158458.54 6740101.269 3279676.284 4660604.396 7379012.841 7396841.099 4801926.944 4203479.535 9143657.656 5446393.121 5231261.904 4712703.897 7376184.785 3764622.149 5850569.218 7591792.452 4139693.161 7900671.756 7058685.051 6934029.427 2524839.799 5554069.555 5128560.367 6217993.844 6940717.09 7354594.879 5653571.901 7424772.561 8016197.162 416518.1823 2731708.509 5928557.283 5875589.072 499746.7028 7560378.343 10446675.03 8307086.392
(3E)-4-(2,3-Dihydroxy-2,5,5,8a-tetramethyldecahydro-1-naphthalenyl)-3-buten-2-one 202949.7738 135023.5295 124912.4357 126255.2602 117438.0982 122318.8596 137574.2353 145514.3494 111327.4584 252514.8745 131847.3337 110756.5404 120158.2926 145798.8611 252763.1048 93896.36849 105891.3626 98526.58378 131160.4922 131681.8868 144421.6432 291070.1559 129759.6728 129049.6875 698009.8339 112889.8446 134300.9577 270556.1187 164279.1104 131493.1657 1788009.736 640984.8169 308455.2177 567023.0475 392373.4223 246684.2788 101147.7658 94572.17451 128306.56 119113.5974 120949.8459 149335.3122 161627.691 119119.0765 88379.99127 131436.7926 129986.2739 127399.6891 169587.2293 111527.1834 120728.1961 113347.2836 103047.7237 113470.373 102951.4539 164126.6842 390436.3501 271824.1749 685562.5017 150626.7982 143705.2576 2219097.515 1155400.186 1780942.237 265520.6446 277636.9467 128114.7083 122582.3946 126147.6576 99420.90691 130056.5222 137010.3142 113771.3652 117828.4094 106699.3327 93002.84961 104792.9409 133403.3666 136830.2201 94579.59126 104053.4649 118266.6106 117617.4642 131349.6674 126653.1048 126532.9608 140657.8035 134029.1031 83217.0126 94829.27851 164534.5084 890594.4507 153985.1141 336056.2877 419044.5284 269708.6205
(3S,5R,10R,12S,14S,15R,16R)-3,5,10,14,15-Pentahydroxy-12,16-dimethyl-2-icosanone 30546981.56 8515367.023 15935805.26 17476603.84 20789870.16 12431174.87 17588149.03 11800879.69 15025105.39 15478141.34 11182773.53 14803999.34 12503330.83 9433300.381 16355626.58 12165323 16219600.64 15921450.99 10021430.17 10556987.82 14318786.03 14735637.37 16611147.69 13191814.43 12060196.54 13720251.28 13559817.42 14328924.54 11675395.41 15326108.96 153544.0513 118462.8172 230365.9999 162092.9138 312750.8846 465523.7141 13493163.54 10798234.57 19768248.63 12468695.54 23211776.57 18038604.28 22281570.73 16699036.86 3507850.958 12353837.1 10445954.68 10902400.37 11319322.29 14573483.78 12229907.59 10308131.35 16110401.84 8866708.196 10328101.11 8236617.863 13335544.73 18724161.54 15211333.83 12170553.25 12586859.77 133608.2988 138979.8809 68644.53811 49729.34737 236318.6439 22070962.55 22101889.25 15683553.77 11101344.58 19589484.74 15519343.34 17778191.51 17951616.97 17150546.59 12722706.58 16958019.13 12284591.17 14314262.44 11376417.15 18047442.53 15296320.37 10913442.37 13641307.36 15435117.41 11215437.69 12530743.92 9497646.76 1016728.753 11361792.63 20565085.1 156187.3411 117662.2302 711157.4682 375245.4292 161832.2866
(4R,5S,9S,10R,12S,13S)-1,5,9-Trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.0~4,13~.0~8,13~]hexadecan-10-ol 1358480.681 1704696.192 943203.7806 6043927.493 752129.1107 618064.4626 2065094.769 1588195.17 697166.0793 6455423.415 2138628.207 889788.8338 2558859.255 1979679.501 940948.0475 5542336.37 2033675.526 1250586.683 2045711.718 1694019.485 752115.3107 9759565.761 1907358.743 901028.6732 1594908.001 1570011.386 720968.1546 4984843.656 1250182.725 924470.7923 1906645.603 1227096.48 394732.402 4124073.31 831566.1382 867486.9803 2103898.959 2447707.085 6069548.899 1485578.354 1376652.979 3527532.971 6776170.212 5838559.795 320046.5926 1089421.287 3089100.802 6513667.749 7090250.313 2181667.521 1405199.433 1950306.043 4470703.259 5239660.987 1944544.859 1214764.445 2086547.396 5326191.226 5410069.127 1783338.771 1097840.43 1329789.507 3242248.113 5356938.896 1253790.827 1319192.215 182381.3091 195239.3141 340753.2193 181137.4461 574724.5688 141897.188 165561.1953 182747.2711 162748.8042 342879.6619 220356.4625 127539.3892 272437.7523 852195.6246 453039.0982 176687.044 286823.7914 364810.5232 207304.4334 225230.1623 252175.8822 103078.1901 67300.64157 140225.4729 377594.4678 438742.6388 196924.1513 363886.9717 213204.8539 294703.4529
(4S)-4-[(2E)-2-Octenoyloxy]-4-(trimethylammonio)butanoate 29113856.87 19685235.7 32484798.8 25887552.76 33784796.45 25222634.05 28578717.61 31380014.65 27542936.89 38107426.93 31095952.64 35205538.82 26445916.57 29681005.8 25902218.55 31590685.12 28630788.84 38558828.39 22075323.78 47056868.23 37013027.88 26169599.32 21537115.48 35856397.93 31504970.59 28546765.56 25546966.93 34126488.45 51371723.41 46330906.34 26335393.4 18458651.36 28242852.37 40737712.79 28108290.89 29091497.7 27621082.93 22415190.95 19089668.24 36874791.75 88238795.69 33906396.04 39835865.36 35004803.34 15334537.35 27757498.59 32943140.01 38705980.84 23709491.73 34959362.97 30742073.26 33376966.25 39928885.16 28469056.81 29296717.84 28405070.28 29104983.71 28512397.47 46018272.52 155812953.3 49364538.24 20381775.73 19458784.5 33780692.76 45556745.83 21147207.82 28879493.17 33720561.59 26788418.89 35726764.29 29535049.95 33192528.77 31190289.25 26598286.32 38824661.88 27099442.18 45970899.12 34254899.28 26197112.32 31756549.15 30374628.17 30711393.21 32899236.43 42519191.81 26552717.31 36783679.51 31776643.57 48654148.38 4258625.745 24815933.43 32718357.91 26767251.13 11903913.68 36356158.9 48766008.52 27885405.87
(4S)-4-[(9Z,12Z,15Z)-9,12,15-Octadecatrienoyloxy]-4-(trimethylammonio)butanoate 15182745.43 30929960.65 12129697.35 19057670.59 39691049.52 43530875.54 19067219.83 23596697.61 20776571.63 11571537.43 50262715.63 16298462.37 34456805.94 29703388.47 31169687.23 17815007.27 42414661.52 23972015.67 40420008.47 45071366.87 34379730.62 37080727.95 54121908.07 14162092.27 41935370.22 25001164.46 30924877.53 24615848.69 56347031.5 18441508.35 30952717.04 33741704.9 18965880.13 26009655.55 43535812.62 14126812.32 18135799.6 28563910.31 31998923.31 14842827.34 21902910.39 11156585.14 28331898.17 31105905.75 4307929.694 40552205.42 26957384.11 46107859.91 41994271.2 22396303.64 42694236.41 26522493.86 42274667.64 37298433.87 26427979.51 48023924.17 41692365.17 48147392.17 34837981.86 24886423.9 38901500.64 46702040.92 45068040.07 38911249.35 30118475.1 42905507.97 15209804.55 11711970.7 18423880.65 13565711.15 17821336.4 12589090.19 11237498.87 8892429.964 10966647.22 16027764.66 8997276.507 11604431.8 5241738.397 4581262.51 13016880.27 5739725.107 6787636.112 3788929.562 5245429.37 5459923.602 6911015.182 3250739.602 187330.2639 5534154.483 8269291.1 4998543.445 1275597.781 1677075.535 6857556.416 6684048.951
(4S)-4-{[(9Z)-3-Hydroxy-9-octadecenoyl]oxy}-4-(trimethylammonio)butanoate 7499521.542 8468180.657 4958170.586 12591001.67 27492401.78 37435865.46 8586070.424 4783957.714 5947264.499 9834885.966 44674150.61 41801972.35 19736818 9937028.611 8077970.903 8388496.313 38229762.91 42778858.64 15181766.63 9648092.154 10965847.81 14555308.95 46865489.65 35995047.34 20628349.51 11450863.83 30260760.12 23399209.07 54465594.26 54246271.29 24104198.87 18457798.56 26218318.97 30126878.6 44510325.46 71366085.53 4784732.278 6722519.67 15930396.42 3840375.113 6362338.598 4461189.437 17353752.11 13874988.19 1323673.377 7278063.287 8811362.338 18061388.38 14705328.37 6231298.717 11651547.41 8759065.37 14964874.38 14747586.3 8187408.249 11532617.78 9779159.95 21893493.69 44138063.94 7257940.285 9061152.575 10577153.07 17816558.13 39548411.86 7812278.524 10812033.52 3911449.688 2268993.345 3955602.839 2457413.862 2583489.736 14306974.73 9390990.979 11714484.72 7206766.538 6291474.959 13774072.72 13107274.4 12824711.3 3960569.036 8026136.104 15545808.57 12193489.4 14550351.25 9340105.701 6640536.223 16859332.4 10723793.94 958579.3154 6905221.358 9633076.054 17180434.15 3231065.593 12444003.85 7776999.311 10473705.19
(5R)-5-[(1R)-1,2-Dihydroxyethyl]-4-hydroxy-2-oxo-2,5-dihydro-3-furanyl hydrogen sulfate 3756270.032 8112811.698 7447858.858 9827487.74 21978161.9 42974862.86 7411687.608 7402545.891 6414316.579 19540289.86 101629771.4 92024475.3 11629395.86 12123930.48 7617117.814 10080364.53 73405418.38 80716657.62 9079681.476 8291142.385 8285452.919 27265294.69 46425884.64 67994209.4 8038837.798 7576038.075 7013382.2 11573223.64 31512328.46 48999025.36 6788472.142 5757449.821 6523990.271 8519520.279 10799281.28 37158082.03 8210061.924 1200155.472 3500866.173 3846007.831 3116546.516 13448134.59 18604703.8 3659738.813 231476.3372 4248631.156 14084292.57 14415491.2 4947096.26 6897893.32 4419343.355 6548250.636 11218383.17 2734818.592 5389758.39 4007421.969 5864726.871 8149427.88 2826398.835 2592276.879 3128671.167 3057753.669 1089534.866 2872835.077 2421580.175 2841039.331 4336441.512 4205988.218 4712861.657 3312607.6 2771282.596 5324450.766 3806311.075 2757758.256 6788226.021 4404890.796 6484535.511 5394926.552 5192933.734 230961.187 5505827.582 5244854.931 4839578.208 4710983.361 9501572.681 1771019.244 5445908.523 3223284.34 916718.2896 347856.4449 5077932.981 4464727.2 213124.2202 2524323.479 6060361.395 5474123.025
(5R)-5-[(1S)-1,2-Dihydroxyethyl]-alpha-D-lyxopyranose 18292183.8 16479456.66 17137890.01 22882206.47 12230885.73 20599841.34 13970726.21 18207334.27 19274685.48 21327651.95 10931572.97 17524872.36 18687403.68 21392883.48 21223116.81 22785716.41 14849387.37 33322446.35 28584594.08 49997487.2 80008851.95 86569282.59 32816042.12 146310680.1 129122583.7 64000085.89 143904806.9 219477375.1 97896401.29 249537439.1 245053761.6 206438949.4 330263834.2 368667754.1 318607478.9 353941328.7 24142181.63 28929152.91 23733101.07 33386605.07 31108380.5 31360805.43 33231191.92 107175351.9 42429104.44 36268092.88 148148410.2 55719671.86 166728838.6 248020421.7 58223139.84 319517147.9 85971835.49 304497191.9 479884657 169388696.8 378351435.6 155135019.9 479026525.3 510738482.7 150645347.6 498897413.5 488323625 726899513.3 625287413.3 223370241.8 21824978.1 23459553.21 26663578.12 22683769.41 24558059.73 31265882.24 28926663.34 32838055.18 29157570.21 32260498 36765859.59 39942761.33 34001205.14 19363118.98 33118061.93 42294119.09 38297055.79 36055385.47 31599045.13 34745781.92 39456758.01 37412963.73 1264215.265 26209231.97 38893489.1 38017481.52 6851693.936 33907563 41762991.07 44758000.62
(5xi,8alpha,9xi,10alpha,13alpha)-13-(beta-D-Glucopyranosyloxy)kaur-16-en-18-oic acid 3065269.457 6732342.644 4132387.213 1311880.03 2164882.859 1422885.187 2149463.175 3159620.174 1165114.264 1373059.674 2314721.065 900799.3702 929983.1333 1388465.782 2318567.733 1459392.414 2120143.221 2026969.086 943965.4922 1611648.116 950440.2912 1513089.474 1814193.429 2766094.697 952737.7376 3847957.011 2805725.419 2584709.207 2891024.598 2142471.696 1099903.082 2351093.11 3673949.038 1268252.403 1833304.948 2139354.503 2261352.466 819382.5969 1573771.841 1650015.647 3980408.876 1393012.635 1696472.386 1501171.593 487861.5718 3921366.559 3368567.162 1418102.51 3309876.895 3957507.58 2489717.186 2162241.205 2839622.977 2739627.416 1711181.544 1999931.625 1616376.978 3584277.541 2303528.021 2859342.901 2837889.013 2490479.744 2017274.843 3890116.312 3888394.18 4931394.241 2596023.193 4425875.867 3071506.498 2498829.319 1921169.622 4737382.696 1853543.928 2665108.215 1790184.26 1949289.474 3843791.761 3041054.492 2804734.477 1198919.153 3086045.247 2125478.483 1678239.385 3308639.713 4150716.516 2920554.797 2139988.554 4451193.608 162099.2715 1411347.658 3366645.576 4636498.825 345460.4286 2323729.127 4189712.916 4908768.613
(5ξ,9ξ)-17-Hydroxykaur-15-en-19-oic acid 792689.5454 687494.2431 63683.20687 849087.967 11750944.06 6864535.983 918110.4078 995298.0047 178725.1228 2784991.134 20360897.12 8680677.908 1592211.244 938398.8301 156997.7451 2179437.334 18140834 9429882.922 1182278.821 962025.0402 267521.8765 3434311.201 18107364.45 8140531.737 4388545.195 825775.3066 511079.6728 1603777.398 13525405.09 6634434.133 4943479.885 762313.2923 1007946.414 2581271.9 7081978.173 6543804.539 228061.7913 198796.4051 787650.3579 255158.3096 297162.4954 470729.3759 510567.7508 672588.0658 57906.81878 385661.0636 525296.5174 413421.2246 931356.4085 553279.7427 425127.1977 797126.6768 444356.0863 703932.5642 403697.3326 237267.6189 457902.6099 1159584.925 1541163.763 384027.7186 205826.0712 6487471.925 2684916.679 2867685.468 399730.4959 374999.9947 1692620.563 1473999.927 989137.8673 3478529.1 2383333.957 2184845.209 1670495.951 1033041.617 4482359.937 1750306.19 1886112.88 2033458.827 978836.122 1770657.749 2282837.048 1440251.936 1609047.807 1691762.819 3434816.39 1315252.281 1525370.499 1252929.676 37284.65031 2371723.408 1930536.498 2245020.811 319092.2509 1754463.851 2396406.651 2230561.854
(6R,8Z)-6-Hydroxy-3-oxo-8-tetradecenoic acid 6977812.897 11607937.55 1951497.358 17936524.21 11669735.47 23872163.92 9187556.18 14629800.77 1403539.41 19170006.78 22671614.12 31891099.77 12265588.18 13349975.17 2353754.115 17623815.47 22247574.51 50400362.26 11010464.89 12057118.11 2671055.044 26359422.4 19925725.99 35177275.25 12822311.5 10614417.88 2400645.316 15626657.37 17013341.68 29882065.46 9076540.7 13594154.38 2571460.304 13279711.67 10221179.12 29283147.44 8327350.984 5034427.355 13523372.32 6231650.014 8136898.142 11646811.47 11791556.23 13216000.76 985233.5111 7787477.604 12795108.98 13407012.08 14755192.94 8180158.027 8233848.871 9097831.466 13641642.77 11911114.23 8148261.62 7620723.164 9983743.735 9696047.975 11766323.81 6246036.037 7726810.351 7371497.809 3657049.892 12540662.22 5825693.33 8043743.074 11950697.95 4268929.847 5380207.974 2204811.171 2910898.184 4572996.079 5546756.332 4470916.75 6288693.914 2156058.508 5679078.499 4857615.917 4021010.729 2521983.068 2619714.446 2944259.268 4575505.609 2769401.581 3695171.455 2553143.344 4883205.125 2668446.163 318395.4132 1641162.73 2500606.144 6051804.752 732025.8214 2589949.466 4689745.719 4951549.236
(9Z)-9-Octadecenamide 1556915.446 2548785.978 2396795.471 1978817.183 3285898.6 2011498.485 914623.0389 1398095.36 1887726.66 703357.1057 614943.4099 874271.1707 1069211.304 1432381.616 2224943.742 930645.0424 605283.788 609418.3912 808705.1522 1376888.363 815237.9593 537225.2724 835138.8081 619398.332 940233.9379 5748123.887 731528.4742 783816.8572 684937.2397 711359.9635 3730936.827 7842267.971 5347857.693 3329083.312 3076366.25 5930634.417 3580538.438 3137638.394 4778458.554 5305124.544 5224718.524 608706.4373 1086886.92 2326033.586 945564.9906 3810847.528 1817193.198 1553300.716 2741532.949 1331110.803 3476104.387 773677.838 663231.3716 2185911.349 1020590.897 1867170.105 7739637.317 727146.3223 1027799.53 6821479.279 16345809.14 7701800.553 14159943.88 7693983.738 4773480.824 20164460.97 23099992.86 23131221.36 29382130.22 16171780.74 19304545.66 12574726.61 26336218.36 19393957.66 23839613.82 18331373.29 36128944.27 26399345.62 18059935.68 12168278.19 28184908.36 55275597.43 38174489.23 32445638.33 47643698.19 30856504.07 56737557.86 38366545.05 1673288.955 26072619.82 49277342.06 24444172.27 11620401.93 59125434.51 57815190.45 64286650.18
(betaR)-beta-Hydroxy-L-tyrosine 2417671.676 2093856.812 3456415.731 3159373.069 2674309.81 4522752.271 2814615.106 4045155.298 6211820.607 3621100.428 2739198.419 4205855.144 5461025.901 6443807.126 11656463.48 5496378.072 4191529.142 10312861.42 7767586.169 13028254.18 18383146.13 17910595.56 8936271.026 19956504.63 9148894.915 9507248.956 17206438.15 15431518.38 22929073.92 27897949.46 9834854.421 8157878.709 18117238.73 15669685.16 14477490.85 40402239.52 5084350.214 1236705.719 2815895.786 2941613.219 2142830.176 3873026.156 1666659.372 5153396.97 840817.8861 3780480.075 13992954.33 3328952.598 7928856.695 8427649.05 7329424.8 17709027.56 5339134.658 9110370.719 14022108.79 8584636.193 27154234.22 7060856.938 10140672.27 12277836.43 6912517.564 17336363.31 3580543.587 10167013.74 15900080 10304463.68 3165180.672 2453846.87 3138722.095 1640168.559 2484119.606 3492398.671 2370131.815 2557031.432 2956834.883 2781516.537 2614491.823 3157002.551 3468278.529 1224791.238 3164282.51 2047809.083 2011694.286 2207337.702 1725392.005 1904807.973 1353169.325 1207065.896 291722.3787 874527.3479 1755908.462 440461.6594 265122.1698 336492.8419 399181.6407 1991563.001
(DL)-3-O-Methyldopa 22627059.92 31849593.44 27431116.25 31440580.79 27011570.29 29470335.45 13026311.02 33682552.5 31646637.73 15979516.84 8793679.05 10301121.29 22153263.34 30845224.29 30178534.75 15017452.79 13415548.64 17714996.39 19350825.79 28579826.6 32879474.89 28592928.9 12002547.26 15588473.16 26653217.95 23219782.49 27115652.89 28424902.1 23021047.36 23455117.38 25156689.46 23022506.97 26525122.47 29798226.25 28837000.06 42820877.58 28873066.12 18276702.75 40244757.32 23529959.35 31969693.88 9267037.234 10156330.49 31075846.53 3568588.56 31747882.29 20083937.95 19852813.76 27969938.56 25007708.6 37077011.61 14560752.91 14661979.66 21049376.53 20007722.28 26158021.3 21701349.56 18764251.09 24097402.89 21235743.34 32386522.14 27850768.97 16416680.14 24387477.56 28472255.71 25267428.2 32341267.15 33622444.12 41488060.14 24968401.22 36087245.78 40353749.05 33482154.41 36731519.16 32409208.39 29111092.17 32631236.32 36284752.61 30576829.36 9793127.527 24527286.14 23003013.67 30993852.05 34197321.89 29615993.11 15317391.13 28683926.32 27881827 1353182.95 18552409.24 22682372.6 28273377.15 4442443.265 24543166.67 27140257.61 23211748.04
(E)-p-coumaric acid 31274431.56 91542617.79 80867158.12 43561755.56 75687396.87 70387855.59 35095990.1 69099731.92 87590000.94 76495379.13 62145807.12 69127183.37 45810682.99 82789765.48 101235259.9 103764641.9 61745928.19 94791547.81 55098308.24 86215192.27 133243211.9 159611577 76514484.9 98764726.52 66957305.42 84287975.03 113536161.1 100723754.5 82419295.89 118186082.8 89662567.91 102377447.5 163730460.9 116360574.7 88948688.1 328930538.4 94221038.58 111398944.5 65878228.75 60534042.03 117174889.3 72770666.57 84945860.42 102883664.4 1086246.479 115614469.1 87627564.47 98815485.35 83638625.6 83848339.35 131165706.9 94919583.25 102859533.4 77825269.4 110480274.3 170263446.5 96813503.4 106336819.5 100009392.3 99212397.34 161023065.1 102916904.1 196354429.8 115128602.4 176244794.1 162376425.5 55952072.55 70043425.58 70344536.11 55265919.62 51561087.15 113844659.6 117821260.7 82580446.92 77827683.75 105055870 87753917.83 104620548.9 113205439.8 88417580.73 81287626.08 105159581.5 164360236.8 108092499.2 73054590.93 134634157.6 95073724.67 170208558.3 612944.4592 69385641.42 87739799.09 91973461.64 488967.5321 167020179.9 88292756.49 107881166.2
(Hydroxyethyl)methacrylate 88931829.38 199861248.6 241992198.3 199929234.7 191874727.7 136003886.3 75941608.41 50650035.71 147194075.4 109042834.4 126898053.7 66648330.44 91312036.56 76456315.42 109689577.9 104185962.7 116276080.8 118868492.8 47274521.36 91186843.41 87311081.86 221683262.5 106699283 185691250.9 58293577.55 64502598.98 105818206.7 98857534.42 101485430.8 367167835.3 85495283.58 169792107.8 241868668.3 255719024.5 123753396.9 554993007.8 39676350.69 30606948.62 26084400.82 29325147.9 54138636.66 26787173.84 48114335.44 18824418.35 43828620.88 42415714.6 42805466.36 55270681.22 18992669.39 38482460.85 51494215.9 28435920.01 59024076.82 10839380.87 31638706.65 31375569.52 39618403.08 53721035.59 29793479.95 23789926.33 36977939.63 57363990.71 144220465.9 58692575.09 46071476.8 87968630.01 308870742.5 328897784.8 399525928.4 352513570 259808357.8 386299636.4 343720365.5 422146089.3 793339854.6 543234404.3 360695668.9 432149468 258296224.2 314545706.8 569612404.4 414258671.9 463645379.9 380068759.2 864332541.2 681962648.1 495433194.7 471942489.4 19137918.88 638407550.4 885137272.7 696808153.7 133538698.6 629436872.2 846815364.7 1201186486
(R)-3-hydroxy-2-oxo-4-phosphonooxybutanoic acid 257638.3856 274244.2265 261598.6407 265327.3339 247160.1193 256212.7913 245316.2142 442956.8257 282373.5374 255596.6883 266225.853 252990.2329 283812.6154 540734.3624 455215.2486 263686.5061 260477.9742 755112.6779 376868.3246 1158516.724 1881289.36 2857752.964 718690.5762 6115605.521 2206704.495 934721.9419 4477291.256 9381671.706 3487999.998 13330872.86 3957109.295 2861263.509 11257907.41 14702623.2 8744205.978 23154868.28 375234.4646 241263.7722 263154.96 407320.1531 386685.8187 316049.446 244868.542 514158.8356 148991.8421 569836.0199 907049.8002 570304.2649 672931.7827 389954.3239 626727.8408 1104055.551 308784.718 874128.7256 796363.4388 1269810.64 384300.0854 1586323.838 2739403.411 676539.0423 1139166.036 1524032.773 4328840.199 5628270.875 3790388.306 2087985.989 308412.9606 295978.6214 313562.5775 258176.2931 307600.8815 435220.766 623530.9032 709298.9033 309458.8968 319926.1456 4463200.855 5890761.953 2076537.895 551604.3301 3262420.883 8062228.542 11856317.73 9125627.204 5865069.178 5397561.773 6029097.117 8460121.758 262030.4658 4534257.928 4786458.406 5833070.776 2389101.331 6292719.259 5126193.814 5054151.774
(R)-3-hydroxybutyrylcarnitine 3836766.542 7422243.347 4057977.897 7440387.798 9101721.033 20387852.9 4018557.198 9463459.707 5458595.593 5326425.626 14184337.04 17552666.1 9720528.596 8701014.977 6983616.049 11694624.99 21480150.3 27488220.29 7311068.878 9335581.186 8566891.563 13584664.33 27141535.06 34581235.85 8013195.568 7447832.016 7018205.433 10940198.41 30466833.41 47665194.9 9945572.855 10330137.43 8748342.299 11151340.51 25714736.28 55333391.97 14854034.6 12774759.83 18706567.8 13621085.45 10600164.17 13278117.8 13159650.51 23136942.03 7915862.622 11665231.27 27389861.18 14070209.4 34255299.39 22074100.23 19516135.18 19845674.84 10896238.67 25337252.23 17998923.13 13667978.41 15851868.81 11378236.6 27794579.74 16042059.29 17980762.01 17472472.65 12565265.86 25628637.14 21047589 16346515.03 4749486.089 5834939.63 6088056.991 3655912.623 5152625.094 5673072.435 4795823.584 4200911.844 4450999.668 3378709.098 5009139.682 6327699.72 4149507.475 2559624.126 3880602.585 3581288.682 4565713.657 3937134.484 2821029.3 3604162.824 4200331.084 6086218.6 868093.9224 3456408.085 3834343.208 5533830.553 3413696.586 3292892.975 3971081.143 4442767.753
.alpha.-Aminoadipic acid 5402598.893 8469871.903 17648475.36 14960926.06 12533355.2 16329634.72 6604639.031 7887403.262 13561743.98 14688274.67 23462237.92 16527352.4 11758952.91 8922686.161 14111868.36 19455477.07 22885553.55 24218130.49 14653306.37 10183541.69 19912633.56 25495253.72 19287705.25 20092988.71 12457758.84 14047464.34 18284717.11 15701787.01 12319101.36 20289275.77 13759811.12 14913888.28 24380058.77 19052588.07 15833073.58 29233670.97 8260810.684 8384610.017 8827011.967 8783765.776 8039285.384 8462225.668 8052064.77 8143869.483 2722755.798 8236579.261 7859807.025 10993871.35 8686925.747 6582272.159 9092722.601 6584538.223 8847899.372 8184221.136 9443657.355 8150460.91 10703614.53 10962970.11 7164801.064 9075126.712 11516615.2 10092923.62 12722942.95 13642831.84 13407666.06 12910911.11 6870819.822 7237796.239 9974880.978 7029519.381 8432107.311 13304466.37 13611687.15 7389517.346 15233294.78 8500258.331 9489930.34 11864575.86 12621296.37 8287264.659 9261087.948 11116342.95 12923137.75 13193352.84 10498463.78 9809072.771 12787267.99 16460951.32 1483325.61 11625786.24 15721662.05 13133583.54 4853397.111 14749370.07 18966544.73 17521877.18
[3-(Hydroxymethyl)-3-methyl-2-oxobicyclo[2.2.1]hept-1-yl]methyl hexopyranoside 1750677.077 1925001.502 1714863.099 3610533.913 5499352.619 12258503.92 2714968.536 1863611.366 1417514.101 4720300.774 11745003.66 16174368.82 3859298.611 1981140.363 1369264.999 4294779.916 11119765.27 18415537.85 2478619.87 2136578.082 1317835.032 6191449.665 9427562.249 16307414.05 2091803.731 1664178.455 1318866.908 3079409.682 7634873.412 10679185.61 2101731.178 1513804.891 1235357.901 2572284.814 3891108.181 10838324.55 1049316.122 1322295.264 991122.6359 647283.4548 760753.0142 1365213.85 3083747.006 1258957.571 77149.9169 687772.5496 1732175.099 3376275.471 1546162.62 1118661.722 687849.4109 1072184.487 2440054.236 1109050.036 895848.7211 736018.5052 1101887.569 2437776.778 1140834.16 753948.548 712423.1244 771964.0526 944416.3067 1225821.162 669153.3473 668160.2611 3278228.422 2917160.395 2585267.196 2270606.782 1439559.365 3460209.965 3291964.894 2329054.483 2837989.382 1397516.999 3618403.996 3508671.288 2400219.259 994455.2941 1080402.795 3187589.151 2844474.983 2787311.169 2623988.073 725764.3248 2844249.166 2893235.937 62806.4343 1358487.474 1393357.57 2488427.046 407820.5766 1733543.898 2157325.38 1509330.339
{(1R,2R)-2-[(2Z)-5-(beta-D-Glucopyranosyloxy)-2-penten-1-yl]-3-oxocyclopentyl}acetic acid 249306.0022 267775.2653 714671.5669 627155.8649 41525.06193 154587.2442 179631.154 385844.2646 584592.7417 935162.3709 150380.395 86027.2934 638758.2429 386535.9517 824057.0592 653683.3962 181547.4185 132872.4835 357697.1895 572455.3901 792773.2603 1387743.861 140712.1994 154163.9061 586760.6499 666654.9247 614644.037 633275.3065 209093.4786 83198.60503 482455.0563 335987.5013 576488.663 663347.2318 140749.8707 154347.724 677310.9205 1631436.36 725984.1165 1584045.907 1645828.562 1039891.621 4253589.55 746361.8387 497075.9999 1566213.936 1087635.495 3350712.826 1021940.756 2347284.89 1909064.716 1054254.567 3752163.995 729805.3627 2592716.525 1495538.645 902207.0062 2720587.141 609336.4977 2237007.922 1638420.438 624122.8742 1704147.795 820582.9773 1573431.577 2009643.025 136873.5542 331447.62 315733.8003 229181.6918 143137.9809 145286.6928 398121.8836 316076.9332 272855.5689 251190.1759 152087.259 550838.3073 330702.9524 143459.9417 242231.2977 217630.9341 369455.3821 272337.9446 188636.3758 207351.9844 202495.2463 302080.0035 51768.82801 188921.5275 225038.7257 157754.1964 40685.91838 279897.9896 223525.6241 226903.4678
{4,6-Dihydroxy-3-[(2E)-4-hydroxy-3-methyl-2-buten-1-yl]-2-methoxyphenyl}acetic acid 33527217.09 20739769.41 32940661.8 14900223.73 37109982.35 26008928.57 18561827.91 26953158.9 28119961.53 21638654.5 32219501.73 10101686.16 16227236.26 8126923.992 20657950.46 11965886.51 30044625.25 27578717.63 16190466.38 10043576.19 23701003.77 21445672.03 19917229.56 30649941.82 22299263.22 24479038.9 24922091.7 26647183.52 31392343.05 35991988.06 15457612.87 10397712 27679275.15 23773735.66 29976926.99 57408403.82 23097153.84 4881621.189 13971022.88 12143150.71 33426924.12 10033649.14 11655815.55 7985059.609 3088641.342 20668846.39 25617835.88 20434909.39 26917991.59 23247203.29 19234121.96 17863510.07 20490428.59 20024128.02 20642981.62 9578383.698 10312629.86 28069065.79 12256210.84 19469874.73 24066474.31 16550420.91 13583186.67 28883114.69 27249352.17 21000096.49 23295861.52 29675955.84 23628473.07 20090703.57 21286850.74 30364467.77 25930314.34 22606860.22 12771811.85 18376351.17 27739131.17 23011070.54 26176101.38 13021710.18 20468450.9 19322379.69 12203571.71 23004568.99 37294740.67 24123269.38 13053734.07 31936136.9 660082.4629 18314368.52 25371199.17 22933080.07 4423706.471 16663312.11 44565994.9 33302019.32
{4-Ethyl-6-[(3E)-2-ethyl-3-hexen-1-yl]-6-methyl-1,2-dioxan-3-yl}acetic acid 446763.1504 332424.986 323224.7311 691555.0282 298410.272 324168.1663 351466.9301 428324.1627 341210.8906 351737.545 336301.5125 305357.8508 358049.2245 287150.863 337350.4175 316036.0048 291389.5251 321199.2605 339622.4236 360791.8301 732862.0342 292011.6357 367487.4961 359905.8536 1824705.137 283465.8993 846314.8622 1068618.954 320632.1147 330653.4602 9070694.117 1566556.063 719488.5627 469188.4244 422418.3161 326278.6271 301462.3081 229595.0317 307866.8435 286483.1651 769771.5803 415351.071 440264.9625 843806.3305 278039.1135 330348.1658 332118.5625 390035.027 377977.5612 290263.4069 312971.6982 426930.5508 297766.1878 330795.4814 389384.5116 319176.32 559510.8324 551633.3025 1206693.009 402799.2227 287115.2568 8813423.411 3327082.69 3252127.34 819369.1936 297280.1191 576470.6708 359912.2645 397076.5099 305283.283 346079.776 407268.2438 370644.36 592084.9086 354858.2895 295280.9963 537532.1783 297329.5764 361738.4047 908937.46 336193.341 339190.5739 314513.2873 351277.4298 985975.1028 379712.764 628136.6852 357524.147 259491.2707 344983.9583 346054.6149 303183.4626 327218.7509 251804.54 661429.4874 322004.1527
1-(2-Deoxypentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione 6307891.193 8688857.282 5512910.428 6222326.302 7304434.645 10094785.42 5005661.579 7862859.369 2787541.477 4921589.516 7661008.236 4702836.258 6998590.553 7618002.675 1978347.231 7602895.7 6771285.48 5237623.31 6843227.465 9600113.082 2407222.169 5738177.751 6404214.554 3531744.924 9216580.058 7039568.758 5584885.758 9663124.724 12042532.02 12601391.42 10741521.85 7629821.48 6683555.669 12194150.06 14644821.8 26943479.72 7560816.661 8280784.566 8321370.256 7570400.411 11744270.46 4862165.45 6681000.573 6942773.389 2345772.09 9862002.245 5512695.966 7709671.259 7485346.059 6777465.563 10415785.64 4293834.557 6289017.181 5371931.299 5579155.388 8620889.017 6029201.653 8096075.575 9547206.76 5043379.376 7770949.082 4104425.209 6886165.562 11005320.53 7899181.946 7926517.455 7087261.74 6675072.213 11119978.04 5694620.236 11242004.57 12120537.59 9727845.574 13171874.51 9737678.203 10540591.72 12064996.71 14772069.75 16285165.86 7060261.424 14782661.85 13398958.48 14310334.84 16934950.7 11103639.67 12576812.01 13937033.91 15446155.28 1455429.131 12414779.19 15525537.25 15389182.3 4833649.436 17778402.04 10699218.53 15551792.78
1-(2-Furylmethyl)-5-oxopyrrolidine-3-carboxylic acid 26628096.45 34419508.28 34675098.42 41493216.89 28525566.48 31738404.57 18524322.07 29888895.4 30896401.69 18276069.57 10766470.16 11361151.79 26852433.53 30874903.53 29540206.51 18973811.01 14563858.28 17353708.62 20927426.97 24968039.58 30616025.36 30271367.15 13485176.22 16110173.15 26924230.37 22929439.42 27251160.61 29753352.93 20486126.28 19820813.79 26693877.69 27870795.04 27055072.61 34054441.85 31496115.11 41693999.87 33319123.86 22078022.38 43399719.87 31170614.64 37638804.97 7363709.421 14769569.2 39085803.08 4802487.234 34140295.03 22215122.95 21658688.51 35400984.72 25829246.84 32435318.42 15482956.25 16915887.64 27157497.78 22641509.74 25532672.18 20154368.63 19505206.34 29272904.24 22884159.18 29008784.64 25689617.51 18150205.98 27292405.59 33613769.43 26544452.11 39926213.4 37259713.33 46016432.62 34393372.06 48589019.54 36548629.89 38804330.37 34820310.82 37197032.96 33575617.36 35512631.37 42799620.41 34524904.16 12907008.58 28221302.16 26852166.75 28545092.08 33542671.11 26548183.17 17315006.84 31822463.31 26489543.53 1625877.192 20557653.23 25990691.64 28851977.96 5606379.692 24715093.25 23651172.77 27420121
1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine 278362347.3 348373814.6 162092788.4 481604360.3 544491813.3 364171873.3 545310413.6 398347815.1 375402276.2 638122816 1222400491 588234784.5 515657807.2 477427832.4 302229245.9 496386768.4 1037656284 583434582.1 346517374.7 230295164 255443131.5 569117396 715922905.7 489269767.8 279898189.3 317162283.9 266511694.6 359535675.1 643929790.2 373935015.9 388965825.9 402624935.7 471394285.2 638445196.8 693025826.6 616950218.9 1029760932 710513159.9 889623309.3 1451857255 759879058 1078337426 1052836825 910058586.3 205896359.4 657071691.6 1011892854 873308794.6 676709983.4 501633765.6 554955564.7 439617822.7 384284674.1 273547807.4 340005587.3 303036702.4 649817122.5 371516677.7 361826659.5 428107849.6 356079493.7 539682910.6 305819603.9 445881578.4 420015712.4 466256554.2 540840396.2 502893599.8 799198389.1 430127940 637891039.3 595147154.4 712863776 619703436 471651249 462019838.2 691189608.7 1097578200 737708615 348528405.5 595784452.1 932412569.6 978182934.5 1123040280 594183087.7 453502317 890574431.5 982749709.3 78203950.11 571057058.2 707975677.9 869654178.7 306423094.8 433434343.2 555830283.9 762799583.1
1-(9H-beta-Carbolin-1-yl)-1,4-butanediol 3968695.809 6063907.493 6156199.35 5619399.286 5977929.236 7022698.38 3735579.979 6169601.626 6150242.837 3408684.314 2812478.848 3221086.017 5540506.02 6190625.037 5690495.361 3423436.622 3470739.09 4991198.272 3040255.72 4509626.649 5116357.279 4478350.285 3279685.528 3935280.58 3802200.182 3593785.808 4481722.247 4914408.47 4300280.706 4817744.488 5294967.652 6331219.48 6515527.155 7611615.83 7010684.547 11410957.8 5454415.677 5177612.7 6427847.752 4219051.01 8592760.52 1752248.091 3070773.504 5803815.574 746587.6492 5959178.725 4182265.248 4578695.435 5667493.967 4343659.579 6237699.691 2648345.085 3304494.466 3210361.882 2493488.379 4441636.846 2857444.96 3711154.498 4100485.794 2778358.019 4357748.791 3760339.237 4357216.28 5285811.751 4563322.014 5464787.56 5205965.73 6125166.536 8526630.274 5672573.751 7455643.693 6644031.665 7009386.354 6665591.329 6779715.328 5670854.92 8075504.998 8636104.802 5714515.565 2463410.254 6076620.783 5287254.176 5395654.585 6376890.422 5246815.549 3594994.43 5597443.53 3628075.329 248737.7255 3670028.031 4960834.821 6690152.963 1531097.566 7390252.682 9083924.74 7940998.814
1,2,3-Trieicosapentaenoyl glycerol 4825863.134 3960858.628 4226371.521 3701586.109 1973415.014 3864877.338 2508369.64 3415865.477 6788012.825 2705250.168 3575761.713 2461500.72 3278258.302 2232836.422 3010039.798 2328206.558 4865974.749 3833670.505 2514361.84 4330203.317 2403913.389 2825533.278 2044419.66 2579659.305 3544843.808 4612829.258 3260830.091 4154927.867 4263523.366 4332145.496 4128700.241 6416239.169 4724060.769 5606429.138 5985395.239 8442816.62 3637724.409 2080745.552 3645536.348 4358776.506 3701365.716 2768079.648 3530883.375 3131917.724 325156.885 2822765.747 2976916.862 4210956.239 4504018.354 3536163.348 3090771.837 2054558.777 3048449.453 3257324.638 2301223.136 3983309.23 3546770.041 2710601.67 3328926.436 2926603.582 3534373.168 1605930.467 2783541.449 5780840.857 4746136.563 5661730.136 2883271.015 5705614.604 3388924.874 4700721.87 3827173.408 7262286.417 2884272.184 3316363.334 4621436.346 1868897.202 3660502.99 4327588.855 3546281.849 1461529.726 4249438.685 2971761.802 3151245.812 3232123.138 4212516.775 2897037.161 4860393.043 3270227.568 149456.6662 1153432.567 4575678.903 4374203.206 1224455.427 3403664.402 4777072.551 5136950.289
1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid 2624320.115 3995866.206 6491534.417 5964050.487 3608206.897 5403567.811 2837620.695 3821977.598 8219742.062 7916956.098 8217944.397 9665962.895 4985335.441 4485698.668 8721229.447 7638062.249 8976580.433 10567196.66 3988359.103 4471730.472 8367271.997 12515651.2 9018696.627 9981186.801 4075408.148 4154265.865 8519350.669 6597517.799 7344156.332 7984054.937 4179954.974 4176874.833 9925051.459 7206535.808 4126314.012 8810070.698 3173177.027 2913505.429 1974384.706 4231816.007 2228904.059 5241750.508 5594712.736 2263940.406 956897.7443 2621576.022 7631803.266 5978126.894 2654356.919 5348925.202 4174992.255 4506740.992 4398343.346 2259081.838 5133143.675 3499460.111 4899377.568 4154151.326 2216904.693 3435429.605 3528537.59 3622045.102 3056523.067 2572338.937 3704404.301 3565526.267 2078862.541 2458200.999 3025701.08 3628195.091 2659795.174 1933701.127 2363282.722 1868552.467 3342316.242 2125438.221 1628016.778 2134618.675 2873844.732 1508970.916 2057594.105 2021246.583 3152286.909 3171835.742 3380307.618 1957748.361 6521499.803 3822117.165 80193.81033 2889425.119 5576630.378 15864524.1 1496422.488 8059646.48 6380748.529 5817185.073
1,9b-Dihydroxy-6,6,9a-trimethyl-5,5a,6,7,8,9,9a,9b-octahydronaphtho[1,2-c]furan-3(1H)-one 2179107.237 8412978.105 3990559.014 3531240.451 626371.1566 656407.5849 3125568.346 6393813.361 3678897.745 4993595.226 541159.9302 200168.934 3800626.703 9022254.841 3582442.81 3817447.187 895147.462 704671.5042 3351244.845 7515135.492 3634748.989 5709346.218 919596.6762 274880.4953 3004962.039 6109329.933 3458394.436 3247111.89 373994.2515 740097.9229 2677296.8 6595645.116 3634637.526 3264533.356 437852.7823 217824.7273 8218728.322 3269102.801 5764823.333 10364708.41 5955470.085 10853754.43 7819503.094 5687525.528 2713855.574 5863641.493 13171357.02 7609467.29 6141790.725 15864329.42 6864332.254 9105444.481 6560244.792 1980079.611 14655595.98 5781206.527 9701431.589 5640201.203 4887901.845 12158385.15 4821800.302 6001526.358 2686780.511 5516310.959 9195546.69 6474635.644 3855513.316 5495959.59 5989796.921 2582279.223 5745488.237 3337688.272 5614548.917 3705138.322 3227016.826 4969829.057 3688604.379 5533428.441 4310454.963 1289495.983 52713.547 3364526.909 5322869.214 4488823.584 2375781.833 2770476.795 3051528.724 4814156.77 212065.2891 1834380.001 4612423.745 2903543.014 1061036.446 3651836.764 2993762.483 5071829.102
1-[(11Z,14Z)]-icosadienoyl-sn-glycero-3-phosphocholine 28931190.85 36742362.73 40279027.74 46802043.7 39580017.58 34370736.75 60520826.21 51295948.9 57567426.09 80753030.27 77354136.97 61850505.95 125452086.6 86969551.85 93837242.72 120552923.6 94527833.48 103777173.4 86568873.59 80493050.82 89691871.4 186659214.8 92709609.97 110796252 111345573.7 76629796.23 78080314.13 102916300 58306996.29 84935643.63 89535848.43 80305308.8 86714318.05 93598348.25 45315377.58 82645516.53 98207505.04 35478382.09 65067302.81 67222878.15 54589531.67 138580987.9 104701978.1 70697931.7 26282400.16 49034390.19 164319924.4 96483644.59 80078416.59 143004142.7 99154875.76 101879873.2 87294548.24 64061212.7 133919225.6 69389064.36 124645097.7 88174263.06 58839527.67 130872866.5 55029586.98 81430359.37 36475451.17 58218029.18 63306178.56 55233248.7 48978784.26 48110082.03 56374086.08 43684645.44 59183018.26 53188425.12 63615518.5 38195479.66 54802884.51 50045924.16 66091641.06 80779425.94 63850889.8 27889436.4 61956457.12 80163792.44 103378623.6 79448624.74 62473399.14 40140782.27 64005939.56 68293868.7 4016474.646 38059952.93 69164962.97 57268604.19 18596433.84 55637138.31 55212977.99 53140651.04
1-[(1Z,9Z)-octadecadienyl]-sn-glycero-3-phosphocholine 52706906.81 55084988.01 58192813.43 49727779.21 44165650.67 37389706.4 54621053.62 69269797.59 66042428.78 58825695.69 59604204.1 43601528.55 118213678.7 97501746.87 95257448.28 88904385.35 64357374.32 73642522.22 118494524 109834901.4 100284539.4 153754010.4 78328771.82 92130464.3 136021820.1 101535199.4 95185223.11 96489650.79 55479856.57 67087803.93 105360305 110783766.5 86120828.85 92398566.38 46505674.13 81944015.62 71082341.14 40359340.33 66886870.53 67517481.43 52725061.54 67220921.78 55609221.09 65096926.64 15831413.33 46076411.65 85939428.93 62758143.02 79222768.18 95045848.02 73531645.82 77727417.42 64140702.48 76582052.41 94280384.24 69805213.53 91348499.01 3617506.404 69797574.49 87384257.13 53507832.13 60912899.81 33136540.05 65329260.29 54518320.42 54812028.46 46351622.94 43721519.56 50072874.98 39053454.93 53253052.25 34549791.32 49098514.91 35888930.53 39847744.06 37961997.83 42273685.52 57647660.78 46428473.01 20052997.3 38813861.76 47193586.17 60905413.76 45700605.1 34479630.32 24340150.61 42196823.21 40048854.53 2046567.191 24663603.41 37425821.4 34846558.42 13112938.76 126774446.8 32722521.74 35615700.53
1-[(8Z,11Z,14Z)-icosatrienoyl]-sn-glycero-3-phosphocholine 114240218.6 101894567.6 89574229.68 121298171.9 74226772.68 63806882.82 143326251.3 112530217.9 74202454.42 168704584 206709826.9 61651049.49 144677695.4 115139677.2 59813413.1 126520165.8 121122849.1 68972738.04 52824832.18 71313989.42 37281063.69 75113712.56 106966356.8 48940335.18 65388536.58 55976250.34 57815021.74 57242369.61 66732929.44 32170835.98 66390967.16 41242491.11 57975730.85 90396712.22 69334287.33 69257472.09 160653788.5 155044470.3 225620934.6 101872797 217672935.9 430566884.7 337389772 295383310.2 86773333.14 197323843.6 395762042.9 348915305.6 218618610.6 200399093.9 209664902.2 201425261.4 161315081.3 94952199.98 132678148.7 99601529.64 141893220.3 144596409.7 94445445.44 119952808 79866008.3 168414657.7 77681272.14 104810592.9 88921513.48 107130770 118828101.3 172232644.4 168569514.8 120584295.2 227842512.8 148525311.2 153810442.2 122268284.6 128663439.7 107185985.4 150583984.4 192557935.2 145636245.9 69983300.91 147948192.4 208036209.6 212759506 203080417.4 185534670.3 103578797.8 147711690.4 215154851 17859784.28 151042753.9 172265502.9 186706903 73255358.43 188590269.7 121240544.6 132220057.7
1-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine 68812118.13 139949120.7 180827566.4 210994956.9 153431347.2 166357349.4 288025948.3 163660215.1 218710974.1 345784264.5 228887530 234825343.8 432791339.5 228370942.7 242841154.4 277737028.7 201469165.9 260467510.1 383946758.1 244967982.8 218708458.2 500697921.7 151016341 198929836.5 362504152.2 195768920.6 208283997.8 271503248.1 141897674.5 168512061.7 398306638 297339454.1 240297632.7 345660262.1 152377192.5 274385009 284926662.8 127589352.9 242095101.3 165483376.9 167353728.9 407831738.9 317085825.1 253865292 50024897.21 194175656.6 401445620 312168772.1 274124767.8 236819435.4 208781297.4 260239396.9 211366091.5 199903391.1 210027903 177572625.1 299801245.5 184912902.1 196040318.8 172474206.2 176381106.8 305917308.7 139166248.4 262069355.1 169506742.5 221141555.2 167109801.1 166169765.9 206597741.3 157267852.8 162931126.4 207403240.5 246050308.6 217539121.6 217452410.3 144862389.1 229050538.6 324286682.6 295425133.2 106450345.2 175167178.4 265352307.2 343644462.4 343570759.7 288895419.1 134720016.1 293358898.9 307137038.1 19485959.03 163454795 211752070.9 261963196 77116595.99 323559629.2 298998472.1 258398989
1-[4-(2-{3-[(6-Ethyl-2,4-diimino-1,2,3,4-tetrahydro-5-pyrimidinyl)oxy]propoxy}phenyl)cyclohexyl]ethanone 2434325.916 3062281.774 3306822.798 3009050.853 2723005.061 2674393.145 2761879.391 3038843.966 2642851.819 3136109.822 2447759.734 3151350.856 2830679.91 2968470.849 2906327.189 2900396.725 3525072.19 3503456.098 4549056.34 6321828.096 5761985.188 12396050.16 5408609.695 4720479.867 30554265.27 61418458.78 36113807.86 28980332.84 45330842.44 33091716.95 7443547.136 13742480.32 8920312.731 10844940.85 12795373.93 7892034.926 2119764.702 1945673.387 2138494.548 2466080.168 2473672.807 2773475.443 3042059.211 2934915.515 2486231.26 1854125.971 2739538.079 2832297.133 2266805.01 3387157.064 3070368.967 3866141.347 6294030.259 3047154.016 4541449.962 2734988.781 38024729.73 24017320.7 37216819.44 33787062.27 37108361.87 15701931.4 8857211.728 8931139.11 8080757.217 5189231.458 3605666.659 3688731.955 3754589.27 3053678.493 2327247.54 2732108.148 3066286.462 2496692.733 1743144.279 3399141.81 4032189.852 4308565.052 3803293.514 1568732.701 2783630.332 6339188.103 6491020.967 3539215.593 2485722.677 3949210.096 36932754.38 21398359.34 5453371.217 15805045.3 40532123.89 9566023.855 1986308.955 9555884.138 11462843.86 7637389.674
10,16-Dihydroxyhexadecanoic acid 1278775.821 3236053.698 558977.9124 1738690.868 723590.0538 1660688.511 2392608.592 4275301.614 515733.0598 2395837.232 1498226.478 2647848.5 3083593.381 3389310.005 501062.6793 1371162.007 933821.6904 2102732.591 1757200.46 3044101.253 543868.2798 3169349.027 1539500.055 2730363.978 3377749.789 3517987.095 482167.3397 1464072.228 881822.4126 2438545.467 1473906.211 3012231.64 771863.8885 2384109.871 1498259.926 1760986.302 246346.7558 142991.0841 1385100.785 278510.4 1828745.995 999350.8076 448559.8672 287734.341 1412618.734 296343.1955 1129398.357 514575.0094 424715.6866 641442.8824 3231485.517 597077.1907 260531.5628 371239.1094 2363766.098 2600958.164 2404965.287 1672290.419 913731.8904 3672107.08 3282431.173 3085408.371 1561547.87 2027560.749 3694111.398 3599875.948 501641.7784 1344053.792 573306.0723 554072.0385 461399.7186 619770.3325 347747.7788 392512.2226 843334.055 445248.394 653285.0269 473137.9879 253479.0389 14532284.92 612363.2707 607071.4118 443255.9435 1590750.311 864760.755 1248403.975 1488006.078 1452382.262 147529.1331 370250.2669 740549.335 700154.9181 336040.5819 1720347.025 917881.6265 569444.5766
10-GINGEROL 3717854.863 4128791.409 3259720.189 4490891.792 2346964.664 5377320.643 8639873.823 8062549.286 5089602.363 8906034.259 6970042.491 12076465.89 9910674.355 10155938.02 4266338.329 9513692.367 12582353.4 15082616.51 9910860.345 9310629.87 7416155.975 13999741.83 13996477.68 18841116.52 18218153.28 12435424.05 11825932.14 12269255.07 17996836.65 21306555.87 22905899.05 20618978.09 16121003.41 23308562.2 17500231.54 26102405.22 4382477.784 3397255.724 2292945.173 3331172.235 3570998.623 3789030.726 10740718.27 6422934.432 969857.8397 6230949.237 8703653.764 11215328 6499484.016 5320994.244 9375823.401 7767414.517 12466629.33 11180050.14 7277764.337 6534311.941 14014520.61 18112009.89 11927469.16 10783665.24 12114069.84 12300255.65 13167371.89 17166964.97 12738810.59 17139393.27 8769780.439 8533000.499 7748863.658 5091361.938 5829942.095 11346751.24 7876064.399 9500777.639 13533144.78 10877244.76 11897913.33 15657212.57 11028116.17 8422690.546 8866056.765 20215143.75 22849337.89 18082556.86 11730647.62 12843567.57 27388356.29 23931347.09 2479533.093 17272396.18 20089036.02 22119036.8 15069658.39 17094988.9 27402704.56 23581261.46
10-HDA 5449288.073 9566045.878 4359259.058 5610552.212 6491986.25 9588871.952 6847095.901 9112627.179 4082458.87 7130091.807 10958068.47 12271310.91 10357344.84 11399501.62 5434250.616 5008486.786 8865490.533 13528906.7 7137703.718 9091845.961 5874865.185 8182210.245 9437742.845 13057767.84 9031038.487 8524568.987 4579083.563 5422570.345 7992525.739 11540553.49 7337701.99 11310910.3 5081598.233 5449247.362 5797988.68 11234893.98 13015548.57 16350033.49 11956619.7 23330098.97 24041715.65 15102430.01 38924860.09 10466840.05 5430308.432 24208096.06 18450953.32 36480948.89 12121242.65 27710371.06 27599154.31 12164340.93 31532733.24 10004858.32 28535771.63 23075877.27 14089620.04 27745528.34 10162221.7 26160628.43 21414882.38 9292647.102 13318929.8 10793746.04 20878721.93 19817254.91 16278231 14889236.98 17385888.54 14298681.19 14982668.88 14986457.3 15275934.76 14388469.31 18151986.24 14621355.9 15027893.91 17184864.57 14720214.26 7390296.55 15182230.87 14971183.6 13585949.96 15378662.26 14834141.07 9039201.345 13676901.83 10619711.77 719305.6783 8632859.1 13580501.17 14848445.99 2708138.794 12125417.73 14637455.66 14882461.87
10-oxo-8-decenoic acid 1083677.925 1491340.893 917799.1287 943672.5153 1007447.721 935482.9886 1064914.674 1102070.198 1096928.383 847150.1565 1421936.268 1227291.238 1323783.004 1416832.087 980644.4897 869348.8774 1177643.372 1635824.926 1437350.682 1297223.029 1205227.275 1685265.385 1250900.672 1583159.335 9958284.156 1572377.397 1119163.529 1329498.118 1522121.321 1460207.319 18739534.32 3109706.108 1786742.063 1281003.603 1137329.328 1494638.919 2832865.009 4324641.693 2495230.752 7295560.443 7461573.196 3267173.665 12970476.96 2113005.93 1560526.774 7025471.256 3922136.645 12274180.73 2876602.288 10405100.4 7893308.971 2517517.071 8678637.707 2094991.85 9655013.985 7177153.03 2671526.371 8896810.27 4432382.249 8180652.808 6095911.569 18903436.02 10136394.08 4561029.727 7073549.51 7016245.079 3257919.879 3367399.529 4148875.064 3646828.399 3642913.891 3700277.755 3703502.408 3326388.058 4393697.281 2832267.492 3356657.632 3742630.502 3261752.829 2222424.176 3380353.769 3056146.921 3714643.79 3969664.693 4271702.003 2282090.395 2967922.991 3203268.229 308841.9164 2741367.524 3526223.39 3436481.626 886554.2607 2841526.455 3749880.627 3232889.581
11,12-Epoxy-(5Z,8Z,11Z)-icosatrienoic acid 25925215.73 54042265.72 48001049.77 57859481.87 18470421.64 23640081.62 333156920.1 403700893.3 624735273.3 728164587 467256645.1 746833842 1676138079 1507970488 1404527873 1198737477 1353736379 1718876027 2726114407 2167942752 2241211641 2891149439 2639563927 2512747351 2123467613 2014164401 1924009359 2124999921 2360638355 2252786321 2174453886 2102109599 2092312659 2515813456 1963243209 3521017064 16730860.09 7840349.229 29279623.72 152137683.5 63054561.53 428134740.7 202545915.7 221152795.2 170058185.1 539823278.1 1074788691 834777864.7 618334371.4 1716524519 1509386589 1204313188 1205300247 974278395 2234886473 1538146699 1341532139 1293751627 1075393281 1920263422 1922251715 1205799745 827189137.1 1162005485 1768700570 1735026017 557297849.9 487105927.9 565724906.6 76782627.53 107405825.7 2078010666 1794652054 1918198131 1511640318 1535440891 3267029310 3102024816 3343450804 1695767801 2750571210 3778335773 3458549291 3595535302 3888922474 2691603170 3744090464 3436141906 355328020.6 2865559311 3734280659 3226699769 1457277120 3359120016 3511737143 3766716774
11-Aminoundecanoic acid 21855760.6 10283371.36 17222416.71 13364248.06 14505529.29 14637313.69 9662634.108 14242925.57 13438836.55 12214849.92 14298531.24 6226048.628 11145134.16 7869082.83 9454701.6 11273285.9 13976981.57 13706730.91 9012290.193 10102021.35 12533852.63 13277775.17 7233860.126 12641048.67 15182349.75 12574014.09 9569191.477 12937738.06 13780851.17 15060217.36 6978571.567 9835097.029 15747135.68 11183105.6 13808459.07 25826679.83 13526042.33 9339612.993 16873973.87 12244117.4 17300487.68 7875672.914 8110401.506 9400625.954 4976420.705 16494614.79 12715638.32 14388418.69 18450466.51 11627556.42 11872918.95 8745219.509 8929846.445 9435188.361 10792641.82 7308801.97 7651816.084 12126029.25 8482920.223 12094462.76 10227710.94 12123411.99 9316011.896 16663686.25 14734845.5 11925093.13 11272566.8 18620456.96 10344273.4 13685635.22 14794001.35 13675315.28 15143475.49 8445320.284 9177062.171 8005738.37 13910288.19 9951927.684 11205028.33 6760706.982 8029844.851 6569860.205 7279460.231 12243445.97 8796512.585 13685856.51 7657890.463 17577274.49 1790405.982 7629004.796 8801282.368 10078454.26 4814540.898 12302872.97 13633301.29 14310031.65
11-Epiprostaglandin E1 1643044.494 1728104.106 1287712.924 2835534.917 2687769.205 1953983.904 2201577.106 2214523.83 3848762.206 2807497.056 1686384.574 3928177.785 8458469.887 3565858.45 5310454.094 6497013.282 4546000.215 5313191.975 24775451.76 11386061.96 11793375.49 32225461.6 15861921.06 11734324.27 30855663.06 11079381.63 13248844.23 22138011.95 16376957.85 13807722.99 39003498.74 19738790.81 12921476.3 19980574.23 15194754.15 17332554.64 2332684.155 855142.3715 3341964.398 1957082.027 1451344.867 2181892.11 1450110.322 2647674.34 327815.3647 2206002.032 3161083.689 4708166.289 2031660.043 6594826.298 4737186.784 6345577.597 6740628.421 4498896.719 11526185.03 10626393.34 9608616.432 11214333.81 8422403.829 10086549.07 14317528.61 8617971.865 5246027.521 3448528.965 10592478.85 15346585.43 1714670.564 2471196.017 2004777.884 694084.4826 1957321.619 6879404.195 4722023.884 4432264.683 4703109.173 5361917.357 27452084.2 12800927.68 17696260.3 6830377.82 19018746.06 126049716.6 142648804.1 114609533.8 109619584.5 86594819.51 118909851.7 131208775.6 5730112.758 71984925.36 133935743.6 116431207.1 30462250.62 113361711.9 103870291 153730605.1
12,13-Epoxytrichothec-9-ene-3,7,8,15-tetrol 14535382.05 11726111.39 6095360.114 9069973.861 7522720.391 8017356.062 11833176.59 10760174.1 12063156.24 7884074.517 5995876.458 9426790.43 6541609.663 6248899.61 7791194.993 2277351.259 8238185.554 6034760.554 7314279.468 7285054.526 7185238.195 6605056.23 10377503.09 12038272.32 7402860.774 9781673.045 6073255.453 9956095.024 5959031.924 6488782.171 3418532.257 5751650.28 2841649.173 4692331.156 3263951.824 5040933.016 11320967.46 7116662.13 11869061.36 11887883.61 10488324.41 20767502.94 14195837.21 11320912.66 3163055.962 12913820.32 11615829.54 9582583.837 11322433.88 11301092.23 9898416.881 9346875.087 8408804.436 9702605.242 8688080.781 8676586.969 9794823.152 16136465.27 12873589.58 11181555.07 12610656.64 4165181.792 5053165.354 6448169.867 3863503.311 2195589.592 9746888.713 16681724.75 10593874.18 12469064.26 11742878.18 16054692.41 17181052.08 10277696.94 13765371.09 11654200.08 16176958.54 13925615.72 10956722.27 5603639.248 10955569.1 14588800.95 13104624.13 20324217.04 9806502.09 9139870.953 13196601.77 11578738.34 611924.4403 5053733.833 13062482.27 5910840.437 609404.5664 1870719.145 2289349.087 9905889.832
12-epi Leukotriene B4 146908.546 765089.6729 130627.7469 548367.8762 335314.8194 804578.0751 393560.8599 656826.4515 546125.7027 742858.6259 1096200.463 1369017.357 3115918.801 2554772.317 4179347.437 2947963.469 7382605.26 2542653.304 11838878.51 8577516.439 9059448.119 20662471.25 14060411.11 4356553.836 18473084.17 10879298.52 12001191.53 15364992.84 11305771.17 4400984.278 11226743.87 8456424.415 5913922.793 7586427.346 6554442.226 7518564.689 308859.5763 260378.7516 916632.7754 646958.5504 390006.223 1376602.038 184256.0707 1625823.465 424031.2725 1285173.909 2152482.059 1144334.121 1239601.998 8339902.17 7550282.439 4657509.948 4561627.332 2178348.104 18027490.94 8345772.604 9265103.972 1940877.236 2190698.29 18904976.66 14684391.19 16129812.85 8571183.975 3374679.102 7405815.814 16739764.57 370686.7332 382042.3657 285517.9939 112636.3931 312400.2909 2423222.078 2627804.534 9992163.913 1868944.826 1559602.111 15681077.98 5661257.167 16311487.59 2013830.455 5341332.27 32957607.24 35779110.58 17400986.8 13239160.57 5261191.16 15787130.33 24729174.54 729441.4195 7543557.261 9262276.645 49961961.75 8602093.139 11804607.63 15801728.15 26523248.42
12-HSA 2429619.146 2196899.664 3380951.001 2200048.076 5736622.014 4461115.214 1791905.629 2279562.314 2300043.327 1755790.029 4728440.135 2886624.825 3573398.551 3135154.775 3021045.925 2717401.937 7717533.012 5088440.426 2618201.607 2550046.336 4379642.53 3963085.155 8149367.479 5281492 3950291.597 2469991.159 3715733.753 2752529.589 5269617.976 3732915.764 3245525.545 2959016.896 4237135.344 3508724.454 5940098.672 5198316.651 4576302.19 3248046.206 3211087.816 3202810.837 4254228.776 2651486.932 4989543.504 2767221.128 666464.4885 3064159.477 2954732.48 3839403.372 2243096.435 4496066.736 4249127.33 3558149.133 3770497.147 2675255.323 3504514.21 3567433.473 4375529.182 5143477.075 3191999.484 4226324.048 4660124.567 2821551.695 2165728.166 3135952.122 1879006.535 4672736.326 2104344.952 2202074.424 1472582.781 1207621.029 1532898.946 1571916.093 2063600.977 1628404.639 2470535.825 1506203.935 2245582.571 2930244.845 2023124.665 2135611.734 2175678.18 3467828.519 3246828.805 2543044.748 2862907.917 1938965.906 2027125.501 2414784.571 278492.9111 2333204.987 2781445.134 2015464.306 865193.8683 1897865.656 2653530.397 2803443.432
12-Hydroxydodecanoic acid 7590512.913 16960323.55 3678914.289 9221223.801 18373954.99 15858726.23 12149999.78 31786042.98 7565169.186 15941907.31 33105879.61 26436226.94 19894339.85 43118531.17 11224616.72 15306456.02 31436073.62 31137427.05 23413701.43 43945712.91 15789903.35 26777730.18 30448543.66 34385035.27 19945956.72 39425361.84 11935777.64 19785119 27441538.67 27140160.31 18943117.53 40912909.52 13531005.49 18944874.75 20551971.58 36437240.26 23558024.8 6947489.431 31732140.51 6659832.998 10299933.38 26822799.31 14017369.86 35795287.01 2054600.866 12583336.09 33423775.73 16773975.88 35478890.82 12700455.07 19062276.44 29503651.3 16116575.5 32558676.92 13683302.24 19035233.04 28345762.71 15723592.37 33834372.65 10802302.73 18048258.32 26515545.18 8275791.171 30197471.36 11130047.84 19275428.19 3070704.778 2667526.52 2120313.484 1533337.618 1621976.321 4190024.39 2676469.437 1629162.661 1983658.242 1299287.909 3418758.557 2867866.06 1955732.524 1746567.255 1450575.638 3086803.354 2602714.96 1809714.004 1847731.724 1035508.16 3328711.971 2326200.12 519696.6075 1149087.927 1710352.235 3002374.928 595434.6136 1985071.189 1893128.216 1713591.772
13(S)-HOTrE 2717673.773 6273517.158 1210742.052 1992665.671 2179875.155 2358372.553 15885969.72 18884385.89 16676958.32 18114423 14742141.13 10951824.39 92890541.13 67368573.56 52270716.24 53802488.89 50363158.72 30712990.57 203541649.4 147817857.6 104332948.5 160747251.8 134635702.6 62565161.06 173531046.6 148887104.2 97955170.16 111306483.6 136081359.5 34983750.58 168584269.9 152146924.4 97549980.51 111923700.1 92699583.28 70223187.45 5750544.029 2286269.821 3301329.984 4437782.686 3205879.815 26785139.97 8461004.864 7162764.888 6769303.761 15845901.64 54526423.62 19725318.09 18398761.44 79486277.33 47242058.95 76606738.28 40908323.37 36811418.97 102676175.6 88766888.19 92269222.66 41646173.79 41170942.33 110526318.6 88105537.71 78196694.73 33774053.61 42074747.44 86098137.97 93494211.88 4130788.129 3692774.496 3501432.063 3257748.006 3358273.276 24229115.71 20600991.12 24141593.34 12597055.97 14182941.97 39297584.31 39201254.31 46610196.98 12442286.13 32103428.9 38019086.92 38232806.33 51998870.9 41654815.89 31025008.07 40682037.54 36304872.11 3143853.55 29385488.5 37061047.69 43368382.64 11476428.8 44193846.32 44140521.37 44823945.18
13(S)-HpOTrE 64083.74533 314908.4812 84938.09902 59549.79071 491544.1533 311074.5468 1072214.783 1298553.282 1182355.94 1221246.96 1284259.525 1313179.384 7771015.756 5152427.708 4131368.995 3657877.087 4311280.299 3002220.105 15273627.95 9154504.525 8750889.987 10524959.36 11327981.22 5174250.204 14525903.86 8453927.032 8111201.127 5844306.253 8442883.946 5464499.364 12755779.11 8709633.233 7350018.647 6620442.263 5063878.954 6211589.211 223752.0895 76841.69773 116596.6137 337351.2655 190933.5978 1925710.118 719152.4704 428710.6228 482078.7938 1585203.46 4025856.062 1999259.534 1337054.391 6307018.063 3797937.615 5063117.021 3148135.361 2654212.631 9708867.888 5794902.721 4994478.116 3687830.641 3089726.584 8750110.944 5849258.091 5172652.504 1862982.948 3023338.29 7183786.211 6224680.655 563550.3654 398098.9309 351178.001 130442.1914 109454.0862 2655775.37 1633952.86 1748481.951 1329411.25 971523.1625 3522339.722 2998248.137 3359028.643 1006703.755 2173785.949 4254773.156 3473228.672 4410624.481 3564236.977 2050958.436 3653468.773 2874115.492 152140.5468 2239272.246 3146138.27 3671202.845 616009.1975 3203640.041 2909942.624 3342850.796
13,14-Dihydro-15-keto prostaglandin F2α 2805650.081 2601710.058 2625869.868 2214952.532 2135687.983 1964932.444 1843507.076 2079585.716 2538462.086 1987170.744 2090309.196 1966240.051 1600635.499 1624510.428 1878201.385 1527219.226 2821771.722 2112801.875 1799257.292 2710350.591 2095678.384 3679817.75 1659656.194 2504078.738 24299246.95 3013555.816 1971076.032 7667053.855 2491604.879 2620662.649 30172651.03 12530828.57 9209476.893 15301437.73 6481008.277 4167620.766 2169192.3 1458049.454 2147566.765 2654069.874 2160005.97 2306622.105 2206797.014 1775446.398 909071.729 1685243.166 2214221.808 2536782.139 2434426.142 2152295.601 3915716.585 4392905.538 2053900.498 3904749.273 5433635.225 1657601.152 5079444.133 7496200.431 7658294.422 2107554.25 2433252.275 43977405.98 33077226.57 53841575.55 6110592.991 2419038.321 2273420.792 2878683.373 1844026.6 1758459.881 1892209.389 2418917.583 2446509.688 3231472.421 2050340.142 1458639.687 2800441.75 2419032.963 2373156.503 1492955.092 1745035.939 5683462.573 1941860.777 6345783.622 3308322.553 2302209.419 10805408.98 11170501.63 1981593.148 3887131.484 8916377.709 8451779.947 2655024.246 2701661.54 8948385.444 9684015.071
13,14-Dihydro-19(R)-hydroxy prostaglandin E1 312022.7967 935065.5736 288741.5751 346767.4592 361921.219 428542.0558 296991.6318 747927.6954 276445.8016 937929.4441 473748.0934 557503.0801 1702399.621 1488860.515 1017239.433 1021393.891 531692.4941 955376.9478 3263698.552 2417736.105 1896151.469 5348849.085 892507.1923 1522765.335 17874145.38 2849672.008 5261691.034 6808184.127 2296323.705 2644001.633 53218201.5 14204304.97 12287798.96 14636274.64 7211240.234 3654518.094 259673.8137 241384.4691 262929.0393 268699.8337 282473.0781 831251.1323 268330.8363 264144.7396 158320.117 236387.1094 1000025.463 722338.9971 464239.9854 1254928.663 707248.8836 4387961.492 668935.3359 740560.7352 1974702.468 1646942.201 7804223.176 5341808.053 7663399.554 2065691.274 1641591.083 34963863.83 14914470.74 25910939.8 5286620.098 3064310.401 301516.4659 285299.0587 286622.6393 242662.3877 261449.5433 521751.806 571650.2979 536977.8704 829215.03 234737.3368 1361487.221 1983004.142 1367098.668 723711.8588 1245603.284 1627863.038 1410125.101 2844147.953 2698924.359 1575788.231 1675053.563 2113145.57 156782.5172 1482958.06 2276259.256 3301068.528 598573.6241 3226789.313 2859257.661 4098103.168
13S-hydroxyoctadecadienoic acid 19670495.52 22279824.3 14287846.66 14687827.7 13304258.28 15200368.23 16739980.7 19889116.3 13793440.87 11585823.9 19982413.23 14109995.49 21824733.43 22242900.39 10421048.79 12682172.37 14447451.73 18436013.21 19798461.95 20677128.96 16788790.64 22582712.22 12103844.22 17543018.42 24243821.93 19353368.97 13043163.2 16378050.38 13668829.57 10639824.51 28598852.11 31259109.92 21658607.82 19554973.07 21550358.44 29229640.82 13563401.09 9191106.411 16621827.55 16651000.54 12213749.72 19760184.72 16256855.18 15800996 4168142.727 17156693.01 21791779.15 18512552.12 18772145.16 19305902.76 24940805.64 15562445.47 16244690.04 16012716.61 20581404.34 20082785.93 22052624.63 17137881.6 14830118.82 16221740.89 21273144.55 25918185.11 17918137.76 22177640.56 22933155.69 24795381.96 13455842.57 16852715.34 15887021.14 9065690.928 15028643.12 11282703.81 15656920.77 10470108.37 21728799.28 9451223.679 12406346.97 12483023.46 13959222.06 6964853.582 13716900.96 13640142.61 12715121.22 14457232.7 17971808.7 11230832.53 14714903.46 14489540.11 1807948.715 11257003.99 15706181.08 15778710.62 4000436.867 17028582.12 17438407.7 24008556.47
14(S)-HDHA 1439477.06 4746764.302 1534998.339 3543213.99 2019488.952 2337007.89 26833085.13 32167676.52 42645839.32 52818953.86 37180580.65 58625664.47 130513824.2 120003438.6 174751062.8 124958200.7 108624536.1 152722204.4 275271965.5 185771649.4 284126118.7 303099448.3 280545554.3 245271205 259153872 184809168 192134104.3 230831739.4 264636277.7 229277219.9 135819193.2 250008859.4 237642630.1 221724239.6 178019896.2 307346369.8 1256971.532 786584.5315 1218383.929 2426950.994 1356328.468 47405476.77 13977928.31 16776286.43 15498074.02 38009822.57 108271913.3 42867010.07 57445384.03 139862216.4 104922838.9 126661965.1 96390106.22 77440101.24 237599660.9 165474813.7 167888636.1 75130675.71 75164610.04 221749443.4 151850419.2 111023823.3 67048374.47 120291712.2 157886803.9 154546688 20836974.86 13905280.93 19088461.38 3764244.122 4052850.643 135105718.3 104765004.8 106563564.4 71784051.18 76901041.51 265065191.8 202196626.2 247480148.2 90026865.34 201451175.1 280527217.5 237185288 343296808.4 285500610.4 227991467.3 272998115.8 208125116.3 23545511.34 184952001.7 322173723 260738163.7 81536260.81 227496128.1 320058391.5 319199441.6
14(Z)-Eicosenoic acid 7034783.523 7822637.528 5222901.495 8054375.6 5456204.534 4673963.396 11824937.22 8778963.425 5030091.162 9811536.818 8150465.542 5897052.232 14251370.33 11094739.79 8204183.913 12283904.57 10133201.59 8024505.528 17337439.06 10796036.46 9833835.316 18233473.36 9769127.509 8549099.89 14464024.52 10985703.28 7554157.634 12262780.1 8880716.269 8699398.106 14155475.35 9621911.89 7416548.438 9807837.747 5330897.828 7255142.281 6013316.418 2239535.939 5128002.108 2971304.776 3204318.173 6260905.069 5378738.577 6613117.085 650393.9317 3660797.48 7281051.515 7634773.732 7561769.058 5869321.581 4679509.151 10440130.76 7640580.075 8464006.011 5654110.676 5072687.639 10390910.34 7464546.066 10368918.04 7143864.394 8102727.128 7377758.561 5972315.155 10105889.97 3914940.256 8405314.034 3323383.39 4086805.21 5166124.224 3524137.217 3420560.739 4316704.246 5442253.26 5445770.655 6070535.976 5721378.547 5831449.174 8510408.417 6441258.028 5761591.934 7468123.659 8446858.504 8046585.126 8408061.444 10918610.6 6667690.693 7595714.199 8273321.428 479244.0732 6732249.565 10228902.58 5390097.667 2295430.654 9930268.166 9139185.797 10716195.01
15,16-DiHODE 865415.0783 765129.6943 609656.0416 572830.1056 975300.7058 637047.0243 602379.394 795950.3492 659444.0086 533596.965 1568503.341 637951.0994 783965.6841 661944.9922 550586.9136 480882.129 1296869.299 583960.7528 922825.8869 697611.1692 605504.5697 1119883.498 1259815.031 913592.9292 6276529.002 1234191.906 1031857.486 1889700.989 875832.5708 924739.6321 8880018.606 3340579.303 2655585.349 1945492.629 2764883.845 1087044.4 761801.8382 555691.5339 1035666.443 747725.3371 1020308.215 812326.6771 664590.9876 612298.6601 348277.0619 903913.5772 629725.0812 814402.3846 1072789.134 872149.4889 1124192.969 5917329.739 1131649.017 897848.7076 966067.112 717506.9586 9530456.895 2181201.58 3223406.96 767936.0347 635056.7115 20271788.34 2738730.164 7359852.572 1809214.186 1093334.248 713292.2356 931062.1309 583323.166 483017.3382 864473.4556 655806.9001 674658.4378 594430.2226 657669.3259 516049.7695 907743.7664 852313.9386 689078.1252 2452129.663 622982.9194 850839.7306 832284.2523 932260.7911 969659.4326 789726.9951 919063.9274 714173.3133 306801.8359 454977.9534 825191.7595 950949.7425 448958.6132 1013350.724 1087631.332 1351036.171
15-oxoETE 909712.1347 757590.6638 973303.1738 603766.2963 735873.8809 880609.2052 615616.4196 725353.8135 1131060.694 672538.1111 722537.6975 651022.7841 1425868.615 714113.521 593610.5958 1429633.392 1456136.855 1439686.879 1359876.752 762888.9499 1712078.922 3882333.225 2015264.583 1666565.677 3000330.073 693943.6041 1306568.935 2471666.882 2055426.686 1233583.742 2116083.091 2429676.978 1575469.277 2763800.352 2172976.283 3344034.668 865512.9204 621483.8928 639869.9441 711527.3682 619389.8442 912905.9485 885818.6701 878368.4578 374253.9969 657210.1719 966305.3957 757663.6473 878572.9474 953234.3696 1432632.922 836668.4888 852236.5479 784122.9167 1601629.475 892828.4948 1414464.712 1060019.125 858431.9941 1052658.487 672905.7132 2149450.113 3107771.107 2825185.459 1323072.094 1606048.279 571359.7412 927188.5423 650974.7893 556097.2757 661692.0636 933282.26 1853994.982 2146189.92 1115896.261 1472844.077 6749966.75 3130564.267 4107146.404 1944199.998 7382044.349 9019944.728 7835901.071 10741348.24 12234799.75 8024438.412 9792989.405 13914020.73 624732.4483 6899130.164 14901258.2 12331898.14 4814135.134 15011720.74 18264193.56 26945074.25
16-Heptadecyne-1,2,4-triol 139718.928 250091.0315 479823.7682 297471.6938 691135.0361 228124.8313 432153.945 356833.6308 568170.4158 509792.2481 272939.046 334332.9061 147985.1764 332708.6427 194592.2715 281782.6912 456576.9377 438330.9637 221220.2235 209128.4068 581338.9647 165489.7172 355026.517 148514.1334 326469.5009 226900.5199 214967.3226 398443.7794 161297.4606 253585.4316 233996.3126 305070.16 408753.1406 332624.1776 373068.3859 448253.5817 196748.4771 655216.0612 238446.0668 97069.30181 322425.8412 379808.7181 385528.3044 193014.4465 213678.9092 392964.4319 419997.6428 498858.573 398555.4448 396693.6464 221731.7768 287057.7877 405884.8771 610585.6037 390484.5294 191224.8879 383776.3853 230175.6001 478781.6495 272992.8351 291382.5607 357380.5574 333630.7526 133923.7617 247572.5659 223674.1109 473246.1942 166742.4335 882802.9039 158521.3458 435096.4545 139669.3268 289037.0705 467409.4939 560024.4416 222012.0175 648900.9834 367415.0931 420794.5151 5028894.48 499867.467 314514.473 193255.494 440211.5375 157908.7359 228885.507 222695.8111 471912.9579 188705.9786 161495.978 394486.1196 259984.3131 317641.5161 333335.8652 379612.442 514925.7772
16-Hydroxyhexadecanoic acid 3226532.013 3552899.679 2993727.41 3552695.067 3335603.242 4288361.174 2315303.631 3310325.627 2469404.84 2560661.367 4718534.931 3740521.004 3958679.528 4619179.697 2804348.512 2992213.278 5606556.835 4940370.869 3797317.403 4533666.43 3760712.48 4654035.969 5648308.571 4680219.933 4875743.189 4073364.411 3462842.538 3664952.423 4895859.353 4358989.206 4665184.63 5056970.815 3960940.342 4056180.245 4462099.689 6645402.865 4636522.136 1988733.185 3361707.888 2273344.827 2627473.389 3900707.222 2897268.239 2842442.137 707561.4691 1950859.478 4439998.361 2980726.691 3087240.487 2435633.104 2838152.874 4356841.684 2825549.203 2787484.327 2936811.458 3157970.087 4844608.145 3206802.256 3513670.334 2555777.723 3406762.601 4301822.028 1363527.076 5135468.706 2293066.207 3083564.054 1404837.115 2069423.96 1498451.476 1145197.789 1420292.248 1705657.353 1629503.406 1381452.926 1589744.034 1418491.036 2106315.312 2400834.073 1894746.263 3051258.714 1700196.687 2068251.077 2325944.365 2140760.641 2636578.119 1601996.218 1776815.898 1911875.435 559199.6348 1389121.638 2298184.426 2129315.793 1107668.173 2012682.766 2132621.841 1898984.077
17(S)-HpDHA 228754.9674 245777.9267 198417.8621 205474.0412 234787.2979 247872.1606 847077.4514 619179.7086 1130741.164 1281001.777 1063237.654 2845413.458 5697859.333 2184544.2 2522729.542 3261272.394 4838458.781 5428015.853 9820009.673 5556969.481 8983560.355 18572492.79 11308575.76 9791728.58 12245232.56 5712098.887 9685096.873 10195467.34 12552696.74 5943666.241 5606302.923 10811592.11 12745738.03 16364511.7 11830461.74 13964825.31 271309.2283 231437.944 232087.3393 260397.5781 229172.0333 578867.6477 295972.8496 430773.8119 474159.1404 832945.1092 1799069.817 1076928.583 579623.9221 5532799.614 2152846.94 2101501.139 1334715.321 1108691.332 7414663.774 4744060.307 2273909.973 1700497.422 1799638.875 8737798.875 6353106.055 2620616.261 3463254.764 3667558.296 10221219.19 3764784.364 963524.7176 717466.0875 1289637.072 307999.42 237378.1966 4765579.702 4091777.728 5317426.648 2088849.83 2560904.535 16947678.92 9703193.71 18156098.9 8979252.906 27755936.57 29353247.11 34759022.58 42746777.38 42406012.5 30036829.18 27220862.03 33131573.87 2506764.428 25746126.7 44369936.37 30986687.96 12158133.22 35682263.84 44072704.69 54169766.75
19(R)-hydroxy Prostaglandin E2 320736.9966 353702.1634 274085.5611 363953.9976 274774.4358 339845.0598 310612.2912 301004.4691 296619.7934 332916.7984 371562.8255 315060.4802 1463678.032 501477.3635 298020.7044 699909.7148 605848.1076 568137.1565 1745218.091 563092.6208 464130.5553 1991723.458 990670.815 1326043.925 6652996.634 504091.1036 1456435.011 2631970.121 2123284.714 1085906.847 15565462.05 4306970.653 4226571.172 4615862.943 2773398.101 3608436.626 634167.6845 271417.1739 823815.6119 699838.116 316924.9526 448796.1077 900007.4147 333322.0235 294968.6619 367773.6271 552172.4498 407624.1103 354628.6597 1120972.151 481628.8398 2293002.749 1020075.039 303074.9794 1515328.629 1482965.487 3551693.228 5600506.389 7212793.229 551453.0721 527699.469 20181143.99 10546489.11 10513671.72 2537815.621 974301.4263 280090.2026 317804.2653 365832.3262 261576.4194 293477.983 849529.3074 926395.1809 680472.1627 754967.499 657964.7791 1455154.192 1701415.699 1310949.525 647931.3351 1154950.649 1963924.792 2047241.455 3538074.265 2798695.978 1968610.502 1427911.559 1259299.525 267156.3359 1504314.498 2197651.934 7716385.713 1435108.382 3612244.727 3837031.49 3259133.476
1a,1b-dihomo Prostaglandin F2? 81256.18299 83251.32378 78782.99 72795.49411 67786.00512 69619.37179 75907.53169 92712.89439 188875.3437 262731.2015 229176.6751 149185.303 940962.1158 426094.4163 729024.4778 698567.1901 650039.4234 660294.053 4132201.664 1953283.405 2854735.162 5009646.612 3146615.933 2265680.622 5793489.745 1774882.972 3131178.114 4308023.436 4402398.514 3565808.492 13450137.47 3479914.459 3601574.212 6462752.651 5259789.74 5943911.318 64338.71209 64304.82857 77910.61385 69853.80385 70242.14917 170025.5412 72758.13071 68322.56632 60177.8577 193608.5897 499835.0547 299163.4218 116154.5405 1190761.14 864686.9693 1245664.091 969234.5368 697241.6125 3069440.753 2333696.93 1716909.753 1655664.338 520005.2244 3196508.179 2710460.406 2076549.824 1223915.358 997845.7876 3854670.636 3551627.387 66479.45354 77719.64898 73855.15051 68209.21327 69793.99252 864339.3177 451788.6457 824924.3723 541975.4327 720541.5476 2636861.259 1388144.837 2714978.263 642283.2925 3037382.263 13995388.43 12158408.62 15242120.73 14791532.53 12200510.76 20872856.23 11914254.38 647705.988 9604414.603 18413481.94 17432366.59 3117660.13 15168786.56 19439562.24 23933317.76
1-arachidonoyl-sn-glycero-3-phosphoethanolamine 243075524.7 292569883.5 231348009.2 430051587.4 348544576.6 381765154.6 389116438.7 325834432.8 250407157.3 431528706.4 476840684 267444408.1 603719152.4 408382502.6 287896400.7 565576709.3 618888645.7 462687503.1 261287559.5 270268904.1 270739971.5 555077423.7 393166256.9 338657285.9 480353206.3 351166836.3 282477034.4 369794617.8 344123510.1 356822601.9 676604723.8 637752523.2 639081792.9 701065931.3 484920487.1 843702843.9 404603993.3 197298871.8 263497963.5 376682579.1 324741605.6 309366674.2 351792064.1 266077933 60470713.86 265953048.6 389314820.1 507188563.3 352519559.7 355453276.1 454066229.9 272799011.1 312904548.2 228339622 308741862.8 300003943.7 388972614.2 391072942.8 296159253.2 358611917.1 434254113.1 533895147 500228735 601520983.8 475419853.6 635690465.3 425749743 425177326.7 500339948.1 303222540.2 393904647.5 749901014.6 567901410.7 522524000.5 675707342 607996615.6 855477977.4 845633949.2 748984261.9 465102580.7 612045805.5 1015479336 1192020088 1128064856 886882062.1 669853988.5 1154047281 891516372.3 107210844.4 714716906.1 956496722.5 928267919.4 437505804.2 1056734392 1060345900 1077879633
1-heptadecanoyl-sn-glycero-3-phosphocholine 81709954.2 83727977.22 77592133.09 90003534.11 49282629.84 58303135.36 98189004.04 109724713.4 97666635.19 93256407.39 68215793.82 65357762.78 181428200.7 154202835.2 114556825.4 163457099.5 94708812.88 97150496.83 195430674.6 179748325.4 132241490.8 210708996.9 89086754.89 93444649.55 192112969.2 118122703.2 93258993.22 125003921.9 60041022.33 63893905.12 127528338.5 112647201.7 89130686.3 114951839.2 49576059.92 78692135.03 89715708.78 58755014.85 84725646.39 75795939.98 79718273.95 88197077.03 81563240.19 83918229.05 29366304.49 62093305.59 116050087.9 93948091.46 99088476.99 122447896.8 106781057.3 102484563.4 96049048.33 85408695.03 140578868 95250694.75 122749084.9 100385355.9 86069687.98 97545082.56 73906940.39 71745444.38 52314563.76 55738869.83 65820113.43 53352810.13 64366122.5 66281191.94 65329850.02 57080577.4 86868744.72 49999732.82 59143715.05 55947424.03 54987522.14 43002900.99 48073065.14 91144741.94 63276159.8 29943116.88 34967435.5 54994240.04 82316839.84 66300910.46 51179694.02 31900665.09 44769818.08 59753941.38 3702746.5 36343455.79 40844042.19 38209173.74 16202985.7 48655100.13 40570739.05 32533913.68
1-Linoleoyl-2-Hydroxy-sn-glycero-3-PC 2836225132 4451129080 3228920998 3745547318 2425565544 2232622749 4196766862 4610120893 3855059382 4940793248 4633362546 2703428829 4894852078 5307728120 3958230687 4350877778 4561949742 3318902590 4803447855 4764614322 3904319821 6400179565 3891592827 2686170750 4450329134 4677329641 3469978253 3821150956 3108588926 2562783082 4154344813 5308288928 4275283266 4860688515 3043971921 3183418239 6055315366 4110829889 5655464449 5208562023 5145880518 7597221516 8356110122 6127139897 2168472509 5626330364 8285043546 8423966326 6445819119 7153621661 6867753744 6065056214 7446800632 4771945233 6681380043 4674725933 6498103070 6632634929 4823763148 5980166453 5483334365 5610684544 4353646886 5149929042 5226852349 6240089628 4697559224 4501711763 5492436374 4180391546 5863221786 4938152599 4402370042 4763943693 5692068354 4563374380 5265889047 7008112941 6032680052 3493594050 4860387767 7449166591 7823542851 7967082450 7294640214 4815473460 6711422783 6762815990 813683910.8 4776483982 6525088939 7123470222 3078119750 7240993786 7606762632 7486709441
1-linoleoyl-sn-glycero-3-phosphoethanolamine 187935612 205463127.3 161521182.9 242128987.1 147285133.4 172224840.5 352493652.3 251534309.7 241324290 413944017.2 235487239.2 139143590.6 573312167.2 329404778 240314115.1 398537367.3 259096038.8 234386397.1 413632304.1 286403620.4 221883569 521911911.2 224801407.1 178002258.4 620887796.4 355153685.8 272486686.4 320293609.2 204212969.1 244490709.6 662292568.1 482461740.6 438259169.2 566932357.9 298011996.1 570684668.8 222906096 177663197.4 183123362.3 218275044.4 198100241.7 329929860.5 427060929.4 264749608.3 90940236.73 273738248.8 425980043.1 527916254.5 301134178.1 480140079.8 458302255.8 279106861.3 430377849.4 298393983.7 420304867.9 359645632.3 403012638 428467962.7 334776980.4 385738580.8 361850354.9 640824680.9 405699546.6 448993760.9 448112800.2 504194321.5 245020146.1 265740787.5 301192230.1 250204815.6 290555052.3 419093073.3 367981875.1 353915999 425758706.7 350678763.7 523414972.5 557715499.7 459158551 268811833.4 380386463.6 568416711.7 620659776 717560905 665228676.6 359615772.1 656530274.6 627701137.8 60930904.32 509496964.2 546800913.3 576335720.7 286433990.9 695444460.3 813136899.9 621568099.2
1-Methylhistamine 10441802.35 13232870.77 9050405.024 11048165.31 16086742.13 15205547.5 9448868.383 13093941.63 9895703.707 9264894.518 13317018.19 17483474.66 8781368.4 12610271.92 10033306.79 9197991.698 10196825.07 11929793.01 7199906.196 12468305.79 7226525.637 7397642.395 11365978.51 12170120.46 6206944.098 11696165.21 8731046.125 7699738.37 10304121.3 12006931.39 4511848.077 9231144.41 6405019.58 5963332.242 7942590.609 8746677.27 15788979.68 5919859.166 12318955.45 15291253.51 4408398.457 15760326.85 5589519.753 8170381.582 6433671.578 6473098.229 11694178.85 4450844.874 9214171.915 9164201.315 4908946.138 10919540.25 3753454.939 7247532.075 8418361.904 5242323.351 11626770.56 2705782.72 4571846.13 9328843.438 5581680.992 8262005.061 2695670.499 2624989.256 6220657.237 4383134.711 22637652.9 16013976.75 27424465.42 26576105.44 22547312.18 24226946.55 23829807.5 27459480.07 26788830.68 28843667.16 25767104.68 21573674.81 18615629.91 18861209.78 23073271.92 21603879.13 21578910.8 23548617.11 23013775.04 22506196.62 22889879.09 17298654.98 3032153.543 16901619.87 25180295.54 20017847.26 9681621.815 17293221.63 18266631.59 16625816.7
1-O-[(2-{4-[(1E)-1-(4-Hydroxyphenyl)-2-phenyl-1-buten-1-yl]phenoxy}ethyl)amino]-alpha-L-glucopyranuronic acid 8778259.97 6357863.203 9213265.729 13369813.8 12698438.74 13393623.85 18363932.89 14563754.75 17001715.75 19172600.04 14148884.09 14774701.88 32622461.37 19400511.73 18345377.54 19634214.3 15279070.39 21613794.61 27285176.76 14554526.86 18514350.66 26044799.47 12721249.29 17987619 32605127.17 16803629.87 18000492.5 23963064.79 10135537.12 15282797.6 31026549.2 21087745.04 21970860.63 23842205.03 19633424.04 24325409.5 15738256.13 7696632.453 11660497.27 10791966.26 9899293.63 11828949.95 11177607.48 12888067.84 3853789.556 10251701.29 15947480.39 12172300.85 13103403.97 15245518.98 12021677.33 15027444.83 9755482.815 10170064.45 14748351.98 8395533.052 16163003.41 14146808.79 15138132.11 12474090 10984471.24 27511098.93 13616100.14 18890391.34 11718598.61 12038211.95 12075498.25 12710018.18 16802035.97 11988676.47 14318929.87 13655109.6 5012990.244 13978153.09 15804852.73 15619131.63 6009115.373 19465325.2 7037722.687 8973175.492 15397580.6 16766913.12 19212593.28 22023930.73 19181093.74 10597314.78 16868521.86 15398097.02 1397958.054 8978250.951 14429051.39 12915052.56 4812482.13 13585342.57 12087458.51 13147928.75
1-Oleoyl-2-hydroxy-sn-glycero-3-PE 148409648.2 135656504.2 145615514.4 199810834.8 159909105.4 207902649.5 222762805.5 197044825.4 192316573 248200747 185982257.5 184695471.1 404729602.3 255162645 248779448.7 278491276.5 238241107.5 304782090.8 352916066 249260066.3 257956026.8 389855497.6 233047532.6 307230916.1 848699270.1 356269873.8 359531397.8 520554112 273932548 424054012.8 1212791361 849459800.3 736612532.9 798638492 585645115.1 997151085.5 167829957.5 130026866.1 165994742.8 162992721.2 176475626.6 124972715.4 207918152.9 178907949.4 41668641.85 146128293.3 220250741.8 255103308.1 197245250.2 243581330.7 238243147.6 186448758.7 195104194 172875777.2 230295961.1 175243598.5 396157353.7 474908183.2 577140919.9 346063699.5 368253563.8 1244380118 704421882.5 845562328.8 411182848 517340803.9 341532117 341135137.5 364749406.5 224863626 242978132 528833524.4 527806208.9 504138105.1 495707865.6 376081742 733965231.1 751337261 752641082.2 328665107.3 502068637.8 895886905.7 930806655.6 1017500339 725985788.3 475915088.6 843872445.6 878302067.8 57067401.69 511979137.9 703489443 775380282.1 292177619.3 970549086.3 793666880.3 723524086
1-Pentofuranosyl-2,4(1H,3H)-pyrimidinedione 16087084.29 14294922.8 20097347.4 26540238.86 35879866.28 119820265.3 16389399.6 13658643.57 17419599.25 22532159.12 50134057.26 38581471.81 22811777.16 14636023.44 19452880.09 24792716.86 48593016.77 44067792.49 18083326.03 15194900.37 19084209.74 29577688.27 40784041.51 39224282.37 18263454.98 11300964.81 18777405.61 19313542.84 35986238.44 33973365.95 13786265.83 12395452.55 11891971.85 14467914.22 25509527.47 37157917.32 16098859.18 11592628.45 10325458.89 14336158.67 12145112.25 14799949.14 15705422.7 10741810.99 6948423.479 13062095.74 18700431.54 16113241.21 10629241.42 15753611.72 22145849.78 14340064.86 12798299.74 9779292.789 14615517.76 14309657.37 15828072.11 14251406.95 8643173.855 15236955.99 12868414.51 13106593.19 8555844.786 6676905.65 11804572 13647851.07 17399230 16118003.13 18641859.56 21005285.43 18203135.12 21340638.91 18180462.77 16931929.5 23700052.02 19226668.16 13795476.98 14619025.32 18912480.12 14141525.26 12886629.5 14625679.45 14474918.69 14622693.51 16773537.8 11326941.57 13839368.2 14159148.78 3812639.188 19238687.83 10477929.65 10825154.02 8394409.509 10197398.86 13964987.1 10396778.2
1-Phenyl-1,3-octadecanedione 107816.2684 54916.58388 217423.5176 859082.2783 275583.1753 377308.3144 1290338.856 1041214.982 786740.1816 725005.178 2228951.79 189262.1181 4551192.95 2326796.339 1226164.354 2536553.222 1078114.383 705660.8289 3367447.732 2170075.6 1397451.383 1655276.074 1430244.349 2934582.674 2768757.985 1979140.605 85014.22862 84735.42666 1136444.704 2500502 3391541.503 2141288.6 1976123.172 2099293.745 113286.1191 3941212.095 654083.2876 38807.50009 278173.6509 177617.3273 227864.7668 264293.7523 559775.8266 439589.4305 84518.30385 445779.5271 451894.8473 819570.2347 741504.5691 1135065.662 787582.9348 1629077.943 815087.0869 1009132.825 1104835.899 230344.2802 71471.19724 1360045.666 1154102.766 1504153.684 1311140.734 1135861.355 786271.8099 1222699.803 633731.0404 1453609.91 324089.1272 457981.7843 32926.46599 168717.2029 302171.5908 524476.8366 710747.8237 658172.9124 583860.3193 707962.8738 965190.0833 1116431.452 715177.077 579223.8649 930873.6013 1193625.389 1288280.281 1175650.079 1074455.413 740222.5812 1203525.214 1066250.755 30352.19833 1090765.619 1484884.543 536401.7888 406198.8503 79916.38258 666707.6275 1660971.818
1-Stearoyl-2-hydroxy-sn-glycero-3-PE 917215009.1 1058509127 1465364252 1177621028 1402479393 1502060058 1157514271 1216746978 1179072676 1447069461 1167648148 1153514059 1374543609 1272510737 1373868992 1637488855 1186554971 1325737902 1132823776 1290123161 1260698002 1403853992 1235980683 1762871955 1451780170 1195990856 1314051542 1351838234 1160581171 1277617916 1693934065 1356646627 1715086118 1284300975 1515986881 1357624276 1243879448 913441976 1446945873 1471607714 1133112961 1267518192 1427866942 1519567046 580802953.2 1169591023 1328617006 1542133127 1272278848 1347081300 1376642357 1294942789 1175879154 1225908001 1295003663 1121504506 1357656234 1636309401 1215878834 1237578705 1634950706 1305833711 994155105 1204539203 1174246987 1226785855 1342148709 1405655361 1458335770 1251645103 1098996709 1021015843 1020289106 1298284364 1047040519 1068026665 1034290547 1116777341 1160942349 907807134.8 992620548.7 975204487.5 997662396.7 1193022340 1018877351 957144765.8 1048786771 976208863.2 184678199.8 1026757650 1254563133 990473124 716651328.8 1466403500 1039579055 1214942304
2-((4-Nitrophenoxy)methyl)oxirane 613339.7401 895132.4311 1168388.552 1204084.479 816958.6935 1541636.871 427354.901 908016.2624 1118472.904 1371970.677 1403321.192 2173682.874 665299.5968 1040195.595 1234383.872 1751561.761 1457999.98 2402751.249 896605.8922 945874.9311 1417244.798 1895432.936 1290118.369 2212825.264 567622.4853 819017.6284 1237960.032 926550.7461 1058125.547 1914013.087 546610.6825 828138.0946 1271108.721 1010169.279 738184.0753 1870459.138 1457429.338 1030822.832 689805.1639 1915760.415 1378185.917 1819746.832 1509384.092 652643.9022 704279.083 1175772.643 2037875.923 2324922.099 734354.4667 2605936.03 1529678.581 1413289.841 1249391.296 786206.584 2615538.689 1176299.725 1508025.217 1233309.544 577505.5098 2137913.918 1078079.275 1203001.297 974041.6419 505773.6733 1899993.8 1883933.835 785626.5748 885716.8376 1414585.252 5727175.16 2149848.489 898676.2302 809009.9134 1044485.7 4852071.321 1084464.891 754910.1837 943005.6053 1057404.483 2845000.574 1344692.594 711174.6649 840409.4076 1306244.33 3971936.223 1491035.722 812845.8935 1361680.136 153875.8329 3920433.458 1332779.996 1376640.294 293459.1233 1421989.066 4746717.438 1431611.994
2-(1,2-Dihydroxy-2-propanyl)-9-hydroxy-6,10-dimethylspiro[4.5]dec-6-en-8-one 3345997.886 12106431.4 2542144.609 7218998.543 4171245.808 4450296.938 3839317.108 9795652.751 2324515.396 10113736.94 6533351.267 5590924.337 5338134.582 11327974.08 2535206.408 8478497.366 6335990.817 8101251.109 3737093.23 11533144.71 2143464.72 13149041.8 5943717.361 6557235.569 5264062.794 9614403.669 2250629.12 7933851.788 6072512.737 5866380.969 6469011.883 9908280.884 2367214.412 7715379.514 3029529.199 6076216.659 7147219.535 3220705.358 16491115.76 5693519.576 5907060.993 10518804.39 8247609.684 16770486.15 1857426.27 4827615.975 12033600.16 8992584.229 17881360.95 8899600.778 5990058.815 8172109.232 6788372.91 14632163.61 8416685.866 4888782.91 8725712.229 6857031.948 15251337.27 7749662.012 5737449.35 8420371.599 6068195.572 15106151.02 6143396.518 6072702.086 1253904.76 1043047.504 1661547.659 1114122.062 1553101.607 1279923.042 1423031.083 1201265.876 1277070.7 1648753.278 1038541.299 1361082.454 1235386.159 562456.6863 1654846.646 919614.1901 1123633.007 1289003.991 855593.0354 1182017.933 1176299.937 884606.0119 172272.3996 494049.9889 1938445.93 1857619.867 515410.6278 1392553.39 929367.2501 1656446.155
2-(12-Tridecyn-1-yl)furan 3665337.693 3892573.792 1984299.109 2708630.511 2759469.429 1849840.459 8914497.896 10894130.35 8454778.827 11989595.68 9918154.192 7217225.231 48107553.13 47917355.79 26214438.19 33785490.37 27352288.56 16216453.91 91241410.31 78656285.36 41597190.95 78856999.99 80912647.66 22673542.06 105794565.5 61335479.21 47850967.2 63274394.34 64725485.21 26445646.49 111276521.6 90812137.06 54211166.08 72485803.02 64659918.06 37206367.45 2539407.041 2053219.453 2587687.812 2336830.467 2975459.647 12177769.45 5462398.718 5464386.097 4078277.127 11367026.44 25733584.11 12550772.26 13240522.39 37515391.73 29707751.67 44835587.77 22027481.72 23135430.17 71207125.53 49621663.34 40657003.38 35856842.77 30433048.09 62259349.98 64357841.43 51611118.76 26349266.98 53894953.72 58522113.88 52029786.07 4788636.844 4271494.602 4736556.367 2416611.349 3094500.424 14669206.63 19514942.5 17225472.02 11085363.8 9322676.149 24528486.86 25346507.93 26774752.14 13002221.96 27749879.45 30097766.81 29792230.5 37471633.96 39471641.76 24102259.76 33549919.83 28562097.28 3280573.98 25414717.79 32618746.24 35662861.11 11136913.67 49094234.17 40028010.4 53955478.87
2-(2-Acetoxy-2-oxoethyl)-2-hydroxysuccinic acid 1188710.511 2359250.443 1776710.797 1277758.428 941028.6498 1376416.238 3925331.808 4196305.358 2971551.961 5825931.872 10100179.32 5371963.793 7373317.165 7118445.04 5511521.733 6847921.298 14102886.79 6364453.6 8645265.445 8765385.359 7536582.794 11162167.19 15019645.34 6067512.775 6901499.807 7905565.28 5521369.513 4641275.787 8211975.792 3803692.07 9314186.098 6430303.914 5921572.931 4452790.956 4680144.356 3316079.198 2575150.955 683160.1873 1178680.103 1556635.721 1010081.933 10261529.38 4671574.044 1547702.382 1241713.733 1563642.87 10408373.81 3913768.122 2586391.826 5324224.003 3612869.474 6672595.195 3633934.021 2815796.147 5154948.329 3631059.15 6554236.719 3793102.629 3218255.17 4117627.94 3263225.178 5114299.304 2348481.37 4225174.547 3606330.296 3772093.354 1155969.615 1059261.247 1121512.778 910827.4563 1036178.694 1259220.79 1448877.824 1133940.841 1627953.249 2366576.901 1464161.937 1767524.389 2238719.904 1336175.753 3775489.971 3597321.687 5499820.362 2969109.392 4870924.988 7659096.956 3711813.625 4833215.757 487925.2891 4455051.429 7302444.862 4167388.001 3723939.973 3031903.27 6657950.59 12146533.72
2-(6-Hydroxyhexyl)-3-methylenesuccinic acid 113073.9592 236619.2976 104710.9289 157352.4004 157303.5551 138816.7799 195962.2403 111864.826 273723.7629 169724.0489 86724.12447 107086.4416 95042.1531 235927.2574 159749.7527 126986.8804 299666.1834 290910.0089 250666.3916 250785.3183 349977.3748 245057.258 267010.7228 284723.225 1292621.664 296389.3168 325257.4277 407738.2923 112679.5434 260333.7361 1962428.026 263021.652 348150.4462 365362.5942 399808.6238 346835.4749 155083.6142 136039.4309 230243.5394 174784.7171 75167.76976 56924.2645 144090.1455 134758.6746 133496.4686 222768.2613 135160.8894 211001.3483 186439.0372 232303.9821 196480.3902 380811.1168 270936.6175 189685.2171 261053.7567 449960.0601 548764.672 496816.8684 940297.3257 326019.9632 439918.9187 1251831.787 612638.9725 2322782.561 328072.0614 302320.0596 53374.51744 190639.543 164068.2261 136348.769 138270.4589 111514.2949 160592.2069 145623.3656 171733.1005 123939.9728 303568.7051 279419.6433 266487.2943 101657.7668 280132.0074 116094.7918 295552.4871 271665.3353 276127.1224 234681.8826 250425.2088 193146.0278 161407.4154 226440.1002 237710.073 1137391.876 235469.584 431757.3514 482430.9344 848222.209
2-(acetylamino)-3-(1H-indol-3-yl)propanoic acid 13156279.99 19518495.77 14860697.04 24905901.96 13190151.81 28789862.94 15457814.11 17561949.11 11985666.59 28241434.89 22518037.64 38465982.21 16110402.52 21316876.98 14846382.14 20567524.68 19710206.98 42129412.97 11974914.76 19642662.46 13741516.1 22119337.37 18331701.67 38261590.08 7989606.504 14950660.95 11243280.95 7501444.805 14412730.4 29058682.92 3623687.671 14024585.06 9992600.31 2274752.127 6704747.814 23218870.05 23182100.67 24159009.33 29165647.47 37738547.85 53599169.16 33021977.74 57628728.82 29160151.55 7881869.512 46750228.47 34637563.91 56341470.14 33045294.4 53221948.72 54477962.35 23840771.26 43596475.24 24394777.27 48023977.25 46921379.89 24700738.62 38311470.95 25128899.58 37560639.48 48920449.09 14883853.88 17320584.39 25022299.18 31770938.09 45834310.29 27782294.13 30821287.77 34340925.83 22806573.15 30433783.56 30935635.1 27744800.25 24637174.35 29243998.87 23570162.15 27986772.93 35526587.67 27471092.07 11744881.5 24778798.21 24239200.6 28886584.93 24590426.51 24859656.38 16200378.65 25337617.96 24617520.85 1195625.481 13996193.43 21653213.39 24961101.14 5256934.352 20220506.37 21857236.02 23531490.67
2-(Decanoyloxy)-1,3-propanediyl didodecanoate 14775196.06 7802596.523 8702890.057 8659312.464 10690326.48 6906859.003 11094811.28 11181324.81 9763925.022 9035998.76 9248369.89 8468294.286 13072704.07 8449729.302 11142429.36 7555331.307 12816635.85 10459801.36 15813122.79 16004007.38 13194074.83 17872231.4 16776954.19 13061010.79 23758942.76 17507733.04 17403902.35 13843585.6 14597576.83 14321464.47 319035.3863 908638.4122 1086799.491 298659.6227 537195.5417 1674176.413 9775872.058 3804821.648 9991600.303 10111581.46 10212551.31 8014495.406 8604373.101 8656923.589 725701.0108 7962424.488 9032229.048 5837926.413 9242999.817 9705987.175 6437323.24 8357631 10302050.3 10987267.23 9823025.181 9041068.192 16983847.24 14535407.77 15155719.64 15965135.62 14800968.84 271230.078 158455.2843 313201.9629 201334.3324 1451723.969 8705360.713 9950508.653 5846805.328 3367192.798 5609651.927 8027607.952 8644848.267 7394874.221 8900127.339 5906677.778 11382627.39 10420488.19 11229751.73 4717454.275 10320480.58 12552786.28 11854612.99 13199447.57 11396931.34 8341533.478 14063872.37 14477510.41 154334.1469 7614084.469 17721295.12 251440.4927 96375.29246 1209774.061 907587.3119 296924.0399
2-(Diethoxymethyl)furan 831451.4538 633712.6991 585322.3368 460647.1694 583654.4995 549849.1895 514916.6632 513679.4558 494864.9891 506924.7382 511422.9814 368640.9764 503344.1641 515452.9116 578072.6859 311408.5259 240547.8377 592264.7727 455576.1867 463384.7493 668926.4639 431920.7705 456977.1834 438961.1802 1529233.959 546291.6312 770207.5618 605107.4951 429562.9537 545360.1521 2783694.99 928534.713 651663.7242 750046.9256 575089.4783 715864.8503 582534.1022 286103.2155 251989.1504 556775.1823 534463.7444 458590.1255 310737.0518 547518.1546 166040.7288 595669.2644 421674.8752 373528.5886 580053.5296 435851.1027 534492.4503 577954.5174 479434.0826 427142.1531 644307.4001 618760.6925 545884.2991 1054921.528 1060086.074 679123.8636 392840.6964 1931632.006 767297.0487 1746523.594 801482.9145 729297.8481 361557.5454 735904.377 459741.0939 692510.3468 433576.2008 509465.7746 507798.2254 737579.7981 596410.4729 486508.7599 575369.6564 599377.5216 670847.3713 340176.0221 596166.7825 660762.6624 686708.1887 1135612.215 880922.8018 565896.0151 784122.9973 704809.9029 371255.7693 481710.6174 785456.7383 1205932.665 382659.5022 921505.9779 841768.8999 864510.4811
2-(Ornithylamino)ethanesulfonic acid 8960740.377 8052108.533 7555265.971 9312280.326 9632253.461 12359680.19 3798365.985 6015258.696 5906328.834 3739358.168 3347534.504 3875886.654 6232616.683 6631176.352 5220135.446 5620013.8 5765434.616 9057555.402 8067793.826 5820038.243 8403080.914 9118963.396 4471814.518 7544083.272 11211076.54 5426446.01 7214592.311 8459440.81 11056728.77 12124163.97 12072482.91 7296024.804 7205755.475 8904050.39 7320795.347 14067648.2 8881540.987 10248686.98 13434483.36 11940460.13 12924233.51 5357553.891 5953399.696 11429728.09 4495818.332 11985569.35 6167720.138 7508594.386 9642687.854 7620884.695 12461365.86 4220332.139 7975006.781 8535772.668 7453322.98 9843790.243 4610396.458 8698439.887 8976450.815 7942919.528 10540174.88 5722839.1 7120283.028 11119972.53 9993494.798 9426972.289 13607735.26 13739290.54 12910227.52 11291798.28 11078547.41 15075630.15 12973892.21 11382081.22 13219161.53 11343846.41 12182608.4 10486976.84 8298589.214 6873004.705 12180788.37 10555983.3 8965846.97 12586343.75 7830704.641 11569758.09 7719442.23 13557195.04 879375.3162 7830803.72 11229272.25 11122348.24 5457545.849 11973203.54 11352222.21 12185105.52
2,2'-{(19-Amino-18-hydroxy-5,9-dimethyl-6,7-icosanediyl)bis[oxy(2-oxo-2,1-ethanediyl)]}disuccinic acid 31964603.92 63820465.75 49536736.73 200045631 33727844.96 48435960.07 32345468.13 46844045.13 45117343.13 52082802.28 40021721.88 50152836.79 31900911.57 119727180.8 32215026.48 24789735.44 40457720.17 43470767.38 29913955.27 48632686.88 138776121 37742224.08 43223392.87 47267244.97 57170490.46 48010200.87 36157788.61 67562560.09 20344333.05 46212340.97 61458292.99 17931070.64 55956588.72 35650713.61 47332123.87 54415723.25 34066627.8 15323391.58 31173101.01 27227675.34 55339052.47 63127337.02 160669593.2 60568307.56 7871843.589 21686239.77 45763975.98 34104621.22 44656699.46 49952152.76 53848898.97 34679315.21 40198825.18 43962056.37 29837713.53 25772336.48 41170469.76 129362967.5 49537690.82 35376199 55044237.45 18789819.45 18941008.27 46966813.12 51615945.69 33633101.63 37042988.19 77824110.81 33365210.28 39282589.89 119259714.9 48794139.02 28576939.2 33892596.17 153638965.5 21936235.21 35055752.73 73474463.6 31116030.94 27632545.59 89438221.04 30078894.25 47409759.01 35155012.91 18664411.06 42684849.28 48279495.82 28858728.38 1830648.371 16077146.17 26403235.25 26642144.99 5786804.314 24905166.41 36718463.05 102541007.7
2,4,6-Octatriyn-1-ol 53898573 107502376.1 132367635.1 100092348.5 81616068.1 134815639.7 52500172.67 101798772.8 134117429.5 90833231.34 109476828.9 119317978.1 90527551.36 107969872.5 153404329.1 100614461.3 89593950.69 157609473.2 60925153.02 132640541 181610497.7 109052451.3 128815963.2 181627475.2 94365662.77 109862630.8 166557495.8 116986912.4 131234803.1 161728950.7 84397596.7 97760983.28 145884731.6 138939332.2 92631990.49 170567086.1 89749564.6 122667462.9 117740531.3 121018122.8 201846403.1 107000013.6 151223649.8 109037587.1 41041083.29 205514989 149938302.6 106392479.8 134586807.6 141264755.1 241604622.9 119001603.8 151138350 121772190.1 152074675.8 205510750.2 153952150.9 149319785.6 125813371.2 131773407.1 213279262.9 97534957.67 102484096.1 136457099.2 120412745.4 225736978.5 88163684.76 117626698.4 137807305.3 51397130.22 69677576.27 112389395.3 86317401.24 84585311.4 84183750.73 96730641.51 114049226 116636176 99996501.14 60297192.25 109593942 86181672.36 154296609.6 111334364.5 87533643.55 93930573.88 85814377 116085586.1 12689709.85 89037806.3 76522424.93 104609419 58641664.89 109037546.1 83079810.56 94560784.38
2,4-dihydroxyheptadec-16-ynyl acetate 26567683.15 32452233.48 19296410.11 24616169.92 31697468.09 19577117.82 34191994.28 32015737.95 20919066.71 27675367.58 42748006.86 27454805.39 40747840.65 44253496.25 32303844.33 27105215.87 35078398.51 36066353 57264116.61 48197855.54 37432887.17 47301361.87 47179298.27 36871097.62 55393558.93 42638192.13 31007279.32 40464204.47 43499695.55 39428965.38 47817381.31 47174244.1 31526643.32 33467893.88 32820455.88 28060386.12 23171213.31 10853234.55 20636559.91 15994678.81 17687012.63 19636324.47 21863107.86 21128657.4 3518823.019 16795300.14 29363864.09 25932873.29 24903867.77 22494759.46 23314075.13 25868880.47 32481459.5 34528678.74 24934781.9 31284306.2 39966695.11 37047275.08 28926496.98 29721201.96 33249725.58 33609294.06 26231259.31 37969071.28 27190901.41 38737042.72 17385247.14 17380927.64 14448452.66 12970159.24 14192136.83 19190153.02 17505532.9 17129171.99 21317608.98 15648419.35 25965687.3 25463975.72 28183474.98 17646048.38 25351977.61 32630429.21 35741619.23 28378821.23 30026583.55 22262625.93 39343178.45 37716398.42 3177141.582 27494900.6 41816122.05 33300685.39 13896498.29 28704644.82 43204177.68 40138985.38
2,5-Furandicarboxylic acid 1688700.761 5879091.742 4904314.706 5421325.311 5908018.801 9141874.196 3541962.844 4451510.465 4462303.249 11001407.88 21524388.31 18767884.51 5748449.162 8049679.041 5277986.137 11568147.15 19053724.08 19112413.4 5103854.397 6238779.485 4846164.307 10496340.27 15948149.43 14649810.95 1790048.881 4292969.5 2966763.239 3147371.654 7657418.171 8974986.237 2234463.177 2889755.154 3229513.498 1722872.043 2525902.839 3160677.434 7323983.506 4887403.496 2285888.723 4021994.613 5268476.617 11763867.33 16683285.68 2415247.83 895390.8007 4116890.696 16881723.79 16170303.73 3754728.676 7506595.785 7496280.61 7304026.396 10477530.28 2387969.847 7529273.669 4002965.822 8581228.344 7880203.985 2137118.342 4202124.221 4942378.003 3481783.415 3137446.449 2063904.439 6177580.177 3762870.003 2283380.836 2675507.106 4051513.726 6771174.162 5399505.095 1261477.684 1193572.763 1308374.854 2310741.409 910240.1662 1756569.14 1708919.278 1743295.004 1272901.264 1314451.239 1665879.36 1745036.833 1857398.103 1445188.448 1346974.253 1603614.743 1867005.029 452021.1641 1453395.006 1628762.497 2940982.033 831624.6891 1588110.041 1598930.111 1629093.065
2-[(1S)-1-Hydroxyethyl]-4(1H)-quinazolinone 142407988.6 131747473.6 60161763.18 210820569.7 180860003.7 21750680.31 128824113.2 97522509.43 92263281.37 115424167.3 76479777.7 128598520.2 139897911.6 120837684.4 127587072.5 226212331.2 95479474.68 108206319.9 72080699.54 121524199.9 80228183.04 419004356.1 94709589.64 104730154.8 88674572.43 52806696.62 44762165.39 90980476.35 109759337.3 118958815.5 54398368.84 66320738.32 34779347.53 57064930.41 87282741.28 193478917.8 108990286.5 11468179.57 113287599.6 110095453.1 124102084.4 46009271.86 52408540.33 91899292.14 71896049.72 154713700.9 110303124.2 63888345.86 88042171.94 141257892 275491329.1 60500478.91 57256520.64 70648474.27 111215052.3 96934823.15 136657435.6 38250803.14 101694253.8 56371525.52 92587852.15 76961835.74 48130898.31 50706748.83 97682708.75 99381463.01 204622346.7 162961439.4 314403247.9 204190151.1 291173663.7 142670642.2 141390196.1 187863027.9 374958448.7 178461493.5 100459890.3 276762158.1 126509921.2 229709895 133236109.2 117701520.8 124802663.8 100898292.6 115930151.8 55334633.27 92435195 161406568.4 10446418.45 178667360.1 128318170 84776360.97 37112717.32 56428684.22 125882488.8 68308077.63
2-[(3R,4S)-3-{[5-(Cyclohexylmethyl)-1,2-oxazol-3-yl]methyl}-4-piperidinyl]-1-(4-morpholinyl)ethanone 2871575995 1400779168 2430205004 2540347185 2165955969 1968036930 1410006377 1654077247 1612416415 489346228.4 2182958156 1696660724 1698202092 1739250846 1589871084 1001998490 2001706068 1930233028 2060515325 2159625034 1834981444 2361301960 2033052254 2436781644 2083692041 2628796084 2459324866 3120952830 2319510603 2895734924 2836385407 1922637495 3353825818 2475860281 2603566033 3418696068 1563480991 1015407512 1168442428 1510519136 2343824981 1461077857 1664915896 1924128453 312604432.2 2266405372 1870046913 1064897787 2977692726 2342809513 2086455924 1521326932 2248364153 1966108294 1302844297 1466776377 1809570412 2447403569 2385491199 1918211164 2769506258 1702642440 2105902750 2658181818 3002338613 2847348334 1788438614 2812782619 1734787410 1604826845 1606937333 1893024507 1284346277 2315668091 2691871620 1526349574 2425547785 1762370535 2364993147 964613878.4 1642499357 1668617659 2154773602 1675550880 2192359369 2233683451 2350029883 2615884703 115953043.9 1182083331 2205527737 2254145922 483293000.6 2736487650 2377360333 6847740300
2-[(3R,4S)-3-{[5-(Cyclohexylmethyl)-1,2-oxazol-3-yl]methyl}-4-piperidinyl]-N-isopropylacetamide 15274830.66 17603102.51 13161270.27 18220966.55 14230822.94 26379726.42 33139004.26 27128193.99 45181788.13 21059430.27 18060322.82 36997387.61 26791298.68 18760773.34 18269034.65 8048502.896 25602213.39 18648859.52 21842977.58 20646170.93 20147274.53 22911828.25 32125638.17 23323972.01 111852022.4 88288314.5 63929999.17 58334245.34 42699760.89 63900865.1 13822362.88 36196549.85 19096514.27 14922863.01 48713354.81 17314941.66 36418967.65 6350925.238 31597109.6 15334644.62 15096449.35 42904209.88 13712618.32 11665925.31 5103090.096 10908686.55 19271859.56 18846188.46 21410683.34 22025055.83 11518614.64 39696321.39 18045866.33 21482797.9 23486437.47 27807762.82 62268144.91 130544177.7 64216702.04 32420059.54 56736762.03 15803146.7 18978177.96 38173959.4 6607939.279 19059403.22 14078035.2 34991622.02 15845564.28 13412077.84 15906931.37 32369005.5 39344842 19231135.49 16233783.33 24400321.06 53551817.27 44757508.52 21495896.94 17082359 33755722.06 27397001.22 17312725.07 19248552.21 18796972.86 31949066.96 88072728.82 38531140.3 1721958.875 40057641.02 63134823.52 42194503.94 4846958.755 21460879.71 31898856.53 41739562.27
2-[(carboxymethyl)(methyl)amino]-5-methoxybenzoic acid 17871176.31 22056188.3 16022024.77 18608100.71 20215476.38 21251376.95 11607107.34 15661896.62 15908694.6 8603110.05 6923116.073 7081647.293 15085532.2 13922817.58 16216575.83 7850263.301 8605325.833 10355199.72 15721847.12 19163344.52 15780342.58 16831725.24 10645523.39 11286677.33 20629818.01 13858121.57 16450759.18 21209052.39 13991841.55 13687547.02 21486359.74 18893143.3 15310222.37 17709575.64 16711491.29 25350301.89 17508781.28 14804016.41 26334538.54 15840907.02 22102026.4 4469491.701 7514607.948 20615270.17 2743955.668 20254410.27 16111172.2 11802937.39 14966401.08 13588399.22 24890488.83 10688607.83 10968656.03 18982563.83 12173165.67 13731119.07 14339358.24 10802842.58 18775609.25 13910500.02 22036974.6 13465359.25 13131186.36 16800772.91 19453915.13 17484052.7 25826356.28 20127363.38 30231611.73 16338234.91 27279147.88 24760363.09 24848088.8 24822521.32 21958551.2 20082946.37 23936944.81 26660518.68 24321778.54 7717835.178 20397444.07 22446101.93 24125973.28 23545933.18 14457543.72 10502687.23 19568467.47 21114641.37 949375.6827 9280317.839 12929093.61 20533429.97 3375302.016 15433502.39 16552171.27 16596870.01
2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol 5119201.46 3832104.009 7571428.437 4978904.923 7990170.84 5197629.779 3673104.194 9264353.738 6087523.636 4804179.593 5155906.931 5706733.417 1890377.665 3963515.735 3157213.562 3821113.897 3488434.195 5036383.033 3033958.135 6492173.04 4803166.944 4170503.676 2068521.282 4465135.354 4148964.987 2783766.891 2537993.808 6022620.782 3138910.199 6053426.589 5178682.226 1020042.427 3203417.928 3426035.003 2587153.265 8731457.631 7496005.26 2982407.046 2536757.734 7006523.625 7040318.659 7161328.285 10532292.59 2905193.566 1225971.242 3489816.125 8644955.639 9136035.89 5251172.725 7438270.477 4970512.709 4626277.843 6169403.767 5232005.08 6079438.996 1869834.835 3681833.09 8844424.323 4028932.731 4719703.742 5962008.387 1671446.677 2389225.987 4650608.172 7533247.199 1925512.958 5687015.185 12007620.21 5846778.765 5775064.556 8008736.427 9080108.654 8840874.338 4532631.129 7937669.133 2567631.953 9910705.16 8768758.621 6884378.456 3707914.174 3294502.776 3068789.83 3981437.853 5264638.196 1939258.34 6287535.842 3771004.983 7299857.211 506810.986 1981042.465 2368727.325 2840033.218 582598.3168 5703953.266 7462642.761 4894900.826
2-{[5-(tert-Butyl)-4H-1,2,4-triazol-3-yl]thio}-1-(4-nitrophenyl)ethan-1-one 1207015859 902335316.2 1304823807 952736499.2 1184301475 1602857772 1432070140 969688194.8 1807013825 1511696988 1796363086 1839355441 1848955905 1295393939 2112414893 1233561297 2138257755 2376073904 1892426660 1313376337 2039231083 1928157402 1879075708 2314222227 1827616401 1393937518 2352996444 1496602996 1689757930 2215274209 1777834902 1321850111 1960780289 1652214097 1542229437 2281165313 241705.687 167621.9089 188159.9277 2292140.126 242462.7469 176358.8008 211584.246 195049.8453 114504.2359 421334.4397 1156819.556 16578810.6 496234.9546 238852.7754 168236.5509 339624.7913 380123.4832 235039.5917 199659.1562 178340.4377 187211.8517 243156.2295 225305.7328 214779.5834 227034.0809 1362456.719 256957.1309 262692.6215 232716.2438 178576.2132 2785942.268 2262427.806 2510214.225 2607861.032 5858201.623 2365145.953 4965429.289 3434724.037 2946981.762 13961542.06 4227235.369 5674023.725 5672363.444 2092485.468 16801611.48 5522171.924 6939442.745 6290389.64 5643291.229 11777000.25 5848785.904 4435272.115 449903.426 3437690.293 19273557.56 2859181.485 1469548.852 4427379.974 4042449.254 15769973.38
2-Acetamidooctanoic acid 10772179.14 11232611.21 9600442.36 21779828.36 4461745.731 9522459.268 12641743.92 9997680.033 9038279.032 18278156.12 7176291.473 8044463.093 17569399 10503587.89 9623531.394 16143776.39 7249000.337 8733892.759 9257957.31 9062829.604 8018015.655 18883702.48 5344906.985 7529213.861 10712551.75 7014404.815 7676350.581 13180702.92 4701148.091 6491096.157 7933080.357 8698016.637 6778980.552 11020900.6 4380193.005 7964143.074 10463275.21 10831462.02 8451950.623 11545290.1 12092579.86 9048752.058 25967386.72 7182560.386 2645027.512 9956422.647 11662205.44 22043311.19 7979522.741 14812420.56 12327231.4 6743816.178 15385823.56 5979223.13 12309905.55 10086800.45 7010487.26 16227141.01 6231701.978 10627589.61 8267760.299 5573360.18 8348408.836 5916952.687 8677984.283 8649389.663 4893962.062 7075006.349 6800663.494 3231878.164 3637457.729 6103869.027 6862102.727 4800420.91 4293328.258 3435512.326 5133841.765 8364966.447 5583210.097 1537575.938 3287866.582 4352183.806 6941592.264 5412342.118 3559021.598 1993183.564 5404743.401 5533712.888 549299.9351 2117543.438 3259348.043 4631287.348 1771884.949 4664216.816 3766433.927 3750132.893
2-Amino-1,3,4-octadecanetriol 4616113785 3090849766 3029319455 3564054054 3012711031 3899935099 5300676351 3970435857 5370325859 3942736086 3075824182 4444809385 4250834284 3008819283 4025506821 2046012182 3513025512 3038344846 3564903346 3796506349 3597637341 3614938081 5216288833 3524284781 7894855023 5192471750 5134480429 4337019051 3476114477 4188104798 1782779537 2268472078 1402574303 950048899.1 4409824570 1722022617 4338313122 2213507773 4744187579 3690097149 3563477305 5081078523 3773649999 3429036562 1428117597 3775715648 3834792660 3245294059 3199020041 3236772255 3414007881 4325156263 3258402155 3209434474 2803908516 3308710937 4838655393 7018929420 5219849673 3744450718 4512667833 2517683596 1501784621 3315165314 1389652370 1746843116 3512805192 4825395660 3210520827 3258992539 3570219741 5760642791 5040613182 3702277347 2832992890 3755078879 4693141349 5226745081 4272825627 2503628840 4242981850 4275751210 3275279206 3553406143 3425916966 3100129082 5955333244 3743643938 360225039.7 3659953888 5513337087 2616419222 827504554.4 2322870924 2508515223 3254781456
2-Amino-3-hydroxyoctadecyl dihydrogen phosphate 52457206.29 110484247.9 78930365.36 69626223.97 114130441.5 84444454.75 41759696.66 84474131.59 79696443.79 42144491.69 76994682.21 45712942.36 35741101.62 77026475.97 77249379.4 38638797.24 55654449.26 51701916.49 78928895.02 58541879.68 68409453.56 43965074.42 49847767.12 38995501.1 33224722.89 49694013.9 67688348.59 132058526.9 43905929.7 40440137.22 16483237.7 30537599.62 99309285.31 25735226.81 47447524.74 79310335.5 151950535.1 76041930.33 106590962.7 97509272.18 130775553.9 89600888.31 85140761.04 93666502.68 25650896.85 119568715.5 109285890.9 82612807.11 66159562.44 99484636.82 100593098.6 109525496.5 127412318.8 79038022.39 69507559.4 92998195.31 85526194.11 77700596.52 89798429.13 72809008.51 74914467.43 65094112.76 26009986.63 47524271.58 27704436.37 52193145.39 104643670.4 78300520.16 112466198.1 128512331.6 127614393.7 117906829.1 102024041.9 104916855.7 146875123.4 139326141.9 100330637.4 89472025.62 84118948.68 63680879.89 108492742.4 68474226.25 43058162.91 67871732.81 125847116.4 39299855.98 49229901.66 31448229.77 2452914.142 34897634.82 44891647.5 9792708.537 5654389.542 74862532.4 27971968.78 14558741
2-Amino-9,10-epoxy-8-oxodecanoic acid 11067008.84 13882517.47 9061109.604 13730366.78 5161622.23 12359657.63 13710199.35 13250408.95 8069859.867 13978054 9552945.33 12352273.24 19749053.36 14987334.13 9173274.485 9996594.562 7536860.012 17086499.49 13933962.06 13414822.85 10254548.05 19446825.57 6697711.135 14284021.49 13934808.01 10230511.51 7897170.016 11267562.42 5366199.25 12933491.32 11569834.21 12374450.97 8204828.519 10770551.5 4460434.839 15974611.03 6959535.533 6385897.653 8024788.415 6379030.031 8226673.552 7440238.003 12145105.36 7491961.021 882396.8747 6747753.115 8626487.887 13155101.98 9809902.837 6836011.411 7373016.753 7159095.072 10107518.42 7375258.071 6380997.595 6141876.453 7530324.47 8919977.638 6592138.948 5833314.524 5547004.552 5102401.289 4504877.535 7679211.128 6026793.002 6894109.673 2094431.832 1204641.787 2530779.154 5185879.011 3477489.828 2067917.727 1466565.399 1913937.184 5896601.962 2231561.505 1864754.402 1556548.522 1664278.454 2610860.997 2435173.016 1768267.397 1568573.439 2271908.55 6161553.405 1738564.284 1356422.121 914302.7875 588798.7041 2269910.408 2761897.684 2177268.237 563764.2422 2697552.384 5413035.368 3396280.409
2-Aminoethyl (2R)-3-[(1Z)-1-hexadecen-1-yloxy]-2-hydroxypropyl hydrogen phosphate 37539731.58 31267179.9 42258480.64 42767477.3 29020722.08 54290188.37 100422471.7 95909400.27 111381937 105638807 50147939.24 135179968.2 239616513.7 176265376.3 223172642.5 172975337.3 91261185.38 235012098.4 332193711.1 277718208.4 330244042.8 408124550.2 176043363.6 340861017 511332073.2 287955247.3 330041000.1 368428629.4 204346870.8 316071839 573378823.8 371094138.6 428033843.9 437855590.3 292895469.3 532780028.2 20441126.53 15235790.37 24720657.21 52531673.09 26567311.71 29286399.9 26897366.95 27241975.78 15954385.84 49802775.17 52385179.45 48016257.18 46742294.25 110082651.4 92464569.28 87746052.08 65976002.69 65250476.68 138133792.2 138348690.3 103486218.4 153438091.7 181776318.4 138856160.7 145251572.5 321693234 193941907.4 292907206 109350743.9 152987924.3 70282774.95 61201316.29 71960845.95 27343539.13 36824516.07 165658767.7 156471595.9 170014298.7 180405173.3 182984277.4 247314888.8 223951337.4 252596223.6 135659784.6 262641570.4 284100675.8 245444273 337517435.3 299058528.6 236410981.1 282412600.3 230088932.7 18245579.51 201037313.9 336873513 201024520.9 78258464.75 306997989.7 325314111.8 360835822
2-Aminooctanedioic acid 3811185.952 7163425.754 8800160.487 5980486.81 3538387.896 6061187.727 4497302.013 7420670.705 10366994.82 7566562.217 4770914.045 6447186.187 8797508.951 9471401.503 14923979.55 7717872.728 6909453.821 9512251.863 11242873.11 14978415.77 23602264.53 17140194.11 10806351.67 12679321.25 12680916.3 12886529.14 19819416.81 15025469.05 11179189.8 14294875.53 14553443.47 18250782.07 24409509.65 15873245.4 12107123.72 20453206.29 9576516.555 2785085.924 3413207.229 12312669.91 10385851.29 8405359.743 5518194.672 4268889.563 2488212.945 13518892.19 16361157.62 9334525.301 7434880.955 23694346.12 20667818.14 17714492.79 14459388.62 11309401.46 30376626.72 26460505.58 22725394.21 17817271.82 11325909.79 29024737.06 31121478.96 26346621.41 14508730.33 13852795.32 37779282.25 39073445.92 3676703.619 4918597.816 4421718.227 2293060.797 3870924.248 15591633.82 15417032.33 10296822.45 7255140.329 8900885.962 20348201.6 28813136.75 17849211.9 5883222.939 15874546 20903726.36 24540245.5 19278038.32 12900761.9 12021115.79 22632980.43 20641569.77 863070.1406 7305823.752 18635847.2 26023308.53 5092654.339 19262829.89 14088092.19 21545925.79
2-arachidonoylglycerol 43424.22881 45692.20876 55619.89901 321946.7364 327622.898 4014093.114 43563.96728 41223.84491 105162.2698 403955.6809 586080.7767 5487072.116 44309.76102 65832.66611 41782.48732 240639.9379 549190.2271 6704231.524 56449.6397 60091.0946 46687.97838 517857.3831 549210.4915 6323419.878 56174.03321 65901.23239 48135.60484 284307.3248 616174.9603 5556914.519 55728.47202 48217.80394 47980.9094 374303.8615 370981.2434 4463741.085 56136.0074 35950.21463 41916.62028 41959.79186 39576.42941 109923.6345 43105.76695 42441.02803 34369.49217 38151.40889 73183.7231 49051.30859 44201.2501 148165.8734 44301.98497 49400.27018 48320.63307 48570.49142 49431.17027 46487.21283 73282.49334 62282.5582 54646.64949 50686.84391 46709.32827 62239.86249 53300.50067 51680.08446 72548.23207 50359.85469 1257028.656 655340.6605 1502275.955 1135227.971 4419607.612 1325809.995 574076.2346 1224106.758 1406078.544 3418087.793 1144925.152 823938.256 1394116.759 723526.9835 3309804.703 1206816.781 751781.9486 1383791.201 1280620.697 2038141.803 1115696.862 477071.3985 41914.57328 592412.2917 3258354.051 981322.5875 145755.9076 1094575.227 946543.1306 2966845.751
2-Butoxyacetic acid 2175338.947 6949794.753 2525151.394 3642253.184 9627521.706 20057921.02 4009395.525 9687554.885 3936874.275 4983859.264 14170780.8 22607874.84 6085133.495 13178450.59 4556115.066 4749333.002 16775267.35 22644511.46 6618143.456 16082294.87 6878087.978 9766526.848 15634203.48 24946754.49 5844458.578 12599086.56 4962804.81 6783871.148 11915008.9 22504622.87 5932838.139 11709830.52 4919304.444 7055546.957 8504672.247 26046992.26 4792637.339 3500088.58 12691839.6 3025421.128 5121357.106 4558732.054 6475187.452 9130593.222 293835.46 5455451.918 6494692.95 7485968.02 10971468.75 3928546.758 6819357.751 7046489.718 7221996.416 9532094.483 4385338.5 6739246.422 6610524.873 7240283.94 10289728.49 3443077.044 7299319.681 6574807.366 3615457.529 10229456.87 3987751.692 7433397.735 6792477.463 5159705.666 4456766.908 12766907.71 3616222.761 7730352.061 5086349.118 3694158.332 15557222.85 3742706.223 7494483.218 7438537.03 4066521.702 7028147.186 4053121.185 6617404.525 5779741.647 4184069.84 16589777.92 2996561.642 6262079.26 4582951.409 1919014.386 9732432.202 3750544.608 6857593.797 1118062.537 3223039.711 11165475.83 4664084.094
2-Deoxyhexopyranose 171189662.6 61320835.22 93866139.11 48700496.08 87987316.19 85315142.79 43480401.27 60538642.73 65645857.6 68115829.34 115811125.3 24139294.19 49066130.92 30738224.44 58130722.49 43090941 73294803.8 81264436.23 61366360.23 25769394.9 62630834.51 61058373.26 47886149.71 79773464.46 80421479.64 88883415.79 68124390.71 73736169.4 76678226.96 72458011.75 31078561.45 45624777.63 61252508.96 50774392.51 73726954.27 150318981.9 55143415.25 19917553.34 60622244.67 39681276.62 89166883.23 26462202.4 24776431.83 35510762.95 16108079.11 75365797.72 62573290.23 46693813.61 86931968.06 77625766.79 80052904.79 62658037.49 66062395.66 67598826.85 52744278.89 44682353.39 31665455.12 77763155.72 34396275.86 61236337.84 53025105.89 43084659.58 49272694 80796772.69 106869182.9 80094260.2 79836231.81 64204798.05 63884981.07 67023423.29 78957329.06 86488333.54 74681321.22 69367638.7 35733718.59 39665105.71 65708406.95 61830635.95 73610488.21 36621012.07 49608348.31 52342118.67 25651089.29 85814902.02 64307739.67 57411500.7 25009741.46 113264275 3499250.251 35167088.74 45999310.26 72093745.1 16211564.83 45380603.49 71852107.78 70342712.45
2-Dodecylbenzenesulfonic acid 20024073 19686360.98 47673244.51 43103484.27 7423567.866 22487420.78 14747817.67 15614583.53 15264376.36 20373832.43 19809549.11 16717865.1 14986922.67 16735732.59 13287109.89 6767834.794 17166058.26 21434486.45 11191790.6 16225478.19 13935349.02 21893148.79 12594109.61 17164865.33 19733102.64 15991860.3 15018878.26 3972489.72 18558507.03 47340784.99 16428343.13 39050713.77 20702690.11 20017364.74 24037985.52 26581037.32 12756206.28 7468741.401 18751723.63 13428781.83 19392651.98 11339349.54 14155465.95 18821211.16 2721123.55 16413192.53 10104360.4 11991020.35 54763907.35 14229978.2 12440094.28 13653809.85 16887372.32 18023507.02 10681560.77 17174117.51 11294959.28 15884525.84 27288551.74 15989693.28 12989502.87 12600967 13169015.48 21975211.43 38754752.17 17359705.18 12078846.22 67523308.7 13779856.21 10315921.25 15952778.86 15127671.16 17420027.86 13292780.84 19681717.5 13075742.23 17127581.72 19797849.27 13771001.34 5696694.102 12743528.35 10732722.59 14213579.22 14436592.17 47002621.62 14833360.4 13695433.11 17162097.46 892623.0339 7325597.421 12713021.5 15256496.42 4088661.614 14259903.95 18563236.12 18027435.86
2-Furoic acid 2448667.987 7909358.426 5543199.625 5452199.132 5386875.76 9081956.595 3591571.192 5232600.876 5029760.434 12130233.36 20256843.95 20031117.82 6141234.05 9844151.433 5887469.94 12754918.39 22842607.11 22042023.6 4292060.139 7341979.981 6545982.291 14307577.05 17970537.7 17186401.58 3955362.855 6906641.922 6808832.765 6675610.388 11286333.96 13844503.7 2945565.618 6753236.933 8428378.173 5695599.293 4392096.378 12445899.43 10077567.65 4930777.313 2428507.511 4682556.312 6179689.747 11622331.55 18634018.64 2665962.935 1325338.723 5359846.946 19053561.92 18983625.69 4977712.4 9095616.879 9074970.42 9621331.812 12478919.08 2703683.32 9709382.283 5720057.588 12442588.03 12201914.85 3302705.5 4826664.528 5866703.675 5397008.64 5778735.601 4267828.383 9661672.332 6993313.04 4536084.94 4332214.36 9068910.29 7852987.446 7868444.83 3236693.569 1786110.159 2506123.71 3433433.283 1674760.364 1014448.538 1797266.221 3778735.922 998630.6449 889659.1764 1304991.425 1243848.807 3099340.399 1533766.455 708592.2169 1974022.974 2069377.343 112959.0914 1474146.701 1042553.102 7052027.912 204821.5378 2407892.485 2325108.157 1844819.478
2-Hydroxy-2-methylbutyric acid 67146870.13 123400852.6 73613880.39 102806689 32799107.68 35022983.84 60617023.55 107043627.2 73361747.98 97922333.76 47347278.8 30179487.66 90849888.25 122209132.7 82118934.29 79470205.86 53472468.83 38444152.83 84706712.3 122445578.9 86603813.49 137323466.4 53561722.79 38340962.66 86959506.37 92497528.98 71833371.94 89476833.23 47533060.2 34980528.14 74497626.89 98209132.13 77314172.85 86519179.42 38425719.34 46658078.92 76105791.39 52654616.47 56725914.85 68448144.35 69541566.91 66438379.26 84819857.79 51627874.08 10468532.95 60743892.12 95949666.14 95419231.64 62302676.54 72893211.46 74690076.06 71580039.88 75169244.38 50130021.44 67951368.19 61881527.49 81735146.86 79032811.95 49945843.47 56709672.26 61353540.14 64303297.95 51953768.57 49528623.49 65715027.97 63341729.27 24027242.05 33633914.25 45136585.24 22860042.94 46623873.25 28363145.68 37401376.51 35974865.94 27320862.9 32940545.49 25190529.71 44393425.6 39067593.85 13550272 35551709.56 23921366.96 36517098.89 40999888.28 29031509.61 26041772.1 23984927.36 33786616.59 1564161.04 16539653.45 34321363.02 23608654.74 6074175.397 31428899.61 26825752.64 38198287.47
2-Hydroxy-4-oxo-1,2,4-butanetricarboxylic acid 200673.2766 1631710.057 751952.2745 461363.1753 233726.1861 409821.8945 167508.4053 2588428.765 1171401.57 540919.9445 3333131.48 355526.6016 387035.3952 2303746.129 470792.3174 559276.4722 2215576.952 158593.4545 304834.6232 940004.8736 189855.0073 544380.7644 837384.7674 456032.3374 1719088.226 978823.7259 1355613.31 2185514.778 2735667.554 2284997.617 3451520.213 1674532.852 4011713.839 4695151.139 4550562.167 5358052.473 1017257.184 588730.7122 744901.0202 904092.6305 913907.0489 774982.6945 173968.9082 928951.9073 491785.335 1250949.921 193600.6894 201523.6077 147578.0122 167396.9143 161829.3452 173010.2566 146568.2012 147038.4296 173573.1344 187946.6413 189798.1611 639533.7369 1010850.504 159529.0917 158991.4133 263862.1671 1152996.621 1615264.173 414845.5049 160751.9603 544587.5819 458399.367 636345.189 136504.3811 239418.3498 3678489.149 3267835.639 3065217.618 1809918.7 3201762.258 7102146.353 8129670.794 6440713.704 3922205.652 7267063.362 7963582.51 9386101.199 9741977.797 8600586.713 7627225.224 9597391.476 9559478.422 1520312.438 7018879.627 7182711.129 8220465.906 4078725.677 8909161.076 8286194.376 2483101.083
2-Hydroxycaproic acid 12775303.44 16066876.18 14684008.2 31388064.99 12071156.27 12392089.06 14147691.53 14335542.22 13408519.15 31101325.61 17833229.93 12062441.75 18500455.57 16334277.67 13279068.13 27144700.77 17295459.86 14602365.82 15701237.3 16525663.98 16465779.15 46122061.02 17442918.15 13160834.03 16190764.82 13509683.42 13553203.55 26759765.49 16124657.5 12330228.34 15107130.11 14739480.96 13299073.32 27351745.38 11714693.72 15242683.09 17020008.16 10868766.73 14540012.22 17500468.94 15861572.38 17027267.63 20958977.08 9898874.395 2726111.214 13068546.46 19703851.84 20454259.51 11215650.94 19568610.84 15134481.56 16325529.77 17680692.31 10532039.74 17885712.81 14173900.86 16785627.96 16445837.65 10501200.38 15492103.1 13955094.76 13968433.03 10557312.34 11248132.43 15565471.2 14113979.89 5296599.481 6302170.558 5758322.461 3720974.902 10457211.82 5842898.228 6198621.793 5192323.653 5191780.949 6334318.762 5296149.995 9965651.611 4995575.063 2087083.24 8336284.505 4180061.908 5574321.273 5252374.255 5053816.286 4689434.947 4511558.407 5656363.235 208471.9001 2866550.75 8134328.768 4280834.35 1169454.273 3759295.59 4324918.617 8005204.251
2-Hydroxycinnamic acid 1301584.039 1336887.593 627641.1927 1429745.895 266678.9969 439643.8184 1976501.592 959185.9214 620509.4674 1866964.568 419616.1315 705555.6837 2475203.423 1407255.264 773793.6287 1714250.524 456882.0976 1093441.607 2237326.412 1478833.008 875433.2068 3363174.133 505624.5109 950138.7091 2208074.613 1170601.004 689627.6526 1573312.088 392115.7062 673776.9316 1685872.916 1102176.299 649516.578 1292668.988 215826.3482 646180.2141 1575010.41 8293361.692 2280292.581 11591528.73 13060228.75 2042141.87 22890449.51 2406516.698 2685742.387 11376838.78 2054244.158 22496106.07 2840685.071 16868341.83 15102501.44 1689354.14 19311986.54 2407321.259 18088108.07 14311683.79 1816304.984 17916647.25 2466892.261 13418863.6 12819961.32 1104416.822 7156735.413 2495049.919 10379605.5 12164449.33 4357267.614 6748002.669 7306333.144 8222650.104 6412921.195 5359322.279 5285085.095 5301082.785 7241841.54 5136790.37 5290928.319 7693001.28 6137057.162 3328294.714 6187760.947 5415606.012 6705934.779 8034630.762 8809681.569 4556737.692 16013102.61 5585291.735 241118.2997 4888928.108 5059645.707 9804027.664 1129386.305 7505865.482 7950068.891 6756999.696
2-hydroxysebacic acid 2427687.582 2993303.163 2779449.983 3202323.744 2802346.724 3056160.463 3011985.638 2339766.509 1952496.439 3356761.044 5526452.896 3400743.423 5368196.703 2854542.713 2348026.459 3170516.092 4373496.287 4150464.832 5235532.15 4499125.765 4721476.667 5066862.585 3882882.481 4412942.852 4608324.384 2674959.011 3497675.282 4708808.603 3435928.016 4230867.852 5699490.058 2679855.757 4198719.716 3349513.687 3573581.847 4160038.108 5745584.352 6922387.726 6175320.966 8228195.113 6672942.157 4710037.331 15160194.49 5308331.006 1054610.208 6116650.11 5291252.327 15290312.91 6916846.213 10590901.74 7124070.844 4525905.891 11619005.48 5896031.871 9703535.862 6582041.772 5511618.17 11700264.35 6422220.429 5524395.55 6642859.556 5488902.831 6650529.163 7975832.631 8493052.507 7111416.409 1872656.189 1984301.489 3651530.561 3274899.479 2349966.26 2473846.245 2010272.799 1516000.984 3713634.251 1714604.674 2363812.407 2396269.654 3245321.748 2254760.898 2182117.916 2475083.196 2202458.776 2152454.837 4100777.883 1791637.016 2308575.667 2550291.479 652354.7416 2409186.02 2082149.302 3776897.685 1016089.881 2571764.2 3566969.348 3553884.96
2-Isocapryloyl-3R-hydroxymethyl-gamma-butyrolactone 3454581.132 1352690.26 2486687.6 2470513.787 3055278.556 3361652.013 2393672.639 2213084.874 2232211.554 3220436.522 4403723.375 4907610.865 3499402.731 2937571.976 2050391.71 3220082.341 3184825.439 5774309.77 2281633.305 2541113.929 2351531.306 4806130.155 2152100.307 2700082.868 2425127.631 2171167.256 2581132.712 4825569.746 2309018.166 6280293.835 8266548.987 3515092.541 5204252.704 3291346.556 4737073.884 5564894.948 1926471.904 1529111.364 2391164.556 1997748.56 2469528.346 2593636.348 2558112.571 2470461.159 595989.7812 2689154.748 1825731.923 3136247.412 4592459.13 2470761.17 2922848.016 2375429.157 3484692.756 3867047.906 3019160.113 3647120.104 2086097.684 2962761.05 2635154.737 1294510.672 1454273.829 2801970.379 4156289.301 4405656.162 3358892.846 4377376.924 2434811.844 2481417.535 1881076.968 1430797.335 2049222.063 3076667.237 1830253.033 2887173.409 3326066.84 1894885.344 3487455.17 3641669.667 2873345.147 2966584.968 1782016.549 1233527.72 1154769.239 1634247.317 1946582.659 1426405.024 2705861.911 2753474.381 388369.8315 1451086.968 3791982.588 2468496.62 1331542.25 2363507.934 3851493.769 4139317.944
2-linoleoyl-sn-glycero-3-phosphoethanolamine 47928145.29 75115885.3 70701415.74 67032305.86 42182456.94 54338414.51 73164400.23 57869009.87 52971497.41 80802006.8 50561910.79 29792352.5 118708764 86083029.62 64315629.05 74593355.44 62429788.54 46534525.03 81115205.14 61769533.97 50886205.04 95676939.04 50420775.59 52823784.96 123257544.6 75482814.51 62471438.23 91958122.69 56749129.84 50482513.39 159630122.4 117350553.3 106164080.2 143029983.3 80058766.39 167839787.5 118641791.6 81637638.43 98917886.26 159156658.4 138654144.7 79796589.13 82957643.26 83176383.63 38688564.65 109992112.3 111682645.1 100865631.8 84542195.31 134299117.7 116073345.5 85895760.33 80753630.08 86153013.45 124766116.3 99479977.07 117822887.6 100012815.9 97295763.78 113566660.3 110136264.9 191400810.9 104373289.4 123185452 95929273.29 126500471.2 78599178.53 93066596.71 71671545.89 59274579.92 52254997.79 97873750.06 102759001 77866851.15 94216318.45 82325567.43 136928818.9 194332502.3 95521166.86 63863032.15 93824032.21 196136544.1 226256840.3 188464174.4 154078704 89817972.26 192741462.4 187519127.8 12053073.05 123671023.5 125900894.2 147069650.1 64105177.93 181983331.3 189123687 156238809.1
2-methoxyacetaminophen sulfate 1409572.574 2136842.85 3801527.033 3025780.456 1743898.153 6009503.246 11556260.23 3842012.934 12961648.84 9990021.714 6221511.928 9270327.667 53549405.08 12732641.95 39628302.25 32044762.51 23339512.7 24936470.32 95641225.59 38725372.74 74660420.31 91353486.62 70040679.9 67279645.65 103150664.1 56520877.54 86477084.61 83823522.81 82577318.25 85887804.38 105031797.3 101838022.6 103172436.5 93148768.47 90412792.57 105495614 1774467.168 1476813.628 920578.0057 2274312.304 1973262.833 5477914.974 21672477.88 3727132.625 3309824.745 13794396.4 19905282.37 64287460.75 16946766.2 64250851.43 41580135.66 49348795.14 116383130.4 55266545.58 140627444.8 72377719.38 114754539.5 120596170.8 74867555.33 151988205 116944362.1 122469480.2 110319765.7 141218844.2 169407929.1 129529584.9 15533228.37 21986283.16 29620423 3829581.522 3632034.444 85367275.3 92703313.61 114236475.5 92750327.41 122222901.7 91756738.15 112867956.2 141521726.1 75618009.25 137428570.4 83550559.76 115937409.9 153300000.2 94239424.58 126438824.1 93643638.74 122818274.7 8622260.449 103068095.3 136130892.4 111493333.1 31707932.08 141694238.5 118687769.2 156646818.3
2-methoxyestrone 3-glucosiduronic acid 22795490.03 11476320.3 14339772.14 10759264.22 11701249.57 16577950.94 13465518.56 12665427.1 19161022.8 11271938.59 13841288.3 10914232.13 12654423.32 7344152.801 11048975.49 6453896.429 13894708.85 14098301.27 11293521.57 7909476.502 12532233.14 13254179.28 13490806.75 14367515.19 21708121.38 16201365.79 14777500.17 15012624.9 13049463.44 16094706.78 4873412.462 6357421.939 9905861.919 7789118.67 11684443.75 14302795.17 10944729.94 4657954.668 12414886.05 9908395.83 12714420.36 15835354.27 10011606.28 11813459.14 2573840.999 15768646.02 9351937.857 10846318.4 15055420.8 9889393.712 10140108.85 11830231.95 10543549.85 11760460.33 11339161.48 10856019.63 9101624.775 23978363.61 13134564.35 13399104.87 11201518.88 4928298.381 5838937.722 8987206.912 8816346.714 9322654.698 12216353.61 17727963.82 12484036.98 15473338.39 14130766.88 14126216.75 16590293.31 11489590.34 9163396.542 11383132.83 17543764.11 14802934.41 12684573.75 6940617.294 13006950.06 15196518.98 8685049.316 14008048.65 14959783.21 10825802.09 13169999.97 15156504.74 470341.8947 7408947.232 16133234.01 8022151.369 2011989.577 6659643.475 9729173.752 10013117.72
2-Methoxy-N-({(2R,4S,5R)-5-[6-(2-methoxyphenyl)-2-methyl-4-pyrimidinyl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)acetamide 920097.9575 756362.569 839050.2123 740313.2402 913987.2624 703527.3741 621652.6186 737646.5096 680483.6969 694127.5113 735886.961 775687.746 2376957.43 2245467.337 1114215.661 1317676.109 761628.0401 2591450.819 3137882.044 1560500.231 966560.2012 4559625.255 1869363.271 675853.7749 3742372.395 895108.7843 1109044.29 3969028.5 1773765.66 1349405.69 12635510.96 8368387.93 4506786.022 5510873.18 3708454.866 3517984.345 793923.5255 532051.9599 532574.6639 785174.8931 799789.9354 707093.711 752995.9423 568596.3791 267247.0424 654917.4944 711966.9078 608659.3788 642334.948 1477824.204 673136.1712 1146875.842 745800.0169 774218.5144 1815109.695 1375240.365 5016458.245 1999000.303 2873858.102 1125869.852 1615933.261 4718946.39 20440745.85 4371859.735 2183492.893 1809969.341 1273934.288 936877.7987 648927.694 616072.8143 652825.5234 849420.2566 1972469.11 1585933.436 1028742.893 1590396.035 3353703.546 2732772.669 3635964.247 2277732.492 5570183.662 6385736.135 8398721.566 7285615.281 9032373.792 3819886.402 3922640.833 6642921.092 270493.538 7649487.855 6210854.865 7105206.15 1374657.449 6362452.296 7329698.934 7846741.803
2-Methyl-3-undecyl-1,4-naphthoquinone 323544.4405 457549.2727 263567.8654 294804.2498 317141.2411 467088.2198 1284985.314 802854.6876 785790.606 973444.9318 1196124.743 1567955.688 1914557.87 1290203.599 968255.407 1312613.159 1776546.922 2880427.409 2134062.374 1512451.583 1123716.977 2254465.929 1727443.507 3526759.176 2778933.186 2107923.018 1679311.187 2314963.741 1362994.143 2316678.473 2883499.92 1846769.802 2065943.255 2351852.561 1367384.834 4114488.665 250814.902 136163.7757 236888.818 127535.1681 170904.4823 627622.409 521982.3162 378389.2672 17696.74766 255614.0713 605517.3546 893749.4116 519489.8228 323378.9687 475792.8263 1059569.308 1038870.826 952490.994 444104.7592 689822.9531 804966.026 1252306.505 1000187.302 610455.686 879191.7398 739517.4886 698802.5233 1696930.178 516261.0895 1127298.164 308582.5027 525169.2513 390265.4748 118752.686 189580.6919 696798.1525 1025982.557 616932.9675 954748.2008 771533.9191 1029611.314 2091710.092 1396567.134 1148734.558 1140933.953 2207647.469 3061481.885 2242652.928 2316774.133 1109305.595 2613274.441 2724742.547 63338.13289 1489817.619 1945468.97 1937417.392 1098633.743 2630749.503 3009161.906 2612388.524
2-methylbutyrylcarnitine 15950669.59 27609861.1 35183616.71 20933027.48 30472603.91 27394174.8 14051514.35 22335430.2 29203433.74 13218987.24 21565072.13 18378665.2 20814678.5 27427149.02 32283587.05 11309137.78 19970791.82 20192612.98 18091484.03 23467166.11 35261584.24 20800527.34 22879243.57 22694676.86 17590744.7 13313411.12 26251441.29 16047646.35 34549364.22 25251549.13 18486940.91 17617415.27 34951186.04 15864558.52 22590302.8 26283952.14 42375367.47 16801447.05 17644014.83 37176818.12 33044235.51 40573988.62 29143547.73 15084587.32 5200164.245 28789764.93 47332856.2 30838494.99 17757393.66 39824376.12 34779607.59 33517854.59 23898617.58 12925368.94 33800946.27 22607850.98 38429152.75 25703567.23 11794268.48 20795917.85 39551362.59 29315898.75 15874477.78 11600434.79 26669195.17 23849456.61 69794819.85 42701548.78 45505197.91 39634397.1 42738550.27 69980703.84 40570349.78 34373563.31 48258651.12 33413624.44 67615866.29 48376854.52 35430188.96 21297209.78 31064609.65 65536600.49 41544660.62 35351835.27 34993736.39 22929949.97 63467124.15 37815138.89 1328794.028 24601163.31 32283891.93 48831157.62 6976497.27 22576249.26 37099563.07 37043222.73
2-methylcitric acid 1021942.802 2941962.582 1477780.326 1532033.514 517019.1826 1433660.718 980091.5621 1890381.91 2051045.566 1208930.787 1671986.88 855372.3795 2724055.668 2149081.331 2582018.011 2686085.352 1199024.613 2849914.717 2944972.581 3728100.381 3719796.187 4154812.535 1908772.425 3536436.902 4030652.164 3040859.211 3113280.097 2230440.182 2001699.545 3331015.754 2684736.239 3499160.275 3355733.58 2366936.348 1782804.997 3170897.338 3793984.347 2960856.232 800738.949 2914773.152 3208581.665 2140744.003 4293321.254 911053.3314 363593.9933 2743430.493 5528496.356 4470920.528 1577092.452 4245513.158 4374815.682 3639541.497 4071513.004 1354250.772 5134038.066 3704949.011 6885272.617 4324605.793 1686168.935 3017658.817 3778233.107 4998911.606 2573604.508 1359404.667 5947673.63 4773235.453 3006692.464 3269940.925 6588685.701 5885160.998 4824470.288 3694997.926 3819753.459 3564600.565 7206697.605 3434486.768 3405170.072 4802192.688 4191362.646 1892654.748 3281252.029 3448861.563 4124504.022 5489198.076 4179266.602 3008969.602 3495231.658 4914618.194 131846.3612 3204700.447 3424505.321 6137979.535 882074.2488 4281696.659 3883465.36 3964607.117
2-naphthyl beta-D-glucoside 3455181.16 5650632.801 2279494.046 1395255.572 2484827.696 2133077.848 1389310.365 1885460.623 1766920.946 1576329.794 3688329.059 1070736.019 1471510.34 717439.9566 1164263.256 1709097.546 2412827.767 2069350.438 921778.5095 751460.8779 1999514.975 2046859.977 539322.7614 993022.673 1069124.528 595028.2903 569884.254 1002238.127 889199.2399 1245237.484 437690.4341 306274.4642 707804.7348 657325.7964 691417.1342 1841102.67 1328204.121 487484.8545 1077508.563 734686.3277 1698286.707 1021103.726 2544917.815 658952.2235 208316.235 1140272.169 1836486.042 4374981.742 1839369.952 1113961.385 1262306.923 894642.476 1860605.684 1168719.197 1209424.701 523844.9105 481874.0775 1101548.024 417341.591 929453.1522 721013.4665 413753.7015 286829.7302 812831.3184 1006978.216 485751.9031 1515741.213 2335280.202 2207527.738 2051085.279 3163378.253 1359705.189 1932514.132 1107870.083 1333437.254 1000524.536 1365023.286 1475459.329 1886840.327 589994.4842 1046193.867 630204.2761 343345.7168 1147957.601 735611.0804 675734.7238 285956.3161 1193705.739 58507.05829 502030.1721 542549.1562 596866.4571 211791.3017 532057.335 986569.1474 873017.3331
2-oleoyl-sn-glycero-3-phosphocholine 166855892.4 189196970.4 214323995.4 292978657.1 144776619.8 239414397.6 170269225.5 167434942.1 149189022.2 242486815.5 216913013.1 175122490.9 288778931.8 232230057.8 200967844.7 239516135.3 253694304.8 236205665 281958724.4 201839173.6 208890055.4 323288315.1 180609748 247586493.5 229019207.8 186598047.9 132406862 247887927.9 157368478.2 209538875.9 236615472.8 175252249.6 204559432.8 264555065.1 157634636.1 212132617.8 746520496.4 339625917.7 389705760.2 491588501.6 380105512.9 387301413.4 379361512.7 223993984.9 91295084.26 190293165.5 483345430.4 258288010.9 208955280.2 288740254.9 318839678.3 267704097.2 195514691.6 150208736.2 248569102.6 199135572.7 370054005.5 226106930 146537777.9 258151989.7 206401191.3 271279120.3 144591861.3 189367159.2 188182318.7 159954702.4 252688989.5 209739123.2 236889379.9 212718633.2 220809225.6 211675693.5 226848384.2 177633859.2 176213249.7 208822333.2 195915614.1 276340450.4 184617506.8 119764281.1 202127843.2 225394578.8 290145659.9 257696722.8 271114844.2 167988236.7 181443121.4 202633688.9 16921972.38 224207357.9 160280380.7 209107773.3 78503845.6 203309197.6 242495376 227623507
2-Oxobutyric acid 29185427.01 38731757.21 38299408.67 37809233.55 32029171.81 35611572.7 22936882.89 36730425.95 48541231.72 33605344.55 27085441.56 29510583.83 47662809.64 47122316.53 65215211.44 39758951.71 35366418.5 46346219.48 57735211.97 71423108.01 103660640.1 77510845.6 45666641.3 56585813.88 81748683.24 58981030.41 82570661 78098387.2 81534894.3 75937340.79 78796578.21 79521598.36 94561814.88 105110995.7 114975224.5 116435575.1 38869849.89 24862043.06 24153610.23 26317467.24 29431076.07 17524200.8 22789138.71 36184255.39 9335331.164 35782942.69 45904197.27 47878759.92 60717189.04 38069097.2 52665020.06 71272067.17 66685491.48 86371158.39 62957731.52 75860264.09 113486790.4 103634094.3 90777396.23 60713612.09 72321322.73 102252787.2 100172177.8 98756836.21 88819362.97 76587871.91 38489010.55 37449344.93 38909502.03 46835901.15 45218602.8 45472436.9 30608076.38 30543831.37 56094078.94 36713647.45 31489030.15 36673889.96 31762670.53 28675769.37 35254581.83 33502057 30316803.48 36478430.22 53911430.84 26560790.46 99527668.67 27715323.11 5205118.19 43577661.3 83477221.46 80903340.97 13150534.17 56339711.88 64831605.38 52348615.71
2-Oxoglutaric acid 42998355.04 167288969.3 89389646.03 72849858.23 54190822.95 60474432.57 28263342.18 103749002.3 38910718.06 69466447.42 32332026.57 60274135.38 13778963.59 75201792.03 36866091.67 39656262.26 23897752.77 53166335.17 34448631.14 66791508.25 81712415.46 85199900.44 39697822.29 105754631.2 59244634.62 48508661.86 69948552.04 71256013.16 37743815.69 85643333.22 22116705.33 90863280 73888025.02 78054121.64 57228963.05 123599195.9 89232105.54 32501322.95 33676872.24 36711189.37 44236409.1 104187094.8 33152727.22 37939753.4 3909780.655 26623484.77 53842418.09 37882385.68 36183285.22 33391801.45 30286056.33 34797086.52 36393154.85 40578607.46 44880903.5 45643437.3 11518011.88 48019387.8 43822877.93 13208585.71 30087630.63 21972465.18 65049428.57 45550623.4 14583103.47 66370105.21 69054870.05 59578763.06 65014089.2 202527725.8 111660957.1 42022975.91 32417144.95 50184276.37 201386614.9 66161333.05 75419256.7 94091137.26 31163508.5 103518691.1 113711793.9 70357660.37 76442072.08 76156710.15 231448191.3 116701505.6 523682777.6 103642772.5 38282702.55 203192874.4 346671474.2 594396770.3 143663511.2 769905183.8 423552250.9 293327006.5
2-palmitoyl-sn-glycero-3-phosphocholine 1801386914 1980307767 1807880475 2043536543 1755341303 1947706760 2340266381 2258202559 2320505141 2461427040 2742899274 2214605306 2959182828 2836744411 2777135366 2854976762 2896870921 2905490502 2805638516 2701354370 2078081591 3723253553 2800054602 3017665255 2729140297 1838349675 1922406933 2180280787 1871783362 2230872706 2174407101 1857130235 1874309279 1876330304 1402293917 1961348046 1900040284 1257928888 2319288170 1893048196 1787663278 2644789539 2573195270 2155516754 586592457.2 1875839607 3309261230 3021297621 2567645920 2884898836 2466834348 2349926929 2122813479 1874645620 2659842313 2012067261 2896139898 1947003837 1998384866 2187539853 1871543815 1631079659 1150058632 1505581847 1356034940 1499185730 1441164142 1584784996 2037110833 1576227171 2462122751 1359863263 1451539879 1426995231 1449936452 1455145640 1246461752 1681529361 1734036458 842901456.1 1488867263 1260205131 1643361031 1634427914 1525028638 847956457.7 1077259168 1231393509 118290696.1 903901905.1 1140819641 1188474823 376000146.4 1481063550 1102854151 1059554260
2-Phenylethyl beta-D-glucopyranosiduronic acid 34091571.83 82789234.89 87699060.24 46340085.04 27631769.19 44873764.01 38962930.29 69296369.62 77167257.35 53819362.99 46929088.18 53641965.11 50540735.05 85024585.83 73987507.74 41685664.03 45634839.28 60405785.24 40582245.25 69314885.48 76683617.52 66202931.29 38518347.34 50579220.29 36529706.28 65532407.9 65461770.2 41214384.87 27169298.26 44322456 33959069.54 57460727.03 70130885 38422863.62 17844201.04 41575296.65 72330928.73 64539531.31 35846912.66 71590065.68 122200935.3 91048370.27 133356535.8 32789658.46 14629173.14 106938353 96704343.7 129310169.1 39579625.45 86799359.31 118998189.6 66698893.23 98295164.69 30866343.33 81805011.27 100827473.7 64349205.73 91611084.81 30230966.38 65588651.05 104762539.6 41691308.63 47706886.89 31848672.08 54166298.61 90156574.33 42975833.3 32186207.19 40672193.04 56255269 43579188.15 41798323.13 32914309.96 31474085.59 67678086.24 35589297.36 41794314.18 39055950.57 35010122.7 24976208.35 37216482.23 38317149.05 35797509.33 33341914.83 60252426.63 26270869.18 38007195.2 30969364.61 1685348.419 36797695.94 34767159.6 39797450.99 6996303.195 27358962.99 57685047.57 40480616.06
2-phosphinomethylmalic acid 15941889.28 17954752.62 14134744.82 17485456.1 26976657.73 27016027.61 8249589.242 10703248.86 11121411.47 6091129.638 6295272.229 8341225.476 8646903.078 9115980.874 11143866.1 7991075.601 8475671.701 12423985.01 10543082.52 11282080.35 12030979.04 7802426.467 9947977.282 12246433.88 13426957.69 11653773.7 10105072.16 11436607 16875020.17 17670620.27 12680589.97 14481170.84 9508522.004 13439296.34 29382122 24904367.12 15319352.32 16568676.77 17153710.63 14913662.53 20310294.52 2097794.795 6194307.545 13083930.49 5866919.898 17476962.16 6987852.18 6625554.887 12317042.31 7148685.107 12833166.52 9554981.016 10155653.9 14593605.99 7693025.682 14403706.96 17556351.87 10299612.91 15438404.25 11726889.98 21147906.63 18286814.99 16882003.9 12077282.44 14852468.59 20223860.08 25375206.43 19297938.09 23454768.28 31157875.07 26303355.47 15243915.6 16048366.5 18539762.06 23165682.49 15876277.75 13678159.27 12861282.56 13443404.88 18651366.98 13431906.46 13585320.39 13021040.92 15162664.58 20010106.31 13566835.22 12589501.06 12652952.49 3944520.645 21048367.34 12768157.84 13023940.79 8079258.044 16569935.29 17142760.66 12108913.49
3-(1H-Imidazol-4-yl)-2-(2-thienylsulfonyl)acrylonitrile 1693482.09 708098.9661 1701812.825 726712.6738 39248596.17 66774275.84 1021315.709 519385.0559 1525931.941 451095.5323 14741394.2 20227401.03 1747015.287 727259.415 2010806.801 798033.6522 21782374.24 36026343.78 2091136.023 690762.4832 2639754.776 1426940.529 23907580.91 36222495.3 5669140.681 750353.0902 2464383.405 1683222.683 26774246.65 47275947.25 11320330.06 3133302.187 3924766.117 3855060.213 37784780.76 86301873.24 268698.0099 334078.2054 291436.4568 212223.3674 231561.2161 237275.0428 235218.0326 269729.6716 421370.0954 247577.5027 349169.3788 142084.7844 246902.9264 278104.8537 225186.8571 152743.9921 330942.867 288586.3454 313238.4564 327535.5284 139004.3346 147032.5219 255285.1411 132636.9393 206817.6537 259842.9661 307033.7721 208920.2558 260484.7666 247838.2748 110641.215 110437.4727 119123.94 217272.9645 234654.9709 252443.9383 129584.4819 191190.3932 339514.2878 249956.8026 236612.7009 301486.3445 242588.1743 372579.5245 237250.5067 199363.558 300071.9924 347776.2065 342784.9978 253732.4162 129323.4171 128900.8677 352361.2755 369688.7449 381044.594 162150.7802 356865.408 365674.6159 114108.592 175861.4041
3-(2,6-Dioxocyclohexyl)propanenitrile 50333093.93 72018506.8 69895265.72 68689732.63 58615217.42 65969825.2 37814937.42 65307232.84 66634039.35 34578811.53 25163280.92 26288023.23 61638913.86 73355581.39 69442858.66 40629691.39 34173563.5 41593944.31 53716687.5 67910675.75 76343629.13 64493322.11 34747347.55 38689903.89 63021342.19 63344462.33 66394949.49 59783665.01 53539556.29 50733893.91 68441518.87 70125565.03 64520477.13 71827698.55 68918783.78 87451818.81 71858683.45 46413274.35 94058494.47 74346763.17 71654425.72 22164423.89 27014621.31 66407690.58 12145599.7 73599793.73 56889310.15 48907161.71 70108258.27 61805859.97 82316856.52 42770367.54 36140825.47 53823526.35 58298224.43 68598408.47 51406854.22 44562158.99 57440920.12 58287524.35 74989591.84 72157087.62 43123011.06 60808364.98 68756912.09 65241623.68 71791417.87 72598545.32 77465026.78 60176609.99 75846391.41 81150905.15 78222231.75 76990472.72 76514420.16 75053430.27 71878906.98 89043706.26 72687889.76 30817781.78 62246150.99 64398924.72 68633691.39 74761753.32 61935228.22 40819385.31 74501010.43 64127134.27 4127489.301 44726955.45 55622274.72 57506560.26 14133127.67 59633216.42 54227296.73 57786604.56
3-(3,4-Dihydroxyphenyl)-N-(3-oxopropyl)propanamide 3205758.54 6721851.694 7004894.695 3968103.442 2830813.556 6265535.962 3823549.761 6272055.84 8600672.561 4984491.137 4448440.6 6469352.356 7794163.664 8521386.435 11589390.6 6132537.572 5754794.095 10213989.65 10648957.75 12445547.09 20053274.58 15128604.19 9567716.746 11765743.26 10939453.39 11200803.56 15388772.32 11846944.42 10023453.32 12148263.12 12442662.87 13172318.66 18098549.29 13467571.41 9809231.874 17809820.69 12196345.76 3185433.628 4968430.511 16629698.98 14679118.53 12373311.95 6538361.106 5462014.264 2909390.151 14548580.17 17107987.35 9866638.005 7643420.226 21715332.4 20463826.27 16434537.3 11244039.02 9923248.243 24375696.56 23463746.83 21658786.27 15425006.71 10917685.82 22417995.07 25121822.34 22795790.72 10462373.38 12674646.94 29716770.15 30130028.08 4447070.872 6366169.868 6630545.806 2501145.488 6189447.689 13964685.53 14141561.41 10664351.67 6484055.955 8496516.352 17078994.79 24227024.86 17826571.35 5305410.854 13872070.05 18246581.52 21174265.62 19067151.76 10452556.51 10506846.06 18770434.6 18749349.13 1194074.177 6001281.889 14794512.33 20130224.37 4282044.383 14101107.48 11085572.88 17249586.69
3-(3,4-Dimethyl-5-pentyl-2-furyl)propanoic acid 7332689.241 14536969.29 7552567.595 8129940.885 15256915.3 14954228.06 12115780.79 16974893.64 8275517.005 11506953.58 35805712.72 19166089.08 13999152.52 24807655.22 12398086.81 10790248.66 20420279.17 18289613.52 12016078.47 17736370.38 5558020.063 12974564.12 23039493.03 16692556.13 10083396.06 15264902.87 5319994.858 9731524.342 23353480.62 16565095.67 10176456.28 20581969.04 8248269.205 11155883.15 16761314.01 17272312.09 8346866.783 7873777.343 20680669.68 8174250.227 10397703.27 14891747.59 15742837.61 17535637.45 10105336.29 10985328.99 15206018.93 19123605.86 27818224.47 14436035.77 10063910.6 11782926.12 14736815.12 19025889.36 11126717.71 10628567.27 13029090.75 14359397.58 18760807.35 9811590.403 11728148.2 11851001.91 9093331.313 20531416.45 10238070.15 9706365.792 7841755.791 6539712.067 8351076.945 8402978.298 8966209.518 9329319.868 8040371.286 8312070.747 9640771.776 10874299.76 4341734.28 5682276.384 4920516.115 3597102.315 4226675.341 4930857.568 5837361.935 6321020.427 5998924.349 5309207.688 6759615.423 5575322.301 4387817.449 4373411.529 4183990.712 8176406.406 4757138.313 4765112.096 6619508.846 5778942.26
3-(4-Methoxyphenyl)-5-[(4-nitrophenoxy)methyl]-4,5-dihydroisoxazole 806761155 376602178.6 2316115668 1374204559 5420274663 6903296554 820258242.6 360932354.6 1918689728 879761087 4327074269 4388386705 1071629677 361766024.9 1916685280 908547349.8 4527222623 5616213412 579376617.5 272114506.5 1332186679 991645783.5 3853844292 4328946542 887371522.2 191006117.4 1453541002 832866256.2 4855052521 5187178891 785924688.6 194212942.7 1436408414 843498107.6 4262422694 6875782906 1010291.02 668254.5762 809441.2803 795096.1373 803855.6631 590025.4489 592192.0168 697003.5239 364821.6941 749123.1746 616049.9322 829386.1252 808580.0793 559882.7242 618389.0353 603619.8264 554486.5357 567108.1036 767809.5524 654758.2907 601693.1649 1621011.116 668950.7858 607946.2053 705632.0738 543435.8345 531159.2005 654176.1273 781225.1361 614891.4034 3397398.032 3365117.917 2098950.6 1543049.335 4331474.925 3340210.665 3099338.184 2097290.581 1711309.427 3265274.912 2325503.131 3822632.784 1478167.537 1922765.303 2386579.61 1636612.545 2846767.981 1246490.432 1567882.016 1434788.756 2362476.267 2514522.73 526750.237 1484524.325 1508721.3 4684921.115 1232734.925 1393951.183 1148433.382 1792142.549
3-(METHYLNITROSAMINO)PROPIONITRILE 25427932.65 88707710.74 53366025.32 22975222.27 17294609.65 22603427.32 24348197.38 23545496.91 50760356.11 24759106.65 34267494.96 20213504.47 25655006.37 35084949.06 23463913.48 19300734.34 31727066 20252944.66 26757440.27 23774770.16 27164413.3 30402234.01 31542302.13 21620343.54 49838900.58 32059055.91 74769314.9 112503323.1 103335805.5 115465929.2 65130391.84 61632464.73 93514888.07 146692795.8 144114450.5 265316047.8 33080604.25 15888290.45 32113891.71 34489536.16 33469545.18 22384515.56 20810565.8 11374445.85 15244188.74 20105418.21 18879219.95 22102539.44 10998289.62 14895864.21 12676807.01 9372647.959 17433113.06 9097336.444 12197933.01 15897431.37 14798455.15 26752046.39 33566815.77 12524080.3 12749783.21 23135545.3 24278280.17 31600116.82 21133440.66 15459304.92 48371207.73 56262731.71 68195349.19 33634893.43 18947353.55 343419176.6 349287638.6 17475285.92 287534470.7 254928144.7 332141928.3 265737855 394094462.6 155174875 197257131.2 287482676.5 243981259.2 277421891.7 224839899.7 77029318.06 219918171.2 139340552.5 6423016.295 52466036.97 60015824.98 134812587.2 15514064.7 132108235.8 110879379.5 26940368.75
3, 5-Tetradecadiencarnitine 12062963.23 15013791.41 10811351.94 12693407.89 25860789.13 44378040.17 10449770.62 6252466.908 7840242.417 6983757.621 50093358.75 30586845.46 9880233.802 7749093.459 9247292.468 3374187.61 41162689.57 22616011.5 4919154.474 7408166.821 12964581.92 6104875.376 33056157.65 7582854.947 6405834.304 4902706.818 11074493.08 3105883.848 28591635.61 12448916.41 3735418.926 2377503.374 8470986.31 2204453.2 7036839.635 4618140.909 8969739.394 6583993.784 13144732.86 7241753.16 7638025.358 9540125.717 11307492.55 9426693.613 1329591.129 8285905.182 14143770.92 11069708.91 8430877.264 5450851.958 11113890.36 10356042.19 9655301.089 11922083.27 3892708.454 14235597.3 13125182.92 11428760.12 13528698.44 3890857.054 8730761.925 7502804.924 4957923.709 6443132.688 3139364.582 7314635.045 9630898.114 6386426.34 9094313.992 7639312.7 9216927.553 4687361.376 3211266.436 2984756.445 3442724.121 6944467.137 2559014.152 2515243.451 2299345.448 808124.5548 4351579.363 2492392.072 2717309.554 1184983.788 2514048.731 2340638.929 2965538.982 1705037.949 144062.5019 1372482.416 2407797.691 2737565.726 548867.3585 816943.6673 978367.3966 2984642.932
3,3',3'',3'''-[3,8,13,17-Tetrakis(carboxymethyl)-8,13,15-trimethyl-7,8,12,13,20,24-hexahydroporphyrin-2,7,12,18-tetrayl]tetrapropanoic acid 4252394.656 35406490.78 22164473.35 31297806.51 24703021.54 34637049.48 1254402.084 16041873.03 14727227.03 11133302.39 20653083.92 8692953.218 19157366.88 33864054.46 22291773.88 19144523.7 20418685.64 25446111.53 8612804.243 20256632.64 42152777.57 33600666.1 17338919.52 24207014.71 10187247.67 3438811.737 6831196.108 12007640.2 17413018.12 21605345.67 13513139.13 8491383.873 22697521.97 13225753.27 3295782.913 30177515.1 28484823.32 25219565.07 21385064.44 19438313.08 37798750.59 1426799.695 11519508.84 7291733.044 727747.9942 8055692.386 18146736.52 26696391.18 19632904.32 5389429.276 25110404.89 4032645.419 14762779.15 6432452.483 6956298.834 20774033.41 6007709.743 9176284.094 3436032.937 4437315.88 11614501.24 4231733.418 7727135.685 5190384.686 40721290.01 14733130.96 15817562.12 14357892.16 32672827.33 16772638.58 36761828.97 14267340.84 14746372.16 7434644.789 11212674.09 5390259.458 4905261.727 29194532.24 24000800.31 1150809.112 11021238.8 3956430.807 20082744.12 16349967.56 15559051.02 4669076.402 5252478.942 15554882.72 1560621.818 11316496.66 4924075.848 40222575.77 3547934.966 3467095.957 13717691.1 13768706.97
3,4,5-trimethoxyhydrocinnamic acid 33261.99091 37710.38541 36076.18599 36514.66177 32319.49938 35289.18943 32160.81196 40262.65996 38453.97352 35879.63574 39964.2876 36299.87518 203540.2268 52909.95556 142805.1164 76515.98606 88259.39833 195941.3195 718912.7648 455107.839 479598.269 719217.2396 628294.7885 844835.5639 1084063.372 457124.0447 532834.3284 616152.7597 987670.0446 1082753.099 1447562.152 739873.4587 938651.7706 782461.7568 976428.4468 2030427.632 35408.50853 32695.38091 34970.52938 34292.86864 35084.80982 63070.00662 35943.46347 30994.15442 27298.42675 49011.82619 128608.3265 38840.60409 31546.17367 337471.1817 157344.8153 275447.9399 169876.0075 186877.6831 823567.0827 482323.3347 389044.875 384587.8859 327723.4674 769766.136 612899.5745 516715.0531 563198.8754 748063.1338 1000036.254 598141.5787 33649.94417 33446.00585 34925.91082 32662.96555 34527.59499 115847.3052 48855.82413 170822.3811 34700.19073 106154.0808 399626.8315 317769.2983 518025.5572 82456.3695 194095.9189 705230.9865 725446.555 2230797.295 907900.7316 580476.3146 526445.0078 771499.226 132771.9754 693980.9367 746303.9869 389662.5141 199662.7112 2077561.187 1256127.764 1018634.597
3,4-dehydrothiomorpholine-3-carboxylic acid 7981641.431 4032436.672 7834977.602 5542469.489 4646440.099 7002853.167 2791792.019 9788487.19 9090531.656 3781025.16 2539584.985 4453531.269 2836964.823 8178992.512 9116406.714 4298690.047 4078208.237 9042156.732 7373175.194 13414326.97 20739679.83 11005884.36 6871010.58 11519742.25 54007264.87 30436111.16 41860701.16 40422700.74 33429274.16 16856883.81 8134681.434 75650134.33 16526227.37 15448191.74 16324101.08 8756357.509 12662749.33 15205797.53 17259396.07 12075679.72 13883267.94 4400642.739 5646177.303 26808782.28 12246133.87 16922610.08 20262370.73 13043372.81 26482056.13 17336714.09 20496923.03 25873284.06 14114994.8 30999873.18 22514318.71 27830512.56 26484917.33 43796662.53 73238900.14 22104151.59 27705811.42 86258653.09 137429882.3 84104416 28551805.93 24507489.98 14735987.29 19584282.14 18312642.73 21342613.65 27317246.09 3322200.612 3998222.4 4676574.967 9381518.732 8027346.147 4321718.936 4291882.117 4780468.522 5439450.82 4586941.488 4258256.605 4247774.015 4930432.095 4610501.414 3547375.062 4504982.456 3829451.444 1786062.029 7794323.018 4883381.496 3873998.909 2639239.786 4515940.384 7191834.632 4550647.283
3,4-Methylenesebacic acid 124947.9383 115609.4009 173085.9484 49417.44542 133799.7623 116990.2084 99209.21079 57369.10104 113546.26 60352.30577 85798.67705 63171.24277 166581.132 104878.2072 216885.1181 110475.7582 131922.9998 122319.7288 314018.9429 140537.3882 184381.5373 249473.7338 110129.7157 178790.3312 2285898.6 188579.1097 247126.4936 448570.1425 206115.5251 203183.7576 3874384.533 1207530.346 430522.3309 654906.3163 346359.7453 88974.26668 48604.70868 51736.8672 104469.197 94094.38856 107202.9547 50694.99027 160503.5699 152799.5743 96009.94433 104028.8296 206859.6494 130316.5162 154443.871 65135.03372 165595.1176 531233.7455 141199.3714 130234.158 187600.6913 185665.4593 624876.8675 740383.3669 861731.9628 252042.7515 115000.4044 5636280.22 1646347.803 1172488.683 366011.3892 234444.4563 95055.84791 76698.11448 143950.9246 97452.50536 134703.303 135729.4183 156806.875 46950.00296 99954.73557 102028.1748 164632.8351 144779.1773 162347.0405 96329.63362 134773.1392 166762.9597 132290.6522 234727.7647 204588.5 169730.6933 119543.2658 149881.3445 32079.79147 138137.6959 143921.2758 290545.5197 153526.5527 139768.1545 148715.4866 211532.1231
3,6,9,12-tetraoxatridecan-1-ol 171145693 9659483.485 175441346.2 117865122.7 134455346.4 124360450.9 107853443.8 106844525.5 120585244 106217164.8 133601493.3 109508357.2 154084540.1 144565113.1 131995766.9 80084862.34 166394147.3 129227427.2 156906218.9 171510664.3 157524706.3 169944004.8 129816496.4 127322854.4 172483910.4 178035287.9 191864626 82236372.87 94820421.73 81286054.02 86101561.7 98214822.18 90622608.9 106912421.1 87455716.55 156353244.2 92831419.57 55711110.29 104870097.1 134302016.1 96910166.05 128786701 112606568.3 133361578.4 53604847.62 120292038.9 75988187.79 107769057.1 189871364.2 121511814.6 152036325 108897127.9 128811102.4 120364706.4 156739171.8 118927966.6 118563600.9 152381178 250895094.4 222783405.8 151667875 94620630.62 109507168.2 130478496.3 64807801.32 96049088.72 155559163 120813610.9 129765293.8 106730463.1 124229806.2 125646245 104742581.1 188669133.5 186849516.4 133828448.2 170813563.1 127669422.9 128948251.1 67368369.74 111378550.4 136163698.6 112222448.5 148829376.4 202837716 160957970.8 124083411.3 139470333.2 5716473.762 44938002.09 105982022.5 94661335.81 25774655.23 76134616.05 137114574.7 143072826.2
3,7-Dihydroxy-2-(3-hydroxyphenyl)-5-chromanesulfinic acid 133661880.8 371492911.1 253677936.5 236074618.6 67814677.48 126521287.8 372166615.8 382482494.1 213667991.3 405445914.3 145722812.1 231380433.5 369614311.9 522455397.5 285674587.8 327266742.3 122568691 263809839.3 267974654.1 453708289.6 195902425.1 425581305.2 157287148.4 201713910.8 190501043 379973803.4 180105133.6 228337238.6 97760979.99 137258645.5 203955347.8 351710496.1 204192761 197169195.8 64836643.38 154342067.9 162757667.1 63338508.48 179163082.9 146258678.8 121960258.5 520763792.3 163445895.9 110702791.4 56059775.04 121576234.1 475787942.8 148201748.9 147333602.9 231420730.5 158575692.8 296694632 132170606.8 127860446 240099696.7 133883779.6 310546381.2 131486163.7 144258422.5 181892782.9 124397297.9 183288754.5 61019825.36 128688651 140187934 149631018 269738341.5 191348527.6 216009791.1 214962498.5 403997460.8 261388194.5 251351888.1 178578606.6 218038244.8 331518495.1 250770510 304642647.4 166064232.8 108817930.1 314959913.8 287322088.6 236519058.1 221226247.9 256736888.5 185630558.6 274416543.3 205823781.2 10299669.28 150358665.9 274556806.1 281685898.1 61031485.14 170016239.2 236943646.7 330522616.8
3,8,9-trihydroxy-10-propyl-3,4,5,8,9,10-hexahydro-2H-oxecin-2-one 1492143.095 2905765.663 2286884.469 15716235.3 6030668.101 4495710.531 2026309.466 2030634.112 1977657.349 13104999.93 9901545.595 5920489.799 6236264.791 1944153.44 2002572.231 14849153.31 9520778.227 7009110.222 2289861.485 3011150.697 2239683.35 21350538.26 9714697.122 6846364.554 10349342.11 4104673.93 3468199.663 13612952.73 8006778.827 5970702.453 10103347.88 3918898.057 4208282.779 8718602.952 6351826.699 5810493.781 3664727.997 3312232.289 8324563.524 1134911.163 2751949.261 4610180.17 7208013.981 907391.9333 1933755.666 1937225.23 2921819.189 13388749.7 6490437.025 7877847.84 4502897.155 3289504.228 7270787.029 3300061.391 1891716.742 4082445.802 3557941.369 6839066.005 11633192.46 8996661.951 6632293.84 6808560.137 5522371.724 10006546.26 6973465.758 5377197.925 846475.2247 1627815.64 3462422.953 1511822.91 1820245.496 1155957.069 1120797.986 2410452.567 1541541.04 1415579.421 2248940.159 2731802.351 2362281.76 3148804.119 2351789.355 1976312.236 2959795.141 2570339.235 2449559.732 2584501.001 2026940.553 2307489.017 2002147.428 2337630.814 2762568.812 4630388.865 2198798.624 2691713.646 2572944.478 3934869.59
3-[(3-Hydroxydecanoyl)oxy]-4-(trimethylammonio)butanoate 3293523.207 6724051.601 4890236.841 7364817.208 4918863.097 8266102.808 3971494.889 9043566.293 12909930.65 5296442.216 6016355.558 4914930.148 8837566.215 14501416.47 21211348.78 7371945.659 6724700.938 11177209.18 9687749.084 18952610.59 30431706.01 17565477.98 8590525.447 26498650.59 11195429.8 10311522.06 25500642.98 15811598.04 12741882.25 30152171.03 14712352.1 18102231.8 24308739.8 21298445.7 13716049.01 49115111.89 10797613.29 2066145.214 8814502.418 5675251.786 7863533.735 5246028.515 3652386.913 17390912.81 1683467.824 14643008.06 19332981.86 9101340.553 21456151.94 14001892.95 23550374.47 25525322.79 12018611.28 44566674.94 20270576.34 34968038.23 30014640.25 16307729.87 44642516.41 21756512.4 42081525.26 48713752.74 15879210.54 44239544.49 33222231.06 38205122.61 3412078.858 981361.9268 2802984.793 3098845.809 3949828.834 4159092.645 3804014.883 2436300.68 3775421.113 3558866.713 5013695.544 5338327.124 3387603.878 1997533.948 3337465.346 4218463.825 3654450.243 3559746.949 3544774.13 2509858.08 4262269.569 3681399.309 275227.8812 1972834.305 2849785.246 5370587.016 981895.2659 3290641.776 3312687.855 4054434.239
3-[hydroxy(oxido)phosphoranyl]pyruvic acid 9625188.842 11825166.94 10304405.66 13541670.88 12239485.68 14867060.85 10941609.92 15850567.87 11408396.88 9797548.997 6855298.767 10672532.57 15996378.49 12668053.53 7415766.981 13966151.57 12521854.64 66602103.79 9942571.803 11279670.71 15605010.62 10457679.7 11537457.9 13083593.77 10649175.89 8888516.05 9903492.781 12604274.73 9684354.321 8000225.598 11793038.09 9346864.802 10062660.21 6616688.445 9034614.531 7430018.055 12546949.84 13364192.2 14227367.89 17040202.91 14562529.02 13471436.92 15788714.64 7871808.893 7748422.778 12845060.4 9125048.597 7585044.095 6705557.671 9049784.883 11145374.21 8636559.786 12705110.82 6929296.64 6285466.22 11384649.19 8874407.027 15686088.28 4221116.812 9319586.443 7770691.905 5285090.653 9522402.307 15522344.31 10712282.79 12975617 15669478.89 86778497.89 6695335.105 11171056.77 9313744.776 7149555.456 9768732.159 11601175.16 9578536.343 13855414.25 10455027.12 10645808.53 6805387.426 11429725.77 103071585.3 17080259.22 11244887.66 11014908.19 11386847.46 10702639.58 10874923.89 9988995.386 72742813.9 9064135.003 59716598.77 6024049.576 45557522.55 8447515.09 10181069.68 7577858.515
3225312 333055.0823 676167.9869 251242.5648 934901.2609 249856.2761 361745.9437 1475369.152 1649692.492 1543251.506 2107804.79 1665738.263 2118048.32 2327572.551 2985158.121 2574677.086 3014826.048 3948073.168 2850200.063 2740348.039 7486236.966 2515051.123 2187003.111 3164422.76 4389820 2465852.5 2992861.874 2786445.873 2813303.929 1942864.251 2340922.39 2433143.958 2529151.584 2472652.761 2225538.484 3427565.892 2242591.545 248959.4714 104383.318 398547.2645 1255240.387 394349.221 1651149.814 1266511.764 1242428.858 1228349.977 1813790.061 2107952.963 2037311.636 1755834.075 2081898.888 2829369.137 2813858.554 2724537.555 2761910.581 3294568.343 3053167.567 3224875.839 3091691.672 2014104.276 3140822.014 2854828.046 2527318.598 2650852.592 2178893.674 1785764.985 3066321.831 2737121.038 2591384.604 2376958.442 828372.4848 504083.7464 2845484.987 2646088.517 3467327.596 3338415.271 2837334.689 4625489.793 3548213.134 6125063.428 4704172.814 3085778.718 6260915.984 3564595.421 2898690.402 4107916.195 4585544.829 2492914.803 2687527.363 2373839.745 2732397.187 2683324.05 4478819.48 4981856.469 3473272.073 2214597.859 3353467.68
3477 41996141.02 36588532.83 41830116.07 42289863.18 30045138.88 40280789.18 25050795.24 42902860.65 41167265.66 25350353.98 12375740.23 18893370.98 39152220.01 38755592.26 61941225.74 24160018.31 9522832.651 17329979.52 36360389.84 29203592.9 45402027.21 32474432.92 14688730.17 22367644.63 35417163.55 34513500.34 43091605.36 53478051.28 38987263.45 41383383.02 45968438.17 35230907.69 54367357.08 49518888.66 41237917.54 70648042.09 29495437 15942118.53 34328201.49 30969329.44 60177444.01 9289208.996 12287069.77 32906541.38 883098.9591 49368025.22 23566621.04 25777187.36 35198058.61 29142016.22 52494329.82 16685045.58 18218646.62 32785468.66 22810702.21 43392743.08 22983605.91 35419788.51 28924688.35 27830797.56 51696351.79 34167259.78 32536288.32 42133507.54 34067732.39 59988835.51 37648520.56 39521644.53 34482640.76 26374590.62 36311531.84 35321013.39 41227170.55 30411581.24 31773799.59 27068171.35 27556516.28 37716814.34 26232830.37 12079164.18 27394710.47 30517792.32 28520578 31299815.32 22897795.39 19161663.45 32679660.73 34227622.83 179417.0514 12830412.6 20976349.23 29129703.87 2975804.118 32129432.1 29131898.9 38145593.04
3-Acetyl-2,7-naphthyridine 404622.7772 4561073.567 4634478.951 1369089.801 3768679.067 5013344.232 942453.5459 4378655.976 4846211.323 2675864.68 5322818.02 5583508.001 803766.926 4906433.508 3810552.036 1772304.406 6217450.66 7366475.811 468059.4303 3136259.815 2621109.181 1855150.65 5592316.586 5939034.716 290070.5254 2057211.791 1304109.584 501935.5026 4163101.781 3320295.857 163417.7518 148325.5178 857601.148 294526.1114 630720.2886 959569.6652 3088615.369 3823364.193 2708560.496 1523985.047 6342371.631 2003749.475 8001353.589 2351853.948 909646.8982 5269872.805 5005172.127 11455637.64 2413703.667 4763307.52 5607498.572 3264206.215 5760607.148 1689904.958 3665765.646 4184070.786 1978239.554 6163867.838 967759.9658 1609543.274 2479534.284 122642.0233 564406.0219 624777.7368 96795.0926 173439.7491 4032492.129 3950793.322 1623585.503 5683660.904 4759404.735 1093196.919 1561617.362 521095.7734 4112506.94 1418565.218 262234.4226 414023.9304 257776.1465 100670.0812 347488.4905 115102.5534 155677.2478 58045.8728 198549.8635 182818.696 149340.1378 192291.3387 35608.80706 192462.9787 207043.6244 201381.505 33911.40557 43682.41576 323747.0692 241929.027
3beta,17beta-Diacetoxy-5alpha-androstane 194755.8975 252601.4787 172181.0678 273699.5803 84003.02189 377195.7465 465128.443 431518.1875 180181.5684 520759.8821 371179.0396 697319.6132 1722332.472 1065909.35 586095.4665 800733.7505 471074.0366 1148639.295 687597.4487 613265.4322 411481.0745 1180350.748 676553.4437 1946227.851 1127384.544 819590.1847 653194.9453 1071489.273 522396.3329 1684996.721 2578377.57 1456702.176 1492492.435 1749734.114 932092.0291 2576964.895 325030.4128 47150.94556 175435.0025 120873.1174 161238.2354 647310.3131 458194.9988 261170.7822 31889.4238 257798.9833 532869.0458 409845.8584 344183.0463 357659.1447 358242.9085 728854.6727 468540.7508 407542.6825 452209.6327 243717.3606 1043838.397 604587.8147 1234640.885 518011.0935 500632.7083 812697.5662 749909.6913 770495.7093 404138.9074 910486.5132 265676.0025 245184.6976 102642.0108 110688.1301 172621.7906 540324.4545 659090.3934 499961.2847 755374.6939 463967.4921 775180.3005 1448713.693 667893.7478 433439.6977 556031.5435 1812619.275 1914941.962 1686299.444 1156430.646 845939.6326 1611114.118 2259635.401 66071.67019 1308729.724 1121444.593 1454181.905 692915.0515 1521832.782 1867927.499 1854816.941
3-Hydroxy-5, 8-tetradecadiencarnitine 3384324.87 5440053.075 2115643.817 4412644.846 9658568.932 13558396.77 4258097.087 4139871.648 3835448.508 4008110.614 23933893.7 17786538.87 7520327.698 8213947.645 6835273.396 4364668.092 20579508.71 20243344.75 6288268.308 7960504.462 11670445.65 7663597.606 21272200.47 23902026.57 13612424.73 6492580.283 13088973.92 10855949.1 21442429.58 21332690.43 16109171.49 11965405.7 19798779.12 13629785.44 14812769.21 23584578.28 4230210.694 2663940.634 5988492.601 2962851.542 3902245.738 4965872.954 4831306.828 8642579.374 642894.2148 6496884.704 7778858.675 5703031.622 11719659.21 5528372.548 9839734.246 7165906.24 6430484.686 14572283.35 7187515.144 13731160 9541927.864 9388419.723 22626622 5954953.335 9192935.407 8950280.983 9677029.643 21108621 7094282.676 10367424.27 2179647.919 696507.2612 1363004.84 1251748.379 346488.1194 1660505.852 1805211.217 1716576.642 1535170.781 1896389.928 1577209.845 1980138.469 2193447.485 622950.924 1754565.23 1703115.039 1710730.119 1609757.297 1652830.706 872852.0239 1910533.574 1265390.877 126186.5673 1098201.755 2066476.32 2408753.981 155744.6517 1138793.705 1426515.332 2273782.988
3-Hydroxybutyric acid 279761288.3 352618159 175443917.8 420801128.9 1672012149 1019452508 216231350.8 282038169.3 177815903.4 365863592.7 2407408699 893630752.6 315470198 259605651.6 135971191.6 242574619.9 2399713742 1767518918 251924859.7 255630159.4 169513096.8 449568721.1 1990487127 1352600769 228590805.5 211161765.9 106629622.9 250288384.1 1695625317 730321999 197536212.9 191132803.7 112461457 214306236.9 830383357.7 814581461.8 234958895.7 136690556.3 606011882.2 251011963.2 509920925.3 204567949 260852796.9 569418526.9 30743481.38 449937326.6 243244380.6 191034253.1 775801291 242642865.7 610900776.5 176239639 306705801.8 695163222.8 222321419.6 344023630.1 163418636.9 278891410.7 441895477.5 146557863.7 443562596.8 125704494.8 87638095.98 525203062.2 183660704.8 369235088 285270830.2 198965797.8 133807317.8 106567586.8 162828620.9 337282975.8 191527162.7 91166332.12 233449370.8 111937669.9 292614057.7 152127760.9 153645335.3 59045366.76 112510699.3 321362344.3 295593826.6 200871690.3 173804685.8 81502475.69 264932812.5 127683205.1 8445091.857 55375508.04 153062609.1 249894162.7 30165440.03 78911145.91 86051549.19 193930081.3
3-Hydroxydecanoic acid 9198147.737 17674244.91 6206102.61 11387523.32 12091057.05 16844051.26 14876683.12 41304379.5 16638886.4 16912474.45 19828112.85 23367909.72 27621738.9 52593735.39 22488508.76 17312987.58 22462091.14 29497632.11 25890993.75 71783072.69 26141750.22 40267080.67 22272294.65 30658559.2 27336617.24 56132436.13 19540526.37 30813979.29 24324130.57 28805029.63 27235138.73 73704197.09 23383888.48 33253764.21 21232984.68 42826034.07 18254213.7 6442104.675 23424184.99 6927640.515 12705670.55 20432010.88 15015608.52 30467079.94 2999683.709 17364704.14 24059165.35 18189519.78 32139981.8 13425892.07 25407882.18 20982827.64 15869217.86 31717967.97 13050284.57 29752606.09 27056612.28 18128426.91 35344942.06 12575433.82 26977947.52 24204028 12201078.11 33621539.05 15921490.63 24584529.51 6833839.206 5615986.432 6577281.797 3332347.724 3805473.569 8443895.553 5481417.174 4550601.025 5140557.318 3229422.93 7246145.615 6654629.87 4244382.494 2523996.688 3076296.906 7351096.582 4233133.819 4421427.702 4489915.296 2922644.24 7842271.183 4622736.638 530889.314 2360867.611 2802186.93 7167394.976 1210512.699 3623848.659 4324717.783 3772067.17
3-Hydroxyheptanoic acid 1701900.249 1461188.949 2186322.637 1855053.541 1748577.382 1896187.392 1666303.956 1742604.747 1618440.667 2895725.201 1801937.831 1736284.665 2334230.112 1670627.367 2115688.775 1368745.861 1832322.31 2301296.714 1884326.924 1748401.193 3095909.338 2706254.09 2881468.583 2071571.246 10137748.63 3183590.419 3634287.306 4687768.032 4913886.777 2632535.455 18874271.22 8058659.643 6030136.583 6139438.48 8169606.529 4148996.227 1658745.33 1639920.308 1730040.988 2029846.622 2389152.878 1674155.063 2061798.999 1718148.32 1000297.227 2225171.676 1693510.23 2092621.307 3018664.349 2987039.4 2266831.84 4528996.983 2152385.825 2117967.261 2639014.732 3065005.775 7350579.642 5501147.981 8461894.771 2896369.834 3167098.071 15927466.99 8418976.877 14286975.42 5740549.262 4918296.275 2197463.971 2579786.584 3079584.948 2107412.951 2120536.283 2487732.373 1704204.695 2313242.393 2501593.002 2358393.901 1884554.622 2600304.174 2157444.401 2033401.579 1729632.446 2383933.354 2828014.418 2902984.887 3262184.425 2509478.579 3072913.348 2385829.19 1156305.351 2702275.37 3181477.719 14663750.15 3219326.16 4442870.181 4585047.637 7553378.91
3-Hydroxysebacic acid 1182437.135 1005602.805 485793.9006 2040750.438 4261139.555 3481243.237 1248375.068 857253.5027 485450.8469 2239625.971 8030393.969 4206992.619 1709744.101 912864.1047 597350.5342 1891417.908 7397969.472 4882323.013 1355326.843 1113119.677 542004.6211 3114864.9 6229157.417 4577758.758 1465343.922 905530.5222 643023.2228 1770798.238 4908098.766 3587170.731 1671924.632 953402.8411 610896.1897 1539006.505 3077065.708 3805471.76 3283509.85 1493381.123 2640057.734 1133582.652 1510364.217 2992619.777 2812981.26 2611309.535 306831.302 1503622.033 3742640.405 2873256.951 2744666.32 1427341.456 1741034.515 2635125.698 2242678.722 2233764.375 1404039.78 1441812.645 3092051.063 2389216.488 2584915.647 1001814.32 1457457.651 2923721.597 1352890.448 2368416.272 1872028.233 1145968.687 487229.0333 553880.5867 484528.2839 865757.0658 528507.0006 609735.9869 443269.4959 359726.5177 1108733.661 492363.9947 654160.7453 538300.7697 503130.8377 569536.7457 636885.5947 500756.9676 471608.5011 518279.4259 987663.3358 381925.764 768514.0541 685527.2716 146813.4088 653120.5754 587993.3117 1017846.62 311059.6361 506157.6795 1037854.53 876657.0587
3-Hydroxytetradecanedioic acid 2359318.774 4311500.568 1535396.35 2651026.444 2608205.133 4236535.26 2126514.333 3579146.908 1555702.034 1918963.053 3373287.596 5288059.827 2659623.959 4594967.255 1319145.108 1798811.175 3514285.767 6092490.647 2249457.436 4329106.831 1397083.533 3460855.065 2831529.513 4958336.408 2301208.541 3081479.895 1434893.158 2053067.358 2931391.409 4128511.608 2329242.195 3603689.735 1655959.903 2151763.543 2317041.692 5150633.018 4874879.565 13961694.69 6720322.349 17625988.02 20639663.28 4682773.631 23116204.69 5855775.414 2509991.512 19702002.17 7599730.533 24955408.57 5966343.937 16837331.01 21293059.07 4027763.026 19381467.7 5222305.095 15393177.14 17030934.47 4536061.188 17447352.49 5321453.927 12772857.97 17822250.49 3986870.671 9665180.856 5620013.355 15632635.37 19292705.5 5406178.598 5758435.196 5645453.536 4536347.291 6348386.237 5691130.585 5800627.455 4136594.971 7531712.227 4553570.588 4358789.898 6853533.746 4417971.892 1905388.146 4585383.38 4518458.469 4672046.752 4475024.17 5093670.589 3308016.683 4335081.352 4394730.567 422985.1391 2873257.077 4756722.466 3850521.499 1019205.838 4363368.863 5618819.04 4696955.944
3-Methoxy-4-hydroxyhippuric acid 8979911.455 14931743.29 19557638.42 20971608.92 11165808.45 17507599.17 10640394.98 11751142.72 12336282.55 8593112.239 5776913.367 5158704.876 17394723.05 12824380.67 11983656.01 8460168.455 7766889.605 8334146.61 10004021.27 16361680.54 19986793.24 12963034.05 9070296.505 6681930.253 12595727.04 8758856.845 15534164.56 11443168.48 13176937.31 8300487.072 11372634.21 11001214.38 12518727.64 21557557.6 11676251.56 17689100.48 13072327.65 6642649.483 23549500.29 16133595.04 15319044.43 3333568.528 5959242.228 19886664.09 1653233.999 16412532.75 10442818.67 8867471.65 17312900.59 11174093.59 17554850.12 5694945.412 6111724.162 12060641.37 8767740.116 13731580.73 8021449.137 11423188.2 10645600 8885322.097 9049824.607 6532071.711 7175403.647 10759320.49 20610891.66 16789385.15 22163546.84 14865072.63 26887757.85 10383792.63 24198360.14 21076996.92 12846577.52 17220578.14 19851426.01 18149188.26 11497281.13 23739529.79 11578166.63 3918399.351 16089944.95 10267533.31 11640572.02 18589901.67 9458616.037 6020209.626 13528645.63 10126234.58 647185.5613 10544558.56 9673295.37 24466395.01 2868744.757 10070392.34 13397442.01 20337974.13
3-Methylglutaric acid 5125536.165 2079972.632 1906476.557 5882334.733 6156372.257 944169.8612 4822488.607 5399601.989 5225277.312 4624411.871 4462330.515 4708218.365 4389030.913 2006668.286 4737032.882 5261465.26 4094778.007 1469122.013 4149027.754 2370174.039 1659305.082 4712775.779 2018499.395 11752284.73 2176399.04 2618004.886 4953291.094 9327891.998 4662959.286 26645039.08 11218616.12 10551899.31 24543898.26 35876375.38 22942727.01 118656346.9 2756780.662 5829750.157 5072906.577 3002351.943 4216974.901 5486861.06 1414427.61 415199.3397 4160144.354 1877332.002 3099826.297 1767776.997 4755946.862 1797817.1 2708188.559 3333006.006 1863869.332 5139670.233 3837272.744 2810855.451 3979378.253 2413509.363 2238842.293 3132023.076 3917446.317 5681994.969 6588666.663 6105683.065 6815986.552 10616263.24 4964861.597 4997744.408 5420466.112 4528685.131 5391245.991 5730636.984 4808819.284 5501158.399 1787816.993 4518664.777 7730293.058 5679368.7 5086455.681 3920507.229 4073085.848 29431165.85 32044543.25 31504267.5 14287928.06 24087984.73 32034304.23 52111530.67 2005828.359 11574076.92 26926989.42 71772275.29 10885387.79 63372028.94 35040424.79 56421402.57
3-Methylsulfolene 637069681.2 783038866.7 841204341.1 625006045.8 281781965.4 384326394.8 630601043.7 756816386.7 826216140.3 666374317.8 466614968.7 422026219.6 931520498.4 877440339.5 838892356.3 673057005.5 577601550.8 580646508 831121653.7 1108920045 1070933524 1103651469 626822502.4 668582943.1 244050716.9 872561112.3 1021334222 815681713.9 576779111.6 678944466.9 1012563080 984591696.2 1057196982 995220553.3 619777340.4 998114919.9 661595255.3 1067453690 711406315.5 1260657374 1368567924 719833165.2 1497892457 749060392.3 450014278 1675656748 960150446.5 1919719605 939438414.5 1575555259 1669770354 779460439.7 1410367701 895227004.5 1764552577 1616910011 914967477.8 1538774938 752717259.8 1478268845 1662124013 787665076.2 1218784357 1065619148 1645456594 1926599575 684123637.6 859058088.7 1240125491 580257235.5 974775187.3 962024496.4 1090280678 971098124.2 887493590.7 925647340.6 177692369.5 1147550332 1276136462 417959048.2 947388507.3 944575954 1226461942 1379854032 841724226.8 826848884 239963066.2 1262834904 137954140.2 739470495.1 988432268.4 1073260697 473359589.2 1155476519 1002669012 1292904292
3-oxo-C12-HSL 3705956.37 6233837.339 1506926.974 2827162.943 1570413.02 1243923.638 4825599.584 5539904.196 1405786.76 3162447.18 3097931.24 1681898.486 7893925.338 7355138.168 1571529.206 3092723.34 3276489.223 1784302.85 4829400.653 5671646.991 1911933.341 4764144.864 2630921.776 1909142.828 4868790.945 5448481.893 1524174.819 2380119.18 2556200.769 1540415.136 4840120.971 6203844.295 1685350.545 2758074.115 1494390.473 1555037.3 1032517.735 2355915.318 7573495.431 1761099.648 2466925.002 1185984.494 5132715.284 6407838.9 327030.9673 2279594.248 1203831.327 5706293.811 8408093.563 1865410.424 2712466.494 1229070.07 3925461.941 7259783.698 2092167.853 2136423.36 1087999.184 3843935.463 6307838.213 1832849.137 2322397.413 768973.0503 2070674.564 6508595.297 1530434.441 2867923.582 138799.7424 149537.4019 167252.4789 232145.379 214158.901 247404.4003 255927.5201 65452.32416 211130.6715 91181.44318 370405.131 292879.4092 151433.7243 59626.69537 237415.4236 212303.6792 226670.8597 199498.7244 171090.6301 151795.8481 169683.33 215631.5232 55598.69713 250778.5707 161191.6385 257239.5036 56850.2305 81798.71516 102995.8231 136623.3167
3-oxolauric acid 1046849.569 1707450.161 513296.7654 1890305.235 2017561.803 1798280.495 1899559.847 2186510.915 1032451.181 2245425.667 3831256.665 2587116.16 2305884.728 2659985.032 1365633.957 1931235.53 3903796.906 4692516.086 2650501.439 2638711.937 2014413.075 3651416.488 4273449.176 4036358.194 2653297.816 1930780.192 1384380.159 2224579.436 3594510.635 4547027.109 2610333.829 3152148.952 2068882.858 2300975.807 2319946.003 5198088.068 1393598.455 1355193.43 1173903.958 1058944.302 2277492.726 1821205.251 3153889.097 1184998.768 255206.5259 1508525.666 1758365.309 3079558.11 1499735.168 1272459.774 2174111.259 1850198.433 2602236.76 1764704.11 1457607.529 2497488.225 1634527.896 3471609.822 2144839.083 1403616.519 1820081.183 1804455.388 1426883.479 2282514.35 1227760.779 2490239.221 2926971.84 2180928.728 1696856.04 2563186.748 1503322.04 2785827.756 2049190.82 1218824.356 2596807.094 1119496.692 2198905.044 2525899.246 1398757.401 1079793.993 1476771.123 3003257.094 2244813.088 1445723.384 2708750.644 808734.1689 2805552.806 1971696.626 60030.85129 1578005.695 1266917.732 2450529.245 487438.685 1481729.774 2505091.753 1736700.778
3-oxopalmitic acid 4449626.093 6464041.26 1323141.979 2947400.453 6709663.557 9613126.479 4103435.046 6685899.251 2651701.234 5137001.33 13357781.52 11713271.76 6075417.41 10854796.45 3097641.13 6689589.276 13476738.26 17726686.24 5530257.246 10309407.61 2650607.528 9086283.86 12836376.67 16253585.88 6671777.282 9886919.761 3827568.233 6090640.836 11303586.03 14367270.88 6654566.791 11806779.75 5326847.49 6188204.267 9875436.496 16898270.78 5360393.522 1682528.403 8772942.227 1699215.715 3571047.19 6440614.129 4853472.931 8273307.502 545722.5301 3131767.324 7210895.2 6236589.016 10225034.35 2367483.123 7767286.147 6936424.899 5024704.886 9814191.531 7114167.688 4230643.135 6900214.233 6049569.035 9672409.544 7578067.438 5415648.362 6459662.922 2632490.898 10466225.52 3042543.997 7363341.402 1091836.95 1847282.163 1960603.194 657850.4252 1723142.343 1847751.701 2133398.464 805932.3383 2545831.402 1586062.413 2966618.933 1599348.403 2451430.234 5696752.069 1925045.084 2301549.537 1629762.113 2456162.567 2412081.573 1019612.414 2595215.315 2674372.127 644427.1966 1417363.875 2299309.143 1820577.208 606869.2339 2687223.277 1549297.567 2488318.736
3-Oxotetradecanoic acid 25364094.78 39540891.58 7893578.076 27194682.2 82365228.37 111373908.5 33777357.33 48133250.04 11260140.84 38002995.08 166669109.4 142278884.9 44921872.76 59684865.52 14658178.87 31625640.82 146203342.1 166119872.2 44006462.06 51141247.16 14712693.89 43907315.35 151327014.3 183211356.9 33851738.34 51602648.53 12499115.62 31583389.11 131857899.5 128572728.9 33898103.22 51460923.26 14565122.26 28003358.54 79054276.81 138024963.6 24817952.3 45058289.95 125871311.3 16730339.67 39327585.03 32336907.57 95947708.36 112354004.5 3839500.681 37623993.41 37519119.09 90806819.32 133839382.7 22482777.95 43104792.68 27494418.94 70885274.99 96366323.82 19347462.21 39299602.29 31521732.95 77159150.53 102071617.1 19025220.01 45512956.61 26190186.89 40037769.99 100143936 19157179.43 39855216.13 13628033.52 7374798.129 8028634.43 5713838.868 4530673.196 12330146.67 9948666.17 5454005.472 7393556.801 3973651.198 11849113.9 10421094.6 6084348.066 3605809.937 4361127.19 12058754.05 8710202.495 6436378.171 6845039.043 3278159.751 12106758.5 7210089.154 431498.195 3976177.977 4269236.628 12463180.46 2351811.015 4689892.14 7219390.019 4618044.45
3-Phenyllactic acid 7176659.971 7283616.83 11240610.73 17675929.99 4927072.594 11549673.89 8291288.159 8275000.001 11800242.05 17624561.61 7882094.573 13309739.15 14572657.89 9153218.078 14829745.5 16990098.34 9097561.275 15481844.9 15902698.35 11226187.01 20530121.15 30948928.95 11311456.45 18307868.96 16591812.54 15081614.95 18446085.9 21255776.06 13355275.99 19260608.08 15804394.48 25419431.19 18243444.4 23725229.09 13357710.48 28043648.8 15951142.32 6987708.64 6112919.935 13787782.87 8046730.181 14058518.33 16261125.26 7579622.044 2688932.73 9525941.053 21140904.13 18529326.95 7837026.725 19669122.31 11415580.48 16187586.72 14942023.22 9718949.459 21781474.85 15020742.37 25662421.59 15369923.99 8631833.295 22929694.1 23339885.88 27853349.58 15157280.08 12195986.4 27727215.48 41764162.54 5811210 4794427.331 5506095.286 6032501.567 8490654.444 7334346.52 5820861.458 4105045.617 10960791.57 9133093.878 5637492.713 7537023.51 4816670.432 6235950.23 9916970.722 5548704.798 7509052.576 5410370.104 14897015.45 7672924.99 9569631.217 5957832.563 337318.3284 8499639.669 13625224.77 13969066.03 1675591.652 9436158.03 16314848.82 19376458.8
3-Phosphoglyceric acid 169044665.8 471619402.7 343883467.2 465557480.1 419833181.9 365842497 277507900.5 500768590.5 589592519 352973525.2 250791224.6 234434555.1 617754506.3 618974317.5 540660842.4 470705202.6 471555033.2 476224556.5 438731202.2 448897687.6 412935415.1 629290161.1 433345341.5 373763327.5 230480555.3 579479878.7 190576357.1 98800054.79 239726305.2 125400508.5 251915164.3 327324104.1 327034799.5 149246093.5 106200199.8 175046059.1 31011304.68 53824619.29 53869030.92 131925408.3 339549808.5 180508269.4 492382036.4 409862396.7 83441199.45 433177054.2 485687115.2 641613906 568485867.6 470567311.8 594698894.9 328755612.6 428850338.2 307997696.9 430062302 342799626.2 1021434045 358139628 149261022.4 484654269.8 531278134.9 173302293.4 130288316.2 237069237 139828401.3 276394028.9 1496168418 1401291472 803875903.8 1019821122 1275863380 988572912 990470097 841292117.9 1315621431 984952044.2 135489398.8 249192527.6 1014532703 54476016.73 118505709.3 651667071.8 544998413.3 736638117.6 588695492.2 556202096.2 698953684.4 968652486 12457124.73 690746486.3 896664810.8 1714962707 334535520.2 583100131.3 1169766023 1512500149
3-tert-Butyladipic acid 28530594.43 36193852.91 31111134.68 40108316.59 26758108.26 56603493.21 29620330.28 32390589.09 26735561.63 49720372.07 36676674.5 50333520.5 37290597.31 35673201.24 22307559.81 35371314.13 38674972.21 69265650.67 35532650.04 36444740.04 30547850.03 62202909.18 33635583.07 63803293.28 40059464.55 31712497.96 27128233.24 34013682.63 30587512.92 52801548.74 35397318.54 33660911.28 32806363.93 36504432.58 27455409.61 53118131.58 27065732.68 19626165.2 26551247.39 26763359.1 32149194.5 24496770.27 33537282.67 25887622.39 7408812.604 28093293.32 28751304.31 34635140.3 27853517.61 28345812.89 26453733.6 29671910.45 34801213.11 25682245.7 31059956.87 32398254.81 24482674.69 28744038.27 26711984.89 27869757.62 30721153.98 27649607.97 28693839.07 28850065.76 27014204.26 28096137.1 18570035.71 21410503.61 18202831.7 22752868.64 20522741.65 16819462.89 19192101.37 17284504.31 30017122.21 17479552.9 20951520.93 4544815.029 23217144.87 36943976.35 23608858.72 20538261.69 20818204.86 21189422.27 34369563 20764161.98 22675576.55 22082728.45 11950958.14 19053217.29 21999031.52 19872226.43 12233847.61 18907300.9 28862033.82 23326219.11
4-(1,2-Dihydroxy-2-propanyl)-1-methyl-1,2-cyclohexanediol 325318.0982 1099839.991 460004.9778 457203.966 417931.607 582118.0714 387876.8426 1134848.814 496611.4422 523268.4977 866398.939 619325.5052 461461.5095 2346615.385 557206.4574 923789.4245 880904.0108 521187.0738 914656.0167 4586233.434 1021226.63 1821088.382 1168877.156 983369.5969 605152.3658 3409105.09 457163.9734 1290635.253 1070899.428 1177802.63 807159.122 3409964.181 773982.9274 1354149.807 1078342.194 1549212.35 527613.8244 809240.7515 714307.6586 664710.8003 905371.8793 616837.1309 1056262.162 546935.1577 195725.7879 1416758.438 614863.8717 1332585.172 911136.6668 788787.7339 1351509.84 878037.8116 1227176.747 1303872.004 935062.4854 1883804.872 936011.5506 1366236.617 1088622.995 844540.609 1772413.246 1319917.334 945760.1301 1025019.552 1091243.557 1556350.077 1161758.531 1119168.285 1593977.224 2547920.74 1299865.779 640182.353 887313.048 1176372.806 3891624.965 1144627.029 920396.061 1076844.12 1260211.356 742928.6269 1181936.176 1049816.947 904378.2432 1208820.373 2654025.936 1027502.422 904402.5646 997469.776 55840.77929 1800767.941 1123330.178 1065741.193 318874.9667 1094574.058 2520307.329 828020.1935
4-(5,6-Dihydroxy-6-methyl-1-hepten-2-yl)-1-methyl-1,2-cyclohexanediol 2629657.413 2798963.769 1510329.881 2899283.192 2381803.587 3889280.978 2462203.967 2466154.14 1692520.159 2921496.436 3967361.994 4505510.789 2500162.554 2588789.664 1509038.553 2487385.682 3509458.428 6083916.272 2269311.166 2002784.282 1643801.088 4207366.875 4729142.293 4643970.985 2505989.156 2440018.452 1533651.843 2573620.448 2916264.506 3931127.735 2083496.038 2248674.11 1829579.711 2695053.364 2371789.8 4176044.973 3255468.096 1181872.236 3283097.218 1665284.982 2197843.221 4010606.344 2555747.72 2447950.348 817672.7137 2323009.71 4324064.323 2402184.017 3312102.433 2466217.118 2688316.426 3012421.337 1936158.599 2750096.04 2326684.891 2203244.377 3366709.874 1818481.866 2903005.18 1997007.186 2372143.078 2661843.098 1393884.818 2487998.238 1833364.766 2420744.282 1514682.079 1864547.364 1577849.543 1148215.013 1392122.66 1773901.598 1748848.849 1688351.665 1639806.58 1274973.531 1426717.51 1638105.632 1698358.481 2010196.684 1382601.981 1365459.64 1791588.471 1514892.948 1413934.99 1241005.149 1290852.174 1505848.673 578606.9021 1218043.315 1955796.539 1495125.387 763469.254 1535462.56 1777195.763 1698243.546
4-(9H-beta-Carbolin-1-yl)-1,2,4-butanetriol 3158951.137 7149342.081 6395936.268 6119892.162 5111733.053 6625228.445 2320751.231 6092667.49 6207354.753 2388651.269 1362312.17 1679030.823 4460706.211 7020013.439 7212603.901 2458952.062 2175552.273 4213834.163 5311068.12 9439453.568 10770903.04 6672408.261 3015083.472 4851938.889 7117184.02 5952863.545 5229438.001 6549749.654 7598608.73 7195862.862 7596091.752 9954844.162 11208548.23 9996263.364 11688918.67 13873369.04 6854823.997 5186768.675 5644497.918 4327362.923 8546523.707 694618.8637 1873801.711 7122581.441 890984.42 9476040.5 3962481.123 4684362.099 8646341.452 6129695.041 10709746.94 4653009.39 4037236.391 8873757.734 11333355.33 12829150.97 6722182.642 6975100.847 8331683.325 5965471.931 11976918.84 7874697.086 6444309.36 9671195.352 10028956.34 11279642.05 6674939.05 6615599.62 8249991.178 4231309.088 6979346.205 8235707.149 8447623.97 7921059.083 7525304.991 6633882.331 8341917.136 10166680.26 7724672.649 3023310.836 6178176.958 7849670.552 8017961.395 8080157.088 6151725.248 4465788.549 7311827.646 8354461.218 306153.1723 4276874.092 6004213.394 7421820.967 1457982.786 6665518.318 6754334.781 7076026.607
4-(Hydroxymethyl)benzenesulfonic acid 14785175.44 22080196.25 25232726.09 87498036.58 104760324.6 74478108.05 17702570.68 17958147.08 22211060.67 118861372.4 191586248.4 116744818 23891912.49 23846254.64 23545045.43 83370828.48 211479633.4 150324372.1 19909186.9 23033720.86 26482014.76 125015395.6 156441440.6 108677198 17477704.97 21273877.04 24118788.53 96091906.36 167075406.8 113160607.7 20307179.56 20346515.84 25537359.86 79675393.86 86905694.76 131795634.1 49394575.2 16462060.22 32699732.05 19066562.38 61392319.62 54764649.66 41541498.03 23235622.7 4183511.708 52334651.7 77109731.65 34643300.02 36369996.96 31174031.35 70680421.56 49225751.34 31432338.1 27814131.94 22938468.63 58897357.7 65615755.4 31109630 31059308.49 20168983.85 56468884.88 50561308.9 15904425.92 30832858.55 18109841.5 60292402.98 15773240.78 29537990.73 32901027.23 24310110.5 34392484.72 17018628.32 28057891.88 23692091.02 23009814.53 28327613.85 16017661.32 33773375.94 26421045.48 11253937.34 29009804.01 16692363.33 34938181.45 29857509.94 20634549.1 19189024.99 19419345.08 27001075.09 736756.705 18178239.26 27479636.93 19947859.94 7679262.018 25994071.63 22702012.03 28028695.78
4,15-Diacetoxy-3-hydroxy-12,13-epoxytrichothec-9-en-8-yl 3-hydroxy-3-methylbutanoate 165577.4841 2072070.408 73334.97181 2738830.502 890164.6916 873240.4448 374607.855 1893405.01 87357.34434 3615705.856 2027191.649 1484908.435 307457.1127 2320158.745 196509.0583 2543439.738 1812311.14 1731938.669 191733.2588 2419700.235 226428.5643 4469860.669 1856382.569 1749218.54 97697.9933 1741187.32 126881.3863 1974826.559 1460162.45 1133826.446 228149.8201 1495011.765 214381.2688 1452371.018 644406.6107 885061.1554 2842912.051 521830.7295 5341915.675 2474755.873 978542.4311 4824361.77 1427027.052 6269153.739 600403.936 1025414.67 5024417.51 1273639.298 5900010.137 4416463.042 1037078.291 2993264.187 1117216.331 5102961.848 4009360.173 946827.5056 3278226.015 1279515.167 5331183.249 3162180.458 1082146.803 1776487.41 434852.9344 4757239.791 2308192.819 968888.1098 167601.2792 219123.4645 235462.7023 237869.4608 356959.464 257205.4355 192062.6338 213815.4833 231819.8565 180326.1018 248985.8869 186012.77 182493.1594 164385.1173 109054.2495 65881.06862 220309.7825 197534.7641 137096.0253 72924.66771 161891.7551 89462.77247 45387.96866 68579.12193 163644.6185 196030.8488 47959.33841 199056.4923 195146.1181 83267.95676
4-[(2-Cyclohex-1-enylethyl)amino]-4-oxobut-2-enoic acid 8643295.326 7643591.258 7402715.77 12045875.25 20500009.17 26608428.53 9647440.176 6857102.257 6995194.695 12197879.57 29084283.79 26354725.55 12152053.03 7667572.408 7478022.745 9915706.126 28570846.49 30066205.6 10378189.83 7130552.724 8398971.906 16423259.13 25278123.03 27812473.35 10176778.73 6222357.381 6651043.621 11358291.98 23267013.97 24338238.43 8465217.815 7632753.728 7301527.706 11481715.15 16711541.96 33569993.84 5293928.526 7875490.745 7290779.463 4672621.153 5418770.672 4832507.278 13720276.21 7232737.499 938277.9262 4973262.505 5918812.38 13691212.28 6970438.304 4989927.525 5483821.679 4193172.8 11051933.45 6508931.116 4733840.289 5485637.666 4576564.158 12112182.31 5668660.118 4084793.414 4573399.314 4035198.996 6815176.407 5729641.849 4860029.003 5129386.81 3121878.148 3063286.583 4435268.085 4579462.155 3349834.439 2896841.081 3276253.009 3502630.085 5876314.875 3233863.531 2265755.779 3541374.949 3747639.573 2223333.278 2680598.204 2597372.035 3566238.479 3075452.292 5096225.355 1754492.621 2428244.414 2702055.341 177867.9726 2841299.74 2694575.087 2722044.308 532282.5722 2120354.612 4381156.396 3097222.101
4-[(2-Isopropyl-5-methylcyclohexyl)oxy]-4-oxobutanoic acid 1848504.571 7165866.261 657735.5467 2053840.801 1511889.551 736399.7493 2147719.681 4385397.028 466141.2239 3669592.084 2524649.985 1411341.737 3298206.166 6070030.477 631892.1604 1021622.811 2974358.004 2097690.31 3073505.15 6915931.897 830465.6569 4251845.89 1843603.619 1692489.674 1883445.265 6205459.44 433844.0469 1082245.879 2238141.665 1678424.961 1993787.354 4107942.334 876851.9273 2572605.873 1068791.951 1434472.008 4037957.225 3924124.156 4633743.904 5355846.841 7178524.464 4076632.803 7208918.231 5595706.439 703725.5475 5608965.646 4490760.725 6831901.383 4296290.795 6206934.931 8252729.496 2863134.371 4817130.619 4641017.647 7646443.977 4699709.533 2061630.001 5227898.929 2397333.533 4262459.114 5963363.951 3369224.335 2756902.355 4495505.106 6325129.346 5746727.038 1794900.299 1461750.1 1156944.97 1002836.713 2437263.936 1566583.67 1248871.231 790189.928 1271059.257 1198760.484 1449385.219 2662405.345 1062954.33 475777.9374 1209808.229 1221846.462 1498609.378 1328721.032 944811.6379 690890.3234 1952755.758 2065640.871 115897.1168 454615.5452 1828815.478 1108501.935 320432.6178 580542.8693 1112128.886 1149759.636
4-[(3S)-7-Hydroxy-3,4-dihydro-2H-chromen-3-yl]phenyl beta-D-glucopyranosiduronic acid 10651510.52 27380571.34 19629399.06 19573272.08 6228684.812 10241020.88 18012732.97 27106668.85 19482526.78 33003448.39 17067760.24 16369553.29 21667149.52 31684524.79 20506254.02 22661869.11 15602399.13 17978896.51 17168778.66 28508643.58 19187455.03 36957845.63 14274725.5 16623339.27 13022206.94 25232094.29 17027773.71 18591025.57 10293381.74 12608352.61 12068737.14 20477996.47 16570640.56 15130133.37 5215643.36 9806995.698 59919661.14 34226267.93 49627406.5 90217920.98 82333372.45 102766507.9 113563753.7 48014967.68 23928717.67 67459025.68 98272791.62 98426368.88 51703150.23 144060195.3 81234375.71 70829359.76 81525365.79 43753675.65 133614417.8 70419341.78 71695435.61 68413681.43 40686691.91 110177788.3 72348993.5 39606373.23 26301611.48 41340889.25 66047277.61 66957213.69 17937304.46 22035428.95 12635924.81 36396219.26 34776760.21 19608164.44 21711327.1 11970610.97 41831288.62 29729773.76 17222083.32 26380211.88 11477121.19 17907209.22 32605578.98 16316889.68 21966812.68 11632963.04 36531344.97 19660013.09 16089115.89 18501483.15 499625.8286 22522498.91 30910865.8 16891938.28 4142057.189 9282649.995 35879370.87 33139503
4-[(Z)-2-Aminovinyl]phenol 46811281 92322702.7 114423513.3 87244178.87 73441155.26 115476575.6 46802166.97 92360205.44 116615825.2 78398489.49 99561316.69 103717497.9 83015914.18 98659922.01 138275104.6 87716238.15 79434905.08 136886224.9 53028211.75 114579802.3 159108133.9 95066731.09 115183770.3 158511588.7 86635912.67 95498355.36 145878744.4 108546168.8 117397332.4 147528907.4 70334737.3 82380965.04 121309191.7 128829555.2 82460695.84 148679636.1 76882340 105600021.3 105133729.7 103724041.4 182170173.1 92192428.76 130889976.6 94292668.45 36116127.87 177381275 136546898.7 91848286.98 117858932.5 128741506.5 211604835.9 109240914.8 132409362.1 107406289.5 133182999.7 179790345.6 135836071 131085275.8 110234331.6 116451052 196575977 81419383.88 91608953.75 126326471.8 98379178.84 197739034.6 78910264.71 100155174.5 124719334.7 44466880.98 61199544.63 102557640 74869578.68 74560890.99 76300392.73 87283435.93 100709116.5 100010980.4 87566706.52 52892700.94 95481120.05 71986299.38 140122027.5 98714071.05 81148577.05 85644105.18 78026677.64 103818066.4 11260449.69 78968682.71 68433169.47 92535859.11 51616186.77 91307968.79 73463030.74 84932068.74
4-Acetamidobenzoic acid 51244353.5 62936860.63 66123789.12 53025808.43 60752860.73 61981939.84 41622942.4 64472993.39 67138639.77 32205095.73 27345510.98 26912422.37 58567700.08 58980623.62 47091918.69 41114241.38 33235218.76 41938920.45 44897591.47 55001779.43 65801781.24 50932648.31 31984329.32 35590354.12 55340162.56 38944478.63 61347060.48 64665186.55 42916879.72 42654034.87 48506540.99 40656141.94 64149197.63 75715999.35 62220441.56 90828594.59 73661986.34 43306994.08 93206755.43 54144203.93 78710520.6 13072964.88 34256946.23 91389049.09 8880913.225 60976726.34 42300716.54 31368708.59 71639981.98 59211187.55 42474407.85 34102930.62 39372771.58 59927635.98 57791810.16 42265509.47 46675212.91 41899743.11 49511253.62 48925993 54849557.91 57375760.52 41351337.48 59480727.58 74447850.79 64892007.82 50926400.34 78585112.07 86196707.7 49820788.86 81800309.01 88070796.14 83084083.21 73991403.73 73570669.28 77839572.83 69472977.24 57504776.3 80578246.56 30525471 64574078.11 50888671.64 73457724.69 67245226.27 45126367.97 46877249.63 81090948.93 59548214.35 4195722.629 46269277.61 62067923.08 75451091.08 14044822.35 55680770.13 44061847.78 71354012.58
4-Aminobenzoic acid 36628479.92 34741204.89 40837670.82 33520354.79 16455386.54 21146199.93 78186466.69 33129607.95 43995903.94 39044139.24 21813154.73 22126393.19 48786581.28 30532017.07 33060647.23 27758279.96 13458047.56 20320652.65 29781218.24 26795083.89 30144212.08 29704363.83 12435664.96 20630189.71 26340581.36 27547228.74 25200481.54 18032446.51 9851162.3 19984495.28 19600508.62 19728292.21 34962507.07 20262306.34 10161185.17 18443027.79 41559373.47 48015390.77 30836355.84 50401969.65 50759724.16 40016541.81 62521561.22 28221430.77 72248940.56 39630545.38 43580849.4 71221571.12 23858409.37 47657790.03 40463657.23 37437385.04 45938657.15 24093549.03 42862820.67 38814761.17 33810155.98 37541559.93 25028217.52 33730146.31 37120864.8 22155866.85 28757463.72 19192307.58 26504571.94 35539677 21945318.98 25543704.48 27718028.64 36854378.32 27543035.89 21437658.41 20878678.27 47779131.62 25970483.65 19008277.77 14674276.97 17736626.21 20221618.31 25320934.29 17706436.81 14624124.15 15895684.98 25487254.41 29513462.3 15153565.29 14719201.78 16425715.3 22197573.37 26619350.12 20782225.03 13935364.76 20350969 15985900.56 20600914.39 15632201.84
4-Ethyl-2-hydroxy-6-methoxyphenyl hydrogen sulfate 433640.7775 1591742.997 1082625.846 1064956.638 349538.3503 1102635.488 473398.1948 2253271.231 2491773.915 1178944.541 440486.4062 707397.9358 1687902.225 3572509.992 2702810.916 1702736.494 352297.7332 834691.584 1691871.788 3416520.817 4354912.492 3084439.592 1409461.352 1964908.024 2998683.782 3380260.08 6419965.175 3355609.054 5181827.992 4335929.723 4201235.518 3537723.145 9851863.349 8628113.615 26277182.43 6341194.474 782782.8749 385789.3409 425103.0494 381384.268 504126.96 384789.2086 468445.5455 1911474.861 350114.4851 2660769.691 1387970.169 336648.0788 2926965.582 1869881.721 3051696.998 2155608.006 1566617.678 1872783.57 1346665.488 3520003.161 3913155.905 2563415.942 3315505.195 2389294.031 3719260.319 4342658.024 4700638.403 19449672.16 4957392.887 6856034.878 883376.6345 541853.6811 333669.2657 320749.2223 345657.036 1121037.601 1079056.406 801377.4675 1973284.865 1693229.477 1336105.65 1678657.388 1048692.351 1705075.544 2173713.406 5303036.383 3704618.285 2753778.834 3391541.012 3215525.924 8465688.694 10982831.46 67758.90983 2628207.372 6933942.661 15005788.94 1434811.095 8887482.979 6543082.148 11041384.81
4-ethylphenylsulfonic acid 11940372.5 11438292.67 8855049.074 14454286.56 4423614.302 7590208.729 9405989.399 10667230.01 6900585.883 11859972.9 4463436.306 6437755.431 14251399 11856672.65 7487922.025 14568113.7 9595490.793 10531247.87 19785810.72 10640246.09 11899989.65 20366735.31 12636855.27 10083462.63 9724640.587 9409664.939 7681559.25 16020088.68 7005590.535 10036167.76 5344640.903 9845463.139 7705161.027 12982943.4 3044815.444 6606176.366 4477077.155 14370327.27 3800902.847 4688658.457 21534107.79 6435505.502 27009201.68 3967594.032 265681.4525 8313758.36 3500530.188 16084307.08 3315840.415 8015790.149 11930478.31 9818972.919 22083638.63 3138512.248 4890812.387 10433943.66 5623045.288 29573488.43 3694166.13 8074792.241 15329248.15 1561965.942 5600154.524 2108176.97 1897539.369 11004500.65 9278865.867 6858968.174 4948079.354 3404883.733 3489982.995 4637959.596 5754286.968 2958761.887 7924235.612 2339318.662 4734407.207 7380949.996 4900315.166 2910269.958 4293563.576 4769963.394 5748319.374 5110276.114 4540329.784 2580551.468 7644253.383 6710506.922 83125.27065 3401257.021 3859537.643 3227328.751 511647.1565 2352752.58 3968676.196 3023959.394
4-Hydroxyprolyltyrosine 17564128.1 39530625.92 67278721.23 24982225.51 19245057.14 24316902.81 22507875.78 35675437.63 66475640.63 30882732.13 35216312.21 32846517.44 30066496.55 45448034.71 64751672.43 25590873.41 33047970.52 37685903.76 24661862.02 42191828.02 71642320.83 44849331.26 33248722.74 34996297.54 20427139.43 33397313.11 58126394.61 25123987.25 24909800.98 28122158.56 18347188.86 30370444.26 48852267.87 20779027.07 13040282.83 24373237.97 40946699.66 16266669.18 12122893.53 33937428.77 35857392.66 51260488.31 36060399.14 11673794.86 6444339.487 34104115.4 59780974.8 37279995.55 13541115.21 47478823.73 40192639.39 41302219.64 28540773.66 12337454.59 44836027.49 34437051.5 44463610.99 26943621.41 12215371.15 33202616.78 31775708.17 28165304.78 12561516.23 9693246.049 28629945.89 31143318.82 26614693.24 29666017.69 46414681.15 19993877 36045875.91 27152402.86 29923703.52 31309971.72 24532955.14 26876533.43 20302547.81 32719976.63 31530846.26 8867884.39 25563525.19 17681824.9 24628809.09 28989847.1 19984147.32 15586542.12 18059656.46 20531075.63 1024597.719 12062715.53 20703294.33 17098062.67 3372255.867 19868177.92 17268346.95 21565446.15
4-Indolecarbaldehyde 30056158.08 114349935.3 91464979.04 58857622.57 41300686.28 49923925.64 28671562.68 100111739.5 76789935.21 45162733.85 44229509.02 43285744.89 31529874.42 106189787.1 77822590.44 32999713.62 41997455.92 54679831.69 23017089.52 102913315.7 82634656.16 50579173.22 35838986.58 44528275.98 23497524.25 73766105.49 60760181.29 38610092.24 30453110.27 41858256.39 22182255.55 83085159.29 57425917.56 40459027.01 23187378.7 38360998.04 146660541.7 68721844.28 102006418.3 125185012.4 189088083.1 125120665.9 101510242 90233094.72 26119901.67 150471318.8 150060074.9 102298227.4 96123919.98 130472513.1 165484266.6 107096401 80749056.45 76708658.23 117031084.1 143743470.2 121731461.8 75869992.99 71104538.45 99661257.42 136987663.6 105580061.5 48412256.7 72000207.71 98397215.14 127312290.2 63666272.03 61513454.46 75028456.67 93051560.59 85112604.93 66550974.11 56803173.85 62666941.08 107024173.8 60874969.67 59788080 65011331.98 62791460.49 43151480.79 58562063.58 50001668.97 46086799.22 68769935.34 86420095.35 43513761.97 44033270.9 32418759.39 3596919.505 52126250.58 52834796.26 42701346.75 7773110.7 49177045.74 68477016.12 47135168.5
4-Methoxyaniline 4555641.545 6124660.858 6899712.643 9100089.505 5183958.81 4355034.15 2977301.81 5596450.621 5324217.693 1970397.553 1094928.915 1314576.706 5769478.566 6425984.448 6567185.357 3223504.203 2226236.51 2856564.99 4214329.648 5517597.212 6597992.001 4699201.95 2395261.45 4141270.684 4331431.278 3850814.194 5197662.964 3859958.556 2480408.99 3509623.769 3679693.008 4555704.097 5340100.028 5415739.851 4675313.957 5126370.189 6200584.83 4259346.339 8634020.782 5893431.648 6256254.896 848539.7248 1533281.965 6146250.14 567354.4414 7406902.274 3586438.088 2902701.677 9183411.874 4844926.389 5796058.708 3725156.638 3015318.052 4515106.96 4201732.424 5079853.251 2632481.13 4058218.679 4570427.07 2784930.457 6896149.409 4574093.34 2327998.963 3976172.672 5559835.359 5842209.344 6653125.759 5548723.408 10389439.15 4207956.749 7648436.686 5266367.285 4982898.553 6404478.505 5081836.723 5384007.135 3392387.055 4200121.095 3209024.925 1290695.712 4259496.207 4903756.445 4113466.03 5291703.513 3818045.6 2242974.566 4585541.749 3472734.972 578341.9021 2457592.476 4679614.115 4222651.456 639190.2926 3571761.879 4343731.404 4171502.372
4-Methylene-2-oxoglutarate 1682665.435 17937825.58 8944933.956 5374855.972 2147778.294 1898248.801 200057.7121 16955022.96 7228484.536 3061926.135 25924891.23 884549.362 7215715.917 13489003.22 1337587.4 3860741.2 21042845.73 1541207.44 3622123.466 7890750.258 808989.3063 7803938.549 10392566.03 8073457.121 27418602.1 8395217.907 22988100.14 25670747.96 38650413.64 32856220.09 22429207.54 17996155.7 27214484.13 36178958.77 50573888.71 56111876.41 13931825.04 4601000.909 11296053.45 9597975.748 10610487.25 2604869.609 232579.7626 3621580.463 3242682.257 4722755.186 230330.3147 272485.3585 1055518.691 228922.9314 347361.67 232342.8744 236076.9751 235262.051 253542.8743 357382.1927 289285.5077 9374494.545 13553322.53 623788.7661 438057.6754 6228562.455 7905592.676 10221566.51 3253356.707 1118775.918 8941095.541 8492648.01 13143457.72 370211.9067 1122560.809 80410576.03 90629440.57 89093023.29 60074319.2 79919439.54 100505119.7 128228099.5 110827775.2 78016007.42 98349612.9 92118965.51 101776412.4 94919163.52 89100685.03 52957732.72 72516003.18 73939477.68 16457006.13 66843676.45 39132497.89 41474258.78 30504799.27 60350281.93 47831258.23 6289885.825
4-Nitroaniline 3363676.133 3998320.215 4900068.434 3510067.093 2714747.642 2548286.652 3622435.471 2680876.116 3696473.075 2826697.632 3476077.285 1348341.623 5345715.604 3733561.476 4259513.881 2223392.376 3339902.216 2657561.721 3138535.432 4092997.39 4418177.191 3380256.014 3247741.906 3005431.149 4718501.006 3897911.975 3658816.563 3650128.448 3216726.41 1836575.752 5888442.521 4137193.87 4613119.569 3935408.125 3106077.971 3308980.486 3559208.513 4073453.776 3590310.951 4182216.581 5896727.942 3432257.277 7356274.014 3600518.416 187693.1064 5813344.338 3493295.442 5758663.239 4159641.814 4760850.824 4432380.481 1640256.724 4891834.932 2738624.624 3292867.358 2132199.66 3093084.428 4716781.05 2882989.201 3095393.797 4614497.602 2668063.59 4735119.607 3949224.573 5713714.142 5641454.463 4788585.597 8884063.036 8249167.482 5399653.221 9134359.543 6946294.36 9115573.598 7940539.323 9323824.198 10276365.78 6943874.021 12023428.75 6716608.985 6003288.441 10189412.63 8515255.736 10813516.62 9912157.777 9660355.29 7996282.705 6177140.449 10885661.58 659281.1822 4935308.386 11642311.57 7602334.947 4267576.063 6521535.965 7900494.794 13874035.81
4-Oxo-4-(3-pyridinebutanal) 8477907.185 9077244.736 8049834.352 8420489.464 8226440.286 8292385.037 6891818.718 7795876.899 8273236.27 4782324.476 4510264.84 3847412.407 8022432.866 8821901.28 10794427.01 3946633.534 5240538.97 8063639.714 8825135.323 10821814.16 11287023.94 10699951.38 7708593.058 6782844.684 11030144.01 11558079.32 15653334.03 11399172.51 12565488.15 9501653.331 12400134.1 9424567.214 10786614.81 8298895.667 9377043.467 13892436.27 9814566.788 4959228.359 10870536.96 11683402.49 8058037.629 3030425.07 4776514.166 7410652.948 1756505.365 11297578.41 7390992.541 6656858.206 9717110.88 9398229.103 11190505.41 5979288.278 7389823.926 9387437.825 8116901.973 13734893.07 8852276.795 8295176.333 11338452.84 10885340.03 10497699.71 9904880.015 5552922.893 8885365.35 8586078.742 10706213.77 7609202.469 9913198.588 8005466.287 4590927.105 7602909.893 9724961.541 10648712.45 12107100.31 8660880.008 12689445.25 12482513.76 13852869.39 14082548.6 5084820.516 9179381.357 11099763.74 12001129.47 13248308.41 9591332.895 9016120.628 9505137.881 9940885.878 382150.356 4666412.863 7449782.367 8595601.833 1791256.267 7324294.045 5992852.229 8233219.373
4-oxo-4-[(pyridin-4-ylmethyl)amino]but-2-enoic acid 38475793.3 19824004 17581141.37 48937714.15 56101274.75 45998440.8 45748587.16 27578844.06 28207945.01 38704965.21 13574548.1 47418790.38 24456574.63 31273294.18 22608565.42 13503102.4 10427873.09 28960607.9 20404299.07 28705883.49 22281044.98 41977065.21 30526749.38 33329873.07 26310285.77 30126425.06 25053091.67 43589479.06 32960230.04 49664569.74 15658372.47 16510444.87 12307715.66 27146569.44 29613508.04 54446089.48 18725490.28 8540184.35 23150237.14 26357018.75 29245879.97 15571135.06 25400620.99 17702258.37 8453027.071 48760401.76 13533207.47 17844112.32 12403500.92 29799158.01 40792261.84 24256883.19 18899749 15810138.93 16365115.74 38392799.79 19494688.83 14998098.83 20115607.32 22387066.86 33987515.13 15655403.63 8486980.477 12602865.11 20488904.48 30356517.08 74590102.3 72823646.19 74446413.21 89966037.15 84682643.67 78413764.29 84591356.67 111383418 135972615.6 92149931.2 97735318.76 92833892.01 103981021.7 65529862.72 89586657.49 60708107.22 56792864.31 74008709.89 98042213.55 41174753.19 55979894.17 40472482.9 2424008.273 45771506.14 58083638.67 38966527.23 5459871.669 53988306.65 55931928.38 27794181.22
4-Oxoproline 86572855.9 141168541.8 153992707.9 111986986 87930296.94 110717286.6 216057405.7 301103695.8 342142754.1 287287113.9 255399180.4 281011450 463649685.9 479294778 583623027.8 451260275.5 444093727.6 466741357.7 764411435.8 808458263.3 939443302.9 983668869 827242749.1 908087067 814563507 749642072.4 987305763.7 864540485.1 950546153.9 1051770457 830423544.3 992006422.5 1113013779 1002732744 1003544650 1403196655 145440567.4 85258245.24 94224185.74 104055983.7 140079374.1 307419495.7 268261536.2 277635749.1 86120077.66 326255991.7 572040275 440826125.1 483807133.1 540482391.2 550042266.9 754082584.8 610719849.3 701255209.8 711337586.7 764922285.7 902976785.9 718824517.8 771065327.5 712944555.7 824380404.1 1045109242 761004274 895524212.4 943767751.7 1124976433 334335671 391230040.6 446871394.4 207337828.5 271712137.6 1727966700 1786932819 1521626067 1681134427 1707120523 1919516755 2517352199 1916257009 1877952078 2147647386 1879017156 2472057451 2176561890 2512746029 2064981250 2016643534 2451660642 213594373.6 2288675668 2254198242 2016157661 995995618.8 1931562530 2760407259 2482005885
4-Phenolsulfonic acid 14772938.87 57951731.04 97883070.24 811453.363 46712315.8 10479303.71 12059999.37 60219737.48 85392539.71 164905099.7 162848697.4 126822999 22143756.22 41913088.27 74933972.89 84823583.01 113227581.1 145986705.5 15251931.39 73831321.08 100683300 7125798.829 98847674.72 124492572 14838244.04 47811727.29 58983951.35 83433171.63 77526700.57 102054666.8 18294560.92 48470770.12 88260552.65 83187060.37 46713923.12 106856039.4 335450398.6 97032636.61 83738892.84 91535257.46 120425711.1 373777814.8 259748466.6 88829595.95 13629265 91579467.94 373942615 235989224.8 98491403.84 108335947.1 159750006.9 242202370.2 228444326.5 90928476.07 121244526.8 115708464.3 217369419.8 165919116 102133216.5 110167862 98774442.75 188859373.6 73748554.82 65699602.06 73783644.79 123182512.7 152363549.1 108998227.6 77202787.24 97309615.5 107350352.4 162778213.3 101153051.6 49374096.43 127221034.2 66965848.79 123129843.4 183508299.4 51476821.86 39057406.78 128068425.3 108662373.5 124820092.4 48647775.94 77814877.47 77413198.22 118496967.3 96535365.4 1095359.448 54136106.82 100556001.8 121983313.1 21621132.99 37941577.73 85902486.2 118222513.6
4-Pyridoxic acid 19435385.61 29189048.26 28353588.43 29744092.12 24424356.24 23466354.93 14630754.22 25808814.98 25196596.35 14400965.28 9626357.762 8858734.233 21158982.8 23889933.09 25838701.52 14537374.37 13146246.67 16134987.46 19310652.26 25245984.48 32555151.76 26033916.17 13214283.27 15269074.77 26916646.97 22369855.28 25710346.76 26531906.43 20787054.71 19578177.14 26164074.21 24181818.08 27567932.57 29860726.36 26976469.52 38541833.32 26669181.3 15720589.25 32484008.23 24543772.83 30161304.92 4642199.525 9736950.047 30572971.68 3986503.352 26664653.3 17068465.41 16839511.32 31227822.21 22281723.83 28493389.17 15527756.31 15356533.47 26921784.13 21632112.43 24690243.62 19070109.98 19337282.84 28323030.1 22737861.38 28167220.84 20712512.89 16963630.57 26435845.43 30566903.35 25367733.16 32370694.55 30374306.19 36056204.71 24664883.68 31920062.28 30206896.06 28344856.67 27335979.7 26936473.08 24901284.18 30373996.88 34707192.37 28632099.52 10304801.1 24284292.66 27155164.04 28672765.64 35209886.62 25107091.02 18990067.28 24805824.5 30845636.06 1709050.642 18699908.67 24240829.2 29310330.11 5438801.85 27216626.09 27063722.8 29181945.83
4-tert-Octylphenol monoethoxylate 1003215.791 1521466.385 512986.2018 1044708.268 2105911.531 1918473.869 1243930.528 1793921.467 640291.1596 1433022.767 3379019.997 2543696.417 1660536.649 2388283.163 660855.4366 1264309.03 5179081.748 4433106.911 1939699.895 2638407.856 1264129.169 2639236.143 4474987.669 4122243.539 1708462.749 1931574.312 1037307.153 1695614.342 3276655.858 3031966.201 1430396.469 2032805.586 1161856.69 1647184.316 2131554.764 2946900.027 1281756.44 362266.1755 1022158.713 308055.1391 412078.3404 1593441.897 798378.6869 925957.998 64783.89544 164028.315 1681122.728 818246.7037 864853.9523 471306.1337 604007.2601 2017062.502 1074017.29 1203600.755 667485.9002 783575.0707 1660748.778 1059162.012 1088469.503 781563.6689 810282.3598 1308383.512 513526.4846 1210619.173 433729.259 593495.0476 414713.7404 234247.9017 357773.5831 216719.8276 263692.8443 425357.9742 389753.3672 427743.9225 482398.2092 236455.6686 568284.713 713145.0197 669846.0115 403243.4824 510986.8619 768353.3781 638706.7335 765194.8105 694517.0594 384808.2896 778338.7867 560193.0554 28346.00974 443606.0021 556551.8309 613950.342 123630.4663 580607.3033 704704.1112 593110.3128
5-({[(2R,4S,5R)-5-(6-Cyclopentyl-2-methyl-4-pyrimidinyl)-1-azabicyclo[2.2.2]oct-2-yl]methyl}amino)-5-oxopentanoic acid 9116695.777 5961580.295 6560941.768 3625721.752 4229269.12 4975520.749 4300097.983 3721655.436 5270312.526 2732645.485 2140496.998 1908024.882 4393142.035 3311435.585 5273682.422 2071032.258 1930355.548 3420594.93 4056272.488 5470873.34 7447773.746 2710160.608 5974037.669 4130349.461 426370.2312 904876.2846 4665888.62 3288343.435 850779.856 2530025.316 91427.85411 90920.19673 126234.3186 76665.2293 50079.82002 117238.6639 2070964.463 2804062.966 4545680.466 6474539.747 7202552.548 4852112.513 14817738 7367222.64 1174783.397 7259067.273 4481885.973 1063474.384 4481869.029 3382638.889 5379821.801 3552734.525 1835130.626 4584616.991 2952272.295 4207638.803 784426.5304 520891.9755 1331082.448 4658379.583 2576502.02 66682.05259 64063.41255 17677.15102 49126.17009 36955.11514 7428806.863 7851226.23 4000814.646 4296551.668 5382489.795 5764066.184 4779601.318 4849173.418 4861722.67 3723852.807 4293015.745 4374560.378 5489523.741 1947281.94 4005163.402 5452379.062 5531262.035 6738636.406 5516479.239 3248574.67 1230589.724 3708429.532 27850.64454 227587.684 3148208.39 21505.22377 23180.36663 128340.2143 74868.94039 37771.15289
5-(2,3-Dihydroxy-3-methylbutyl)-4-[(3,3-dimethyl-2-oxiranyl)acetyl]-3,4-dihydroxy-2-(3-methylbutanoyl)-2-cyclopenten-1-one 377396.0348 466037.3878 295202.915 963865.0248 63699.08373 66543.11324 433217.8023 400714.4297 391244.903 1562898.812 96531.68695 204316.1958 690012.3267 596134.7536 259570.2394 1030373.743 102734.945 149350.5885 437259.7103 227372.732 281053.0555 1532030.639 93084.43832 79026.74543 439470.2585 321462.9408 240152.1872 842675.0828 94497.83776 95838.35222 104179.6618 439791.8154 307600.3582 587875.1033 87849.35171 125167.1352 1856357.895 1746732.786 860710.42 2422052.714 1058113.267 2160702.19 6119704.365 993917.647 487468.6871 854949.7819 2417897.508 5911741.419 1250588.415 3546156.203 1144207.158 1224267.583 3782964.085 742208.4473 2919494.312 932996.5856 1430908.759 3251598.038 660036.1881 2231279.547 1014623.138 885814.0677 1115843.004 288566.5572 1510171.347 972119.5932 291425.0519 476637.9111 430556.0054 328712.663 681067.8922 212861.0739 454167.1954 305731.8508 430292.7862 440955.7971 213602.2918 359477.126 339617.1855 82151.43128 512590.2459 92786.7444 400315.1057 282657.3561 381692.6126 221644.2816 217191.5045 519252.9013 63507.17862 210281.1202 542165.9559 253669.5602 70284.07448 207740.4672 362001.2889 623775.5291
5-(6-Hydroxy-2,5,7,8-tetramethyl-chroman-2-yl)-2-methyl-pentanoic acid 415379.0809 309141.7692 300652.5932 274518.7418 267268.8407 301799.2573 328088.896 342961.2706 318696.1355 280444.9604 314262.7476 264553.9087 334769.7893 268460.775 315365.3793 238339.3877 272313.7158 300136.6689 323553.9854 336726.7571 685663.1013 355539.9371 342999.3047 319149.8566 11950296.7 263214.8783 1135100.343 2255499.672 525184.1155 310969.6643 33467940.19 8375757.55 4120387.402 8260067.302 3659398.05 504104.5701 227399.5772 213274.779 286047.7198 266239.4849 271042.2203 387308.0367 358471.0555 298774.7442 206811.5593 308311.9108 310560.031 308475.7255 336565.5624 336826.9321 284730.3115 1834095.277 252902.0724 308795.9363 274628.942 667953.2194 3615197.685 3865993.432 5493405.221 376843.9419 315929.9709 31657336.81 10480112.8 11024825.71 3450909.087 1074594.522 293819.9936 335305.9468 290791.746 284542.3654 322640.7321 327981.8471 346485.0083 283171.4439 331786.8342 276100.7686 266172.4791 277764.7025 862194.4575 239882.1046 313958.6768 316679.8148 319768.0525 328072.0732 327146.1875 689214.3294 268169.6692 336815.657 210577.0482 511207.4684 456501.8424 1821006.76 228084.8439 1548670.777 585450.2734 1204283.228
5-(N,N-Dimethylcarbamimidamido)-2-oxopentanoic acid 5123245.12 6025412.601 6281392.408 9790564.873 2506720.082 15197458.27 5354610.224 5754264.807 6066742.609 11656569.69 5619982.633 18228131.38 9239247.059 6663273.854 7358914.794 10808425.53 4925446.998 21899093.39 7200315.407 6326190.733 7638443.825 15796919.28 4714433.908 19269977.47 6932531.237 4444070.754 6649097.021 8343725.614 3093035.54 15883210.11 5307611.637 4603704.083 6025864.771 7765599.934 2387697.002 15786088.67 8965420.375 2608304.924 2910175.165 9819175.687 5191342.705 10868201.65 4961148.442 2911499.812 2268799.464 4023075.457 13615757.93 5212093.098 3329885.767 12224511.94 5412206.152 8494512.583 3860015.782 2472833.74 12060792.33 4312889.022 7719247.089 3545483.306 2506153.071 8156800.181 2971212.46 4565493.631 2335010.968 2236928.861 8729735.457 3063322.344 6174006.606 6179712.921 9644666.179 15921155.38 10898792.51 6433619.152 5925254.093 5484738.306 18124210.89 7301102.639 5201281.631 6380337.689 6442828.352 7264829.722 6743257.828 5240839.774 6125613.222 6541239.301 13528562.41 6592452.141 5155330.775 5907868.438 1092508.801 13173737.42 6359397.063 7270673.218 2800168.76 5616894.172 16987143.96 9334638.571
5,5-Dimethyl-4-(3-oxobutyl)dihydro-2(3H)-furanone 6429334.286 6854452.15 6707151.205 14346682.78 5659167.21 6816306.531 7342642.705 5889546.605 5678904.946 12376555.32 9544358.371 5855471.105 8417898.615 5843560.493 5008837.313 14640770.63 10025279.72 7393655.381 9542485.079 7488737.001 9774414.793 21962286.12 10476212.67 7402972.42 12686855.37 7836606.023 8193747.955 14710608.65 8935810.422 6886518.711 14361453.18 8652238.549 8864788.223 9667182.148 7355233.841 7132878.56 8340731.182 7455385.326 7619285.415 7969020.47 7322058.638 9383678.071 6917472.824 8614666.643 3165654.802 5599365.501 9915292.186 13085373.06 6350002.644 7771942.658 6764103.596 11639287.98 7562095.247 12494933.55 13155631 8083364.936 14336021.54 7349610.637 12698386.17 10466428.55 8828867.509 12959000.79 11344690.08 22437411.77 9819702.465 7372151.278 2431437.044 3770286.169 2809607.219 2027999.271 5149462.034 4372509.547 3310713.489 3429239.313 3189224.924 4071581.562 5110485.348 4955508.45 4984972.846 6255210.266 6196334.789 5152569.487 5867373.067 5884723.629 5518643.302 5936049.505 5222176.059 4794344.909 3972202.36 4630618.364 6299746.135 10504605.25 4322913.403 6237858.7 5799313.805 7578208.537
5,7,11-Trihydroxy-7-(methoxymethyl)-2-methyl-10H-spiro[9-oxatricyclo[6.3.1.0~1,5~]dodecane-6,3'-oxetane]-2',10-dione 33665855.64 20346592.37 32918070.95 14874327.03 37244833.51 26098038.05 18513754.04 26738544.7 27850364.62 21547636.1 31363792.02 9669637.097 15825815.52 7639476.624 20377513.31 11714878.2 29116185.01 26103074.57 15599204.06 9627617.439 23011441.47 20647138.7 18379169.23 27801732.5 21568788.91 24133937.14 24133409.84 25429298.58 29120421.21 32939402.52 14542751.18 9990148.345 26429027.54 21920251.33 27260342.58 54215259.72 23030695.89 5066168.434 13817579.61 12109480.81 33395112.64 9854639.319 11602364.92 7979726.017 3141813.425 20665731.06 25357511.88 20318963.12 26895732.99 23004561.77 19003493.92 17565288.94 20270893.27 19909341.52 20226199.25 9325850.735 10014159.77 27569614.98 12066617.61 19191189.02 23791097.81 16181327.46 13488598.9 28622646.21 27075627.13 20772719.03 22833639.31 29287804.9 22745163.32 20064810.06 21282509.54 26473004.01 22370249.02 18442664.23 9886317.982 15456179.29 24922593.56 21371223.53 21315517.02 7926960.374 15313916.74 15795980.26 7793303.516 20632693.21 18518103.37 17993359.38 9985847.971 28537887.19 491821.8117 7851896.645 18810889.46 19009225.59 3548127.291 13933345.61 26781838.61 25312626.2
5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-1,2,3,4,4a,7,8,8a-octahydro-1-naphthalenyl]-3-methylpentanoic acid 1785404.37 3108615.387 1800055.832 3775118.721 1778926.999 1635126.653 26547622.65 26879905.07 41093742.8 44742881.5 30096549.72 41539404.26 238274461.3 122323273.6 133364726.7 104583272.5 114297842.1 119877765.4 334334896.4 189740836.5 228577097.8 389846988.3 205608660.6 241094153.6 361443132.9 198766242.6 174363181.4 255288925.9 207014246.2 203826714.9 369944096.8 205255435.6 207825983.7 214423297.3 170670413.2 288444029.7 1385438.278 482255.2052 1154215.928 3274547.537 1195243.397 39639822.91 10455953.61 14003086.49 12458106.14 23915260.96 105812778.5 42612527.63 39755331.92 146917883.4 98409944.99 157528252.6 84220581.53 64287555.91 284938531.7 145003074 166754108.2 95031664.73 87150846.39 249070474.9 149486249.1 111059725.3 57443448.28 90785840.99 176800187.9 141912469.8 17724457.41 16991719.69 18296636.73 3673035.117 4104774.302 97795771.26 89240382.82 73455668.73 64476229.21 67200280.76 175683238.5 180950697.9 569403896.1 77769754.07 176096520.6 198027317.3 202323941.2 248216826.6 210830129.7 152886705.8 184467752 184645048.4 15930871.24 152280392.5 186405483.8 181042335.5 50021422.06 234929221.7 220403780 237535688.8
5-BETA-D-RIBOFURANOSYLPICOLINAMIDE ADENINE-DINUCLEOTIDE 208803088.7 312266954 266029145.9 276772273.2 272716616.9 326576398.3 122105557.3 290408924.6 265015715.5 119032241.2 50323748.05 91806116.04 174398666.5 269704098.1 265346910.9 153895657.6 94733958 175868318.2 200111391.8 278743250.6 329057139.1 220477893.9 114770601.8 184509614.3 82992311.87 161145545.3 140955818.4 73045665.76 57579424.11 76223814.15 8239997.494 32825345.74 23030673.68 10933424.7 21591611.89 19073255.81 253034602.4 237181122.2 249035857.7 200411529.5 308645668.6 21756476.99 81217501.69 303884273.9 34673208.73 330917636.4 122685145.1 147437929.7 330925921.4 172226774.7 303220564.1 146796787.5 157636952.1 299432331.8 197789245 285923834.3 102048977.9 117622553.8 171913073.7 100337823 200536756.4 11320689.25 41297723.8 30847711.43 5251899.004 38172807.52 89313650.38 106198878.2 93079434.55 221250633.5 270381235.5 11263845.13 10716068.23 7720223.723 24675601.45 13851593.78 6463804.981 6866870.318 4811423.801 8658611.279 11282244.03 7930624.417 5436279.474 4769813.723 6831436.894 6822245.267 4565117.424 4199568.754 1036596.246 7196381.086 6246062.539 4210600.082 2027656.374 4347368.821 5680710.15 4980375.429
5-Chloro-4-oxo-L-norvaline 1320833.343 2646161.887 1346055.728 1612021.739 1202672.035 1550692.817 1313313.753 3134450.8 3412138.495 2877336.399 1530554.304 2662510.512 3164234.441 5611651.755 7011700.806 4960736.786 3151972.229 5838477.399 6581502.205 9971654.876 14321448.07 14142657.42 12001041.8 12311511.1 7584546.027 8392601.941 11427142.48 12900514.11 12927840.9 11115266.72 10232092.77 14193157.94 13289688.45 15029193.4 11726029.6 24490902.41 2403095.129 956568.5448 1203059.921 1202840.771 1274583.341 2993737.347 2349304.411 3303441.348 455663.3529 3106658.56 5013692.713 6177417.131 5541216.171 4562997.729 4946303.192 9083695.04 6333410.117 7560166.901 9435822.506 10300578.86 10394626.05 10104063.77 11566307.14 8405570.756 11610020.94 12044482.18 7465653.874 13037363.06 12418598.74 17570103.13 2851747.03 3297168.327 3702706.325 1753329.26 2744468.046 30811649.13 34062319.15 24585037.46 29564107.59 27170112.2 33893039.5 45502459.27 36773646.47 10663443.77 38793845.05 31027162.2 41627784.17 31859780.97 44110714.11 27659845.47 32478270.19 37528124.57 355376.0752 2423719.853 31779306.39 31638389.38 484077.8579 27449460 37785417.73 32250618.89
5'-dehydroadenosine 320993.6507 428999.632 361551.7314 382639.0438 316401.4582 366438.5047 312748.9931 465441.7573 356835.1872 378737.8884 891907.2443 376060.1919 388043.9711 543985.0754 367111.7675 374415.9994 688405.51 509729.3582 383068.3697 527327.5921 414395.0545 1045758.509 956920.7378 908643.3087 2211279.025 1033942.6 3346778.373 4073937.792 6063339.901 6503339.925 1870788.365 2109298.812 4175649.997 5991157.434 10732119.96 15733506.57 472108.9133 347022.5373 373633.5466 407753.1873 413725.2335 383547.0904 396750.381 318390.3676 235374.6771 465431.4829 450343.1646 417048.0568 331225.3308 389179.8619 398268.8219 390856.4939 381041.5956 338593.8409 414566.1154 422215.9562 464959.925 949402.1023 1303942.717 415799.6133 428997.7073 656367.362 1057953.88 1468152.172 787914.5962 803536.9562 1107314.55 483661.3529 1512492.27 349113.3745 385396.9772 26982454.59 22327975.46 26262233.53 14706550.97 21083642.92 31881781.05 41223796.2 39417668.83 18022513.29 23941487.11 28857946.96 29104686.91 36121490.41 28848721.7 10784332.2 24811661.35 25635978.65 268014.6067 15601630.31 8414530.833 17055969.57 1404379.191 15909049.9 16179009.01 1329257.224
5-Hexyl-2-oxotetrahydro-3-furancarboxylic acid 5529171.369 10244757.36 6538023.469 8320655.308 8399677.277 16053060.06 11612809.28 13833536.68 15840812.51 4847935.523 10460185.33 7946350.065 15815113.65 7865898.932 8852938.545 5325388.477 9338026.167 7408340.034 6993159.934 9046185.576 10498353.97 10949583.61 8986416.714 13020942.7 42802286.49 27076444.95 26322579.21 25952399.13 22748251.55 22743335.94 10363510.65 11889134.22 9816945.346 8405662.392 14045826.91 16389048.17 16079947.05 4510642.082 11340652.43 8212641.984 9213494.485 17768635.11 6378210.986 9503493.962 2874519.385 9053615.319 6973362.717 6674902.218 16527964.9 9668005.376 5832507.316 12141614.01 5516938.035 10496144.06 7710565.777 10205617.84 25163225.34 40398620.64 26535290.11 15647839.65 21743462.62 8181423.128 6812474.364 13241760.1 9119023.948 11110457.73 5753016.015 10718868.42 10403084.67 6204631.781 8426186.262 13200144.56 14164503 5969598.268 8073087.603 8613741.367 14044051.24 13012974.58 8294886.581 8382370.284 10633562.26 9868872.253 8510871.498 6333882.333 11111161.27 12883441.05 36980001.05 22007496.35 1084781.096 14242320.65 22453037.59 20092289.78 1588574.144 10563269.34 17263144.74 12746745.56
5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl hydrogen sulfate 7834742.384 15573264.01 1780138.251 16811410.85 648111.2058 11213844.04 12096187.88 12526048.17 1556853.365 25898010.64 1652693.707 31955160.31 21672825.37 22564592.94 3414998.286 20573845.5 1512461.518 30118827.8 17060666.08 16871014.93 2639717.072 40106508.62 1638094.49 27032326.89 4114741.432 11909800.78 2711299.551 11337220.91 987491.6719 13246305.57 11895375.59 14868300.26 2407565.483 10952242.44 912888.9743 7754059.904 10245332.33 9119946.546 7704430.425 11031862.04 7279866.839 30355209.7 24772365.19 8898636.089 4621132.747 7203602.249 21284506.47 21767454.54 9097163.198 24527673.49 12979705.35 13627624.82 25144462.3 8088052.168 16773619.68 6365893.102 13743663.73 17847838.36 5305110.29 11174605.87 5223019.278 5117690.217 7080458.462 4848197.734 9796134.399 7366614.064 6914152.855 5044634.489 12325660.03 23209038.32 17964433.82 6753705.283 6413127.819 12868923.89 21625794.61 21943438.05 5431701.515 11201417.67 10122563.66 9013791.846 17410998.3 11019768.22 9736192.143 9337349.098 29394115.9 4977482.578 7860237.484 5830764.896 374226.7831 22165102.95 16530058.38 9437991.934 2103203.067 7340839.237 19316598.7 15451463.17
5-Hydroxy-DL-tryptophan 6229298.359 8296424.369 7840401.047 8126843.712 9123523.302 16136054.48 5184520.818 7929024.554 7317462.998 6791724.05 7166761.278 9201586.112 6339947.842 7670135.962 6892451.243 7758557.281 6373045.574 12878931.52 5254128.105 6753666.044 8118172.79 9070878.92 5595076.726 10669785.9 5722904.948 5253616.869 6872837.809 7394794.758 7542917.587 13071070.51 6219154.164 6591484.066 8323911.233 7912524.6 7075624.46 19243673.24 9183284.546 14370572.04 11819636.61 10304609.02 19974979.08 4147007.059 10835435.42 12872881.62 3512146.883 13910673.71 7301821.317 10948277.15 19316462.74 11075705.44 13573299.86 5567146.068 8561365.65 9709581.704 8619519.176 10018213.39 12363645.19 15723139.78 9147684.7 8814783.766 12386183.84 6423488.007 12210984.79 9523495.81 12203907.27 14873459.12 22164640.73 24261827.04 38596584.74 32871948.47 37909285.1 21331112.28 19081953.12 24874555.01 24342786.74 16610063.49 20153631.19 23623204.99 22417891.06 18045326.43 16039314.26 15077065.34 18589862.77 25105983.87 17123355.91 12449511.42 16456824.35 23269067.75 1593083.724 23369601.78 11469238.86 20369004.34 5706425.881 16391241.54 18092037.75 11175212.74
5-hydroxyisouric acid 936580.5826 4462258.625 2877889.679 1594438.702 961256.4383 2574492.159 2707097.124 6756540.086 6961876.979 1994496.187 835342.8406 2472923.567 3040052.909 5208174.194 5922248.531 3040472.267 1612490.228 2101083.517 5630616.139 8210182.628 10340483.64 6910566.691 4421008.465 3673256.022 7280498.431 7173986.483 11264797.07 9248169.432 6910491.092 8275564.372 9749303.37 9742092.06 12947377.17 10372698.04 12664837.97 10990958.44 4297137.611 1202644.403 814351.4099 805551.9664 1110522.503 1357204.167 1581176.391 5877199.073 1144284.701 6128857.332 1970249.651 2588035.011 5440700.431 2548335.454 6387227.675 6040739.805 3579558.454 6492611.193 3194656.439 8186228.073 5806547.114 8382063.231 9748882.461 5105793.835 6714311.224 6193968.123 9942896.825 11645678.8 4383455.867 6733392.28 753522.7827 1623565.053 796937.8029 1127637.047 2098488.719 2032210.642 1539129.471 1181817.738 2797602.537 3113274.698 3794363.259 3276360.454 2337636.607 4001302.501 6525006.89 7448858.877 11081544.76 6429607.359 8201621.729 10583640.38 8596806.988 11059262.17 1242012.308 7762717.928 15178850.83 9384990.404 3188640.638 9794428.992 10015746.62 13433131.96
5-Hydroxytryptophan 18193275.47 43269166.35 41355243.38 36056247.47 30689710.64 59052567.59 15030077.2 34726124.03 34751093.2 16696663.46 14193060.32 27949769.03 23278912.18 31849024.57 37344353.42 15959765.18 16795255.95 46486629.79 19403066.42 31570429.99 40582589.54 38751387.66 15173921.41 41154413.88 31811509.38 21645400.8 31236619.66 26982669.19 32767800.69 54625965.54 34598043.61 41126811.26 45648680.66 44572699.99 42665169.08 100703576.2 48809511.46 33188010.03 48611379.29 51589482.43 93706738.71 9784801.079 24201676.56 54096102.45 9676032.96 74698450.43 27699335.87 34982567.9 67181850.28 47381997.01 76460637.04 25821331.6 29908644.29 56728679.94 51118726.75 71195945.13 44333131.97 43567105.87 57028581.86 40792569.28 78870057.71 46914728.37 41380879.44 60121600.33 80001530.77 74922635.66 102181308.6 93520066.78 141681994.3 91213180.58 114489029.8 105549505.7 102168950.5 100478611.2 106900275.4 82111718.93 99620597.86 125539696.3 99355364.05 51412147.98 71634747.92 94270137.81 93518183.19 108754819 72706441.51 43627317.48 81621684.23 104102140.3 4641005.818 59302112.31 52587016.36 110196999.7 14687976.84 73485863.73 71470466.62 49342776.16
5-Nitro-o-toluidine 31657681.69 30874839.55 35723574.01 36549392.62 47866127.02 78491279.27 30019841.9 26125011 24630689.96 32785063.49 64069870.24 71106749.06 38361575.34 20807736.56 39017713.02 46142073.87 58636420.21 85887271.06 29746030.9 37538367.98 31714246.87 74356316.53 49471678.95 62655724.68 41322482.16 25205189.54 36512650.43 43127309.13 43478634.59 74759318.94 26961230.89 30386210.78 36717874.87 29395537.81 46168660.23 110786146.9 35780259.39 33527588.07 27648031.72 28048596.08 23725468.95 22157784.63 27978534.08 15679832.12 9454475.291 33657181.62 46416459.66 45873682.47 21004986.02 33607785.19 38749956.35 26617391.3 33167192.4 19232548.76 30415434.48 25350119.09 35642198.34 30612625.76 24995413.5 46564709.15 22156855.27 25993895.96 28563602.9 17203002.86 45241342.48 32851552.59 29697506.6 33607624.88 30533963.27 67991330.34 44711735.76 40813741.24 34473073.87 21645998.48 44561425.89 25696151.62 26063397.9 30583331.59 27893867.52 40384653.96 30698062.34 37857932.58 37573354.26 38065420.23 57288048.1 31420827.47 27894247.81 45209592.17 2435616.744 46976208.4 47911289.76 32499010.45 11369061.88 22962199.88 67121676.28 29682540.86
5-O-methyl embelin 827632.9985 833917.2445 165740.9872 1943185.089 2437690.527 2073178.041 769783.1249 947715.3875 155483.3939 1493467.224 4290905.261 2904176.713 1179811.675 1244555.714 162328.2287 1925009.142 5074389.253 3456728.151 1112791.767 1019207.925 544066.8357 2594260.18 4182853.398 3098641.405 1132353.037 1110386.274 312559.6247 1693873.574 3158457.232 2316609.303 1085250.019 1327689.15 435783.0926 1086591.099 1749220.215 2122173.447 1254008.702 878543.9165 5258786.132 1011236.949 1266242.459 1716242.621 2100860.373 3291142.06 113902.8082 1441057.8 2196814.021 2453635.329 3828786.898 1311376.898 723782.3932 1383676.28 1422983.605 3264319.521 1217713.563 1484728.652 1518975.728 1827477.921 3865166.363 670158.1593 1243482.197 1843928.965 850776.7262 3483648.998 714851.3772 1097757.011 578656.5745 251551.0441 551081.6886 497371.1891 596277.5764 659828.9115 595117.1047 184051.0621 978478.4924 574358.8869 462555.9747 160745.8357 857837.9949 992205.4509 354005.3057 760554.7623 188760.8643 805058.8237 779600.8101 299496.4427 183164.0809 362876.6084 103299.004 377619.8689 641832.8575 1318692.482 174396.9893 596530.1309 865013.3252 953934.5143
5-Pentylresorcinol 3702305.328 5798548.072 2403585.207 8186728.172 6777739.427 6823926.645 6904982.368 4690351.638 5275494.772 12629580.7 14862041.92 14371335.78 21479935.93 9930885.547 9958793.182 13483960.8 20377402.91 21865874.99 26771153.08 16217800.12 15020824.62 34360962.25 28746244.72 29509128.04 18732799.06 14076960.61 13799688.23 21632825.82 24689462.41 37526039.93 21345625.79 15958578.92 15647144.11 22693093.36 20151578.73 46495244.68 2938053 1949494.599 4021424.758 3696212.922 3560164.632 5670029.118 7851671.699 4954731.656 2010049.938 5654481.906 10970891.79 9318462.551 6964469.641 18059438.09 10724450.23 12688940.71 13452714.86 9279149.463 22584836.75 11969764.57 14778761.57 14343549.47 10913900.85 19111696.41 13598702.92 12392986.05 9084503.345 15672754.07 16152252.04 13862150.43 4849600.883 3912547.896 4507075.189 1781008.44 2411382.532 16109077.2 14877314.59 15958598.32 15732695.61 14092313.93 38513859.11 27422878.12 36030220.98 16752751.44 39752814.45 64992631.08 60269015.48 73231880.94 93845785.17 69607190.12 65736096.04 55594518.19 3406177.146 67669980.99 93966840.49 63085915.65 12667368.44 61250511.77 94878602.4 88302590.98
5'-xanthylic acid 866876.3797 1144151.245 1093923.085 1065458.38 1134324.484 1424147.386 1417418.569 1095985.948 1165982.708 999835.5397 2126496.331 1749265.942 1543061.92 2999430.208 2815419.97 2394659.786 1769743.57 5578834.018 2444520.923 5022961.596 4261153.905 8413915.12 4630048.411 11940628.2 8207690.903 9980475.289 8303719.082 17245072.23 16320427.36 27648055.79 11520419.62 22404462.93 20841532.86 29033421.75 20511940.25 55389919.11 1194123.793 2405288.594 1716187.066 1161077.377 1314924.079 1126958.74 1243523.795 3946250.464 880456.8664 1705942.759 1782855.555 3192996.953 8689288.097 3882816.243 3936817.525 2825467.443 5027264.02 10425949.47 4938588.998 3433636.727 7085823.825 14241727.33 19099163 7883096.559 6048835.138 15464811.42 24345080.69 48085825.41 32732565.31 18665584.93 29038318.61 23355937.68 47181680.91 7429177.838 14892510.07 81653520.64 61538435.78 85107743.78 72552066.78 106629837.9 54391302.28 70236287.5 60413626.61 43375097.51 96457914.79 33778284.44 53060786.66 42452732.69 73351018.78 103300392 57734193.99 51686081.43 3137535.292 70982146.91 105798101.1 114283510.1 14678528.13 41552958.69 53876218.53 86627748.44
6 beta hydroxy testosterone 368809.3599 457513.6413 417648.3401 439741.1542 393970.9469 368477.7195 339595.4194 370313.1136 331748.3951 406674.9584 384177.3705 302102.2851 351371.8469 353555.5497 305455.4399 302737.2689 370648.2631 319869.6975 344274.2176 328809.3304 283137.464 373741.082 503299.0327 290857.1566 5353345.04 378620.2366 747600.373 1085170.151 487781.5916 311643.1095 16924643.52 3200962.835 2379680.772 3274299.807 2515375.236 688037.0229 606789.8822 498967.3149 553884.8884 640485.1595 632826.9986 492613.6635 462700.3584 467322.4428 253948.3238 431561.91 460509.4036 416708.3081 406217.1819 444229.7876 417786.0444 367645.4559 365476.3044 361666.4585 412206.195 356981.3127 761180.9767 1044465.488 1595579.777 551378.6609 433583.3916 7173082.581 5621620.394 7145204.908 936185.7213 375829.25 463126.8794 457477.2802 420829.2201 411383.2235 381964.4431 473076.4811 477567.5415 399715.5767 396512.6635 372037.3831 452877.7798 512717.0357 389171.7428 308490.1043 391575.5085 1067758.03 657398.6775 1681479.3 545612.0166 785539.4682 607670.7496 502945.4937 166074.3017 478152.0784 1414569.668 1863310.573 495877.5037 1748703.143 1458624.687 1726216.78
6-Butyryl-2,2,4,4-tetramethyl-1,3,5-cyclohexanetrione 138099.8253 181827.3107 195535.8509 287129.5774 89982.0294 80790.33886 487612.3938 355862.8952 616207.7081 977486.2709 1062954.281 1013069.702 2123668.873 730113.1964 1352737.297 1744588.403 1838005.778 2716142.896 3326929.326 1593025.085 2534540.982 4929963.293 4136315.195 5217086.427 4046184.033 1943898.575 2433325.201 3873229.164 3478101.144 7797514.336 5032288.797 2178960.051 2816498.281 3951692.878 2576606.194 8385136.762 109635.8584 135520.3562 142332.3773 148049.2964 172414.009 873111.0195 488319.0087 260032.4966 384752.5161 628685.5843 2007276.726 1010777.007 723723.1313 3203190.27 1497731.796 3527298.943 1582654.701 786549.5458 6725369.574 2345989.318 3276903.665 2385776.551 813822.7734 4106897.152 2383647.268 2876236.644 832119.9307 1689974.946 4075175.617 2996051.751 638050.6472 493040.6588 740691.7424 122107.8434 523126.7299 2017812.496 1727553.1 2497787.484 1790067.635 2000569.146 4623111.714 3047522.529 4755097.608 1536775.671 4779998.856 7481951.207 6190460.757 9055517.178 9605283.891 6503271.131 6649689.012 4608326.557 496634.2256 5986620.102 9206322.762 6969231.223 1163215.857 6059039.135 9384757.93 9879259.884
6-Hydroxy-4,9a-dimethoxy-3,4a,5-trimethyl-4a,5,6,7,8,8a,9,9a-octahydronaphtho[2,3-b]furan-2(4H)-one 14731636.7 25815421.75 20263452.59 24670829 13997877.76 34537140.43 51420693.55 29250700.46 48324913.21 15037109.47 29941209.68 33237637.54 42003484.14 17611709.24 19000931.99 10965535.74 24945907.58 22725714.49 25784425.06 29613870.67 23141287.36 22596522.08 28673320.31 31854320.31 35076597.37 36662670.58 37888097.03 37799568.98 24767483.47 29285067.68 6754858.619 9342451.283 15022055.2 3536012.658 12714573.84 12946250.53 54882756.59 12690303.89 33995545.46 17512617.66 18089339.34 75962199.12 20586951.53 15959322.81 10020873.29 20554076.57 15999870.54 7774012.622 41062104.72 17923505.88 12357036.36 34522818.41 6101969.305 36535558.91 19188527.27 24383232.44 26949363.93 43591656.41 34346602.27 32171371.26 35457608.8 10598153.51 7913986.872 20177486.27 12748376.86 9258820.273 14756203.39 43715757.56 22784828 22364550.58 23115405.22 67124879.65 49028714.33 22155125.87 14743547.62 19075016.05 59307755.37 42887350.55 24612673.41 20636257.4 18507084.04 25045957.47 24247319.34 13366772.16 30337998.21 20051794.91 73092283.28 36243347.94 2090455.583 13106019.41 31464866.67 19947962.4 3936018.31 7294320.33 15182257.99 17532429.87
6-Ketoprostaglandin F1α 3844044.783 1714559.268 2303124.435 1991163.189 2099852.445 2353247.061 1282869.708 1591310.613 3115063.956 1721733.784 1607967.05 4279429.755 3006288.589 4041375.139 1297776.364 1597723.905 1660376.451 4585883.841 3263968.149 2702504.341 1573847.063 5538369.028 1879242.074 1322940.641 8355665.59 1113159.256 1093562.83 4063431.072 2487821.823 1641784.205 18358345.44 11407214.8 4288622.605 7415658.908 3333285.287 4165214.727 1682614.136 1168167.885 1251099.584 1706332.48 1818589.676 3044326.529 3277342.686 1311728.521 513795.3731 1305893.441 1304611.217 1330717.349 1313335.464 2675931.843 1097662.328 1184359.998 1290933.345 1336472.424 2942088.179 3363793.831 6622331.223 5038591.973 7682961.171 2478676.69 1188003.45 19641744.64 18176539.49 17262947.18 4746035.595 3038893.005 6346470.651 2158424.608 2662484.675 1247814.104 1338721.677 1585275.413 2176946.034 1858734.999 1482162.952 1776299.488 3521167.233 2754874.826 4480053.085 2371623.886 7359459.782 6369005.478 8354814.027 12013873.12 8938329.849 6373927.991 5546276.129 5372852.905 408149.9681 11095679.91 9301116.722 6145354.785 2031560.188 9275520.702 6491669.232 10960879.25
6-Methoxy-17-methyl-6,7,8,14-tetradehydro-4,5-epoxymorphinan-3-ol 6864185.807 7444684.202 8769166.3 10770659.24 10840589.63 10970284.56 8821922.467 9391628.909 9179980.489 7659706.647 7464888.351 7277605.758 5890622.012 18373283.76 11221881.13 10526068.1 12812141.03 10208958.65 11797058.62 8258738.718 13025788.47 11281262.69 9743175.26 9048010.436 9869206.805 6272128.497 7557821.85 5783110.358 13288870.64 8570379.596 6468655.92 6446212.845 5560958.845 5940640.175 4944481.158 6292316.55 9050820.905 6316471.015 8447457.945 7473835.265 5799423.024 12445589.68 11788155.11 6014864.675 3254325.616 6620789.195 6975916.02 8548866.734 7740067.386 8796959.92 8372253.442 14217648.62 10425543.44 3886638.398 9580884.893 8315182.404 10748128.42 9083788.755 6395145.639 7808117.123 4560681.388 4441521.938 4149417.195 4853961.23 5007881.162 4087666.548 7511516.569 6188165.426 12505865.77 6250842.739 9804250.478 6211814.15 6481194.308 5062553.631 6925467.801 6975958.902 7805860.858 5952089.453 9445369.223 3522887.228 9009653.185 6058027.934 6621007.088 6615426.657 5337620.112 4086371.466 4161194.926 5155894.514 1455314.974 4448442.944 3974856.277 3761939.139 1789890.513 7031750.043 5292249.395 2571691.771
6-O-Phosphono-D-gluconic acid 61058907.34 54152787.39 27387464.93 55056927.06 40788642.41 105991345.4 27507427.94 59791266.01 66597318.64 111630837.9 97184159.79 141327489.2 115041892 145870016 117016312.3 142154544.9 143377566.8 161152189.6 117339281.9 162917307.1 136466803.4 87181659.83 101540828.2 38420022.04 154816883 143787460.7 84751657.64 63221806.68 128401656.5 50757981.68 55750419.35 162805850.1 63067262.94 13646932.45 33375856.86 5913685.588 119484547.1 46354296.93 75378332.1 49666813.94 22420921.92 47568920.43 139541422.4 119272144.7 46828795.23 117391954 297886663.5 246172526.8 160882626.3 202255581.4 203201752.8 108754008.1 148509154.3 126388473.3 142803209.4 148916717 187829274.1 110014862.6 73549617.96 94772645.39 183230976.2 175759086.9 7554510.761 23579266.89 614022540.4 9475920.621 109136067.8 79924067.97 175639398.9 47482213.95 37575599.05 92997065.29 117170774.1 175501642.8 50693274.9 39816002.51 10238144.41 14885798.42 22419240.67 8473337.354 12859537.41 3122238.381 3715866.894 3553237.181 6812361.376 5060944.509 2954570.321 5142141.805 1597855.523 3948655.472 3477630.883 6077959.013 1881436.894 2426906.345 6534890.75 3264416.126
8,8a-Dimethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydro-2-naphthalenecarbaldehyde 116950.2687 140560.9006 57483.94518 69283.95888 101374.5814 87458.23095 670301.3319 622745.7968 1097456.538 1176137.494 946650.73 2002052.146 3681804.359 2114073.883 2873837.441 2643553.715 2530537.321 4825526.454 9541559.807 3741229.626 6033205.711 9568048.688 6702897.637 9873992.334 8179359.168 3683602.821 5535354.036 7639802.409 5964015.462 9696140.242 8616645.555 4083084.198 6721426.853 6950146.814 4215306.43 11930863.73 102402.6333 44929.42914 76783.44147 84141.22987 67367.96179 1037497.89 476731.337 322644.0135 472817.5393 628292.7324 3027054.917 1401041.185 817180.1857 4646264.509 1987057.394 3763358.738 2313813.34 1287903.872 7135755.399 2610550.512 6055548.031 3343857.318 1831571.891 5618497.185 3130522.003 3676768.371 2129857.573 3235252.387 6962424.145 3507087.931 646430.2564 486518.4264 580829.6681 171085.7329 239014.8503 3692001.723 3068102.404 3569962.455 2489810.06 2420971.809 10997888.79 6169108.381 9242685.945 3691407.554 11870562.43 19711720.37 16788805.97 24411759.79 27749985.85 19822335.23 18102747.77 15825576.8 1302698.8 17070003.26 27349885.73 20319258.45 5121650.225 25618643.68 29920305.28 32186544.7
8,9-DiHETrE 48111.86432 55235.67331 47352.59034 50082.71504 41964.49659 46146.13854 365722.7925 45327.44517 571614.9859 275485.1556 47168.28121 72982.84335 6521741.361 454919.4651 3138241.168 2904962.622 891130.4126 1144586.457 16103135.55 1693921.373 7399926.088 10791697.59 2583697.657 2800364.639 15166732.04 1492890.475 6466240.705 8230094.027 2709635.334 2505359.715 15396105.33 2082551.406 7669741.017 7935658.2 2253263.218 3392041.779 46929.30458 43902.2475 46506.22577 46796.43213 43868.9137 53134.54141 47479.27224 46730.01311 37829.28376 44739.76969 315468.6013 132886.3209 48429.36807 278570.5854 57170.60996 403857.0625 80812.51535 150492.8646 488659.0245 301772.9713 642942.0027 213290.1602 205191.6507 337811.7879 279778.5358 415583.9593 69882.65222 177082.6917 220381.1978 250835.2077 40592.96004 45765.95587 46518.02777 40646.54202 47098.15696 48626.15682 49012.10701 47173.48354 48067.34643 131749.3172 53236.03523 51878.97055 53408.14373 48868.2107 204983.1587 46282.46927 51619.25573 62177.02921 59951.79154 84266.23118 62469.80303 52664.54504 45594.53368 52283.26697 197326.381 54506.2598 41616.75725 51174.14571 52854.90884 187266.4679
8-Hydroxyoctanoic acid 1975281.628 2513223.326 2077739.871 1938688.322 2496113.481 4342578.761 2240763.851 2606779.742 1913188.924 2475768.203 4430026.135 6231352.602 3044240.25 3407699.326 3688233.709 2059037.926 4683552.211 7406867.681 3711942.622 3889618.472 3607755.136 3785300.226 4843564.323 8340603.284 3581263.945 4220783.405 2465542.042 2983855.091 5269317.898 5874590.346 3878177.541 3674239.167 2799254.4 3136753.589 3025249.702 5841623.328 3565631.721 3076488.143 2113450.717 4163954.902 4030781.904 3583835.056 5696816.144 2824666.451 1242283.143 3742656.953 4526196.141 5909489.35 3673475.064 5344734.75 4509408.1 3729417.952 4949929.768 3430296.639 4853965.426 3827337.995 4207552.415 5079049.502 3431104.832 4119869.614 3780531.276 3720174.504 2892195.275 3486930.221 4848084.977 4282857.143 3235979.304 3359244.826 3924115.596 2860923.828 2948746.382 3327440.441 3317072.048 2646229.793 3678786.417 2972816.935 3291683.462 3521662.813 2821717.638 1759165.545 2827102.663 2959794.125 3213383.936 3215978.186 3809022.243 2442465.473 3600156.284 2912233.646 543601.8936 2132726.161 3264181.147 3006246.684 933880.7855 2285254.782 3183609.608 3143698.389
8-iso Prostaglandin F1? 43516.79705 50464.37933 46711.95109 46149.82635 42379.50158 43940.33906 170585.3777 114946.8824 207036.1955 233044.1283 157731.9859 217967.0448 1507153.39 790845.1372 844865.8028 641886.1732 522524.2898 497609.641 4802803.57 2097060.718 2801012.473 5184041.567 1780424.62 1502091.862 9397090.898 2061259.366 3219491.463 4652383.221 2123196.626 1737114.146 12560522.98 2417804.38 4991289.416 4351597.508 2580737.635 3214758.739 40006.43084 39921.7843 48682.14363 57079.04079 44104.25691 110427.8718 69963.12308 69351.1483 88508.15674 267476.5639 425583.8973 173695.3034 305025.2003 674425.9873 623202.0556 847246.5593 291541.1364 492320.0406 1319559.56 1596062.01 1065750.98 655807.5689 611280.2735 1380799.834 1738405.712 1008032.306 867386.1912 1354362.308 1679185.474 1958771.225 106102.0935 45822.45159 47592.76965 44054.15732 45179.15023 457427.3655 386840.8234 409708.0125 348208.3068 372109.4324 1767637.127 931191.5481 1038222.12 298671.4327 920214.9768 8856962.438 11501042.59 8071026.878 12600568.93 8024956.973 8795840.102 10763459.79 384654.5956 7232031.839 13203149.82 11521374.32 2255822.946 7647557.098 9345798.527 12860734.87
8-iso-13,14-dihydro-15-keto Prostaglandin F2? 407571.7874 505958.4642 697483.0753 486984.7313 436897.3802 840159.8781 1044644.679 1651150.703 5075438.749 1694329.135 6518417.178 3826233.096 6742583.886 3402540.583 3880767.331 5493262.806 4326351.694 6461154.629 8946042.082 11022700.22 7821495.929 18740466.23 11448926.35 12711960.73 21862463.59 6965220.906 10292133.07 13633499.24 22481924.17 13964034.32 95070023.79 26252217.16 16158727.71 40246735.67 20781798.67 27028633.98 668145.323 549822.1341 610780.9974 706787.97 1286013.234 1320841.903 1125210.318 1006596.99 490665.3612 5304830.872 4784093.644 3613242.59 2781548.979 13877021.05 4767181.589 5757053.281 7099624.334 5783500.733 17967630.26 5316909.044 11008329.12 17816955.72 15428639.3 9756041.565 13280851.27 109963154.1 57735618.74 60312179.2 22041865.98 10263266.3 6206914.96 2340081.222 7360517 1394546.418 1458443.658 11418688.84 8445991.066 9914822.102 8526445.459 8112795.633 32656281.94 25751750.31 35658870.8 16952680.86 77785876.07 40525416.15 45552257.09 65327912.02 59112807.2 35205727.58 41028013.67 43642416.86 4324941.624 35596900.28 52235631.35 73299303.3 29836976.82 59980226.19 68430170.81 72954550.7
9(S)-HpOTrE 3681277.768 3752863.882 3099839.606 3616670.261 4174870.598 3214202.731 2106226.809 2969664.4 3247869.955 2802952.658 3291958.023 2778030.991 4647299.839 3609267.494 2598932.931 2343415.449 3219831.005 2600258.79 4242499.747 5691409.748 3319398.447 4577505.284 3060721.985 3612608.192 10358013.62 3927726.948 3472522.292 4908192.176 3351562.982 3367859.067 36992824.97 6879174.986 4063654.625 7886111.397 6810387.577 4438733.222 3365325.032 2465183.997 3491958.901 3176041.893 3590609.061 3451175.516 3818848.667 3289862.532 1229579.28 4070575.471 2954407.611 3084620.701 3634352.402 3960514.241 3798276.797 3959018.361 3187434.171 3231098.656 3307560.338 4136306.121 4917625.249 6044627.59 9515621.348 3303776.47 4251351.586 29775783.26 16933073.37 16627054.36 4891868.482 5897402.322 2773007.978 4088817.358 3397888.497 2714484.786 2830044.646 3302450.373 2428015.248 2704737.075 4360537.611 2845476.929 3582632.395 3707531.056 2822546.434 3821748.602 2273409.301 2997057.502 3200293.273 3460394.041 2525341.878 2885045.232 3520556.879 2923326.898 1014176.169 2226550.72 3465479.225 9528960.844 1571068.209 6631316.981 4143205.352 4489890.411
9(Z),11(E)-Conjugated linoleic acid 262033462.4 328438628 169587854.6 208698044.5 260047729 183250434.3 321870605.2 278131961.8 199470826.8 276297707.4 353325551.6 238659342.5 385573462.1 421969631.4 202068670.6 208986591.8 336325950.4 294247913 501661732.9 446137543.3 325442052.3 534450714.7 459342674.8 323430680.5 474425188.4 410524573.2 334906198.4 329557790.7 413490725 341752813.5 499915613.2 433402897.8 296804522.2 328711579.6 291114904.3 284459810 216783724.3 105063107.9 205949339.3 148563386 160699377.2 186723582.1 193681781 179936044.4 27493784.46 150489156.5 255895827.6 217170197.3 199146944.3 194069807.2 154453572.4 233038940.8 305391902.9 298782061.7 297305359.3 271172788.6 328892424.4 276849179.1 258746373.9 277089576.9 301410505.8 293091896.6 229430236.4 360607652.8 235197413.8 316681531.8 164975651.1 159790377.2 131357783.7 120448640.4 128517116.8 173664586.6 154726719 150828025.1 197779287.5 147432464.1 229216663.9 263199321.8 222601399.6 155986584.5 171672709.2 246944075.6 252004999.2 245388731.3 259939489.5 256211042.9 328599536.4 242726631.4 25801889.82 227664356.7 329746213.7 284106453.2 120061380.8 307566798 391436286.1 307885607.5
9,10-DiHODE 2570357.064 1951388.506 2106895.535 1802702.493 1756934.871 1427431.123 1615003.264 1807712.513 1720684.557 1457721.113 1743018.906 1890404.422 3118609.611 2418955.284 1656232.879 1565462.591 2395603.615 2005438.806 4482150.406 3426729.264 3805437.073 5921777.223 6822362.639 3862227.776 26667513.29 4298975.866 6699752.134 9188795.225 9792821.321 3256559.19 62594876.57 13133608.12 12892771 14319424.37 13703743.74 4356891.219 2286061.946 1270169.641 1869853.585 1802600.952 1674966.36 1726693.516 2209128.007 2015652.981 862298.8812 2627747.737 2950425.962 2731844.392 2096466.893 2776180.22 4025626.951 29691034.38 4072063.19 2433172.808 3570604.864 4576396.201 44823940.35 13898779.98 15625548.48 4200291.212 4990980.392 88238014.89 29910176.3 43484662.81 9109572.038 9436850.383 1760368.902 2831743.063 1921984.531 1837320.372 1876171.408 2033823.318 1728140.993 1760667.105 2598107.468 1767668.13 2144065.657 2170422.662 2023163.772 2819433.619 1740525.737 2431665.279 2479086.983 2991244.17 3626727.229 2533258.217 2692143.382 2242228.462 525385.4185 2897513.878 3200807.223 10052893.45 2489905.589 5715025.355 4109945.356 5803463.321
9,10-Dihydroxystearic acid 4001542.234 4979205.917 1811738.178 2833991.598 2063619.787 4523241.406 5106555.433 7116998.042 1822851.942 4745016.561 2147388.591 4005649.21 6419811.445 6978864.843 3305181.608 4241078.171 3747483.711 4998036.128 7498279.475 7029868.297 3522573.567 5990511.736 3659290.585 4874438.153 7587592.13 4748128.568 3191797.618 3638006.547 2091449.664 4392353.653 4872966.214 7338752.312 2716651.383 2970872.486 1459623.733 4840816.48 3777609.551 2209243.239 1816777.895 2062989.721 1842313.617 2937212 4211098.679 2489967.497 1737082.4 4500346.92 5912346.885 3881469.119 3171227.123 5474980.214 3850336.2 5390208.605 3785949.988 3128063.431 5207869.912 6294015.036 5251317.652 4991722.832 3279961.808 6059356.996 6680020.415 5862758.921 3876861.161 5898234.817 5869933.351 6897302.103 2570145.607 3908371.663 2456140.862 1258023.801 1296614.002 2362722.648 4196071.852 2829701.537 5198520.482 2510827.528 2351465.825 2175719.36 2017248.981 5434739.075 3077068.861 2469521.714 2752557.074 1945013.713 2730733.785 2174954.984 2913371.172 2717936.412 1074893.333 2202736.653 2744830.106 2598520.618 1392239.508 1782165.397 2540351.631 3099382.31
9-Decenoylcarnitine 1593287.27 1248735.484 1487446.758 1412327.433 1415153.793 1168208.098 1021656.633 1314575.179 1155347.691 1277851.263 1291608.022 1250446.022 971721.8583 1004744.83 999777.9366 804180.4803 1364105.274 1151713.817 1101675.781 1452458.002 1113238.423 1216932.133 1100076.408 1327562.79 4597255.482 1277675.124 1163597.529 1512663.462 1198927.892 1380443.61 14338725.95 3870972.549 1892306.227 2728361.91 1188442.624 1422071.929 1276747.535 931885.2607 913084.4684 1127886.967 1314441.472 1083845.457 1157235.955 1144488.554 644977.3253 1273380.635 1228885.201 970873.9976 1370222.186 1235498.513 1077659.804 1569342.404 1342207.308 1286631.42 987418.6249 1074305.583 1691128.924 1675467.749 2051915.452 1119435.099 1260661.8 17362408.59 7023718.972 7023725.08 1721161.947 1051466.855 1162457.077 1618394.999 1121719.437 1165637.631 1092473.036 1322462.157 1014991.172 1236832.846 1520753.776 1079630.564 1524381.896 1434237.642 1287901.283 924878.2575 1087226.511 955408.4616 1152136.054 1143971.265 1285901.447 1156043.035 1302864.944 1445693.883 561953.1986 819232.6814 1144007.675 1182095.253 683053.4974 1135889.035 1151867.884 1120206.328
9-Oxononanoic acid 2220090.674 1867313.25 1658643.665 1552501.508 2352304.859 2127517.418 1900488.529 1826134.134 2334083.079 2092054.81 1988640.045 1807091.533 1818006.604 1252882.78 1949667.965 1670056.772 1529504.48 1703946.94 1474327.157 2158736.617 2126147.535 1343335.128 3265308.193 1524602.118 5461705.039 2143674.678 2597827.055 1846349.216 3174569.511 2508717.089 9343370.384 2651071.31 3165773.585 2887193.741 2476700.48 2289436.842 2249337.335 1456245.792 2329662.651 1972943.408 1723765.061 1106708.732 1712038.431 1782390.302 1240841.185 1318496.823 1686420.84 1975058.324 1831196.312 2150238.067 1011069.127 4303502.658 2048855.696 1642143.948 1762687.437 1425737.718 6008835.173 3812451.697 2907989.037 1996409.349 2136780.529 9762556.287 1804170.627 5188112.474 1525543.913 1256123.691 1863828.94 1939969.968 1742097.555 1364943.24 1418864.13 1719621.861 1267060.21 1690323.864 1555188.687 1481578.817 2477737.992 1990526.345 1979447.15 1564190.773 1718570.461 2202117.97 1472165.881 1852374.622 1694810.51 2140223.503 1893125.02 1827854.511 569792.124 1245825.479 1964949.197 1939446.933 772382.2052 1894251.311 1512304.122 2007020.385
9-Pentofuranosyl-3,9-dihydro-1H-purine-2,6-dione 3322248.515 3434084.115 3161998.791 3109294.067 2885261.001 3227726.854 2918623.624 3688976.485 3070016.287 2545254.319 3051048.414 2594549.359 3030237.473 4630560.705 3076376.47 2035738.617 5148040.321 3470496.201 3655002.81 4438137.701 3764100.368 3500919.213 5492542.485 3919432.006 4030992.64 3910531.772 3798816.211 3743798.81 4434736.092 3948584.531 3889396.031 3737108.525 3770198.258 3599890.101 4458418.27 4413083.438 3366540.744 2707557.227 3192277.705 3532796.86 3565014.851 3201016.408 3362774.38 3016277.533 1476237.222 3373529.621 3089092.167 3272911.644 3060992.275 3340670.513 3239386.116 3575655.705 3784358.366 3647083.098 3907921.943 3849392.537 3736996.714 3914617.386 3660214.439 3619414.375 4156904.144 3604395.322 2929414.197 3794571.885 3847603.103 3765083.905 2822286.282 3049211.125 3464374.84 2692286.805 2917667.829 18274439.55 17124417.87 21236065.07 39336474.47 41998531.59 18706191.76 16031872.08 17477803.4 1909593.661 47421245.86 23273886.31 11953674.75 21100155.29 55904863.49 6227817.784 24185073.26 5656554.475 838209.308 1857925.464 36850419.18 11867030.33 1312239.572 14981934.5 30378289.39 22330274.06
9-riburonosyladenine 213143.1189 289623.4274 229857.0939 222545.8559 202151.9008 222697.3483 224963.0125 1417446.759 611718.4071 301644.8398 971760.4916 255687.3366 312817.8425 2186174.573 349294.609 406332.6674 1219848.826 349810.2523 367846.4308 1421756.553 397031.2541 1273496.244 1788284.593 1194898.065 3550898.959 1732094.991 4699644.707 5684647.497 7050782.666 7645120.34 8007271.168 5574848.214 12906858.69 15239880.56 14693092.32 24009757.75 306089.1445 185728.645 251394.1712 262532.032 251498.0409 614542.2781 243664.6052 426827.5377 151372.479 871346.1077 363115.869 285741.1678 345324.3715 318301.4698 318130.4175 372439.89 301597.5461 291675.1979 350799.3305 337105.9053 399804.4792 1265365.894 1626515.716 368559.0283 339289.6334 929372.3077 2962664.698 4445282.652 1525760.043 588137.8722 482374.9464 584374.5774 611709.8079 231159.9046 264952.931 20444864.2 21650939.19 16771905.73 8567004.899 17272853.85 36129616.45 57847755.47 39105903.55 17845319.72 41347080.08 54426792.71 71467012.7 72444186.78 61154620.15 41838303.67 60662506.04 77795153.18 302609.5279 40338415.39 48707592.81 60033120.54 9595399.547 55462620.79 67694010.28 17824210.48
9S,13R-12-Oxophytodienoic acid 2721422.306 2186925.671 2509390.328 2386437.049 2344417.493 2180378.112 1718772.596 2279054.958 1790242.664 1924186.267 1924688.758 1916656.656 2061262.281 1543124.75 1422404.652 1112035.73 1871298.854 1573827.018 1505197.691 1901936.396 1478923.045 1699165.718 1397046.914 1716091.563 7059408.397 1608127.249 1950657.456 1882394.384 1632605.344 1745159.859 22600401.98 4867813.884 1634023.389 4634649.461 2249762.292 1714700.166 2251003.17 1632450.083 1642789.341 2251075.808 2305066.95 2251766.74 1985088.321 1789851.617 882437.9519 1969620.174 1768448.372 1532098.552 1944471 2063239.295 1515684.471 1500246.025 1783658.578 1704487.134 1445860.736 1414721.276 1629756.384 2909668.314 3665038.391 1416529.243 1592308.822 22621604.9 13794698.42 10152895.22 1928280.977 1275228.874 2092019.96 2802930.583 2715817.641 1864437.895 1752081.28 2114794.615 1489526.057 1806051.963 2635528.548 1624046.474 2075186.213 1945256.544 1978517.915 1972273.938 1459060.125 1600465.999 1619387.928 1583277.08 1750402.742 1482193.665 1657761.517 1797617.862 697831.9191 1081026.35 1424883.752 2735243.299 682224.1058 1949543.46 1898530.498 1761876.145
A-12(13)-EpODE 8438588.419 11863463.59 7102758.865 10082243.2 8533150.755 11363892.94 6588674.985 5413143.554 7427499.01 5868081.218 11236121.13 6049461.611 11049475.08 4224570.195 9498804.749 7506433.219 4683754.418 8775788.512 9550361.096 5374448.006 9453297.88 9712192.666 6527495.412 5325032.842 36050676.56 10425653.8 9489101.466 15685520.23 8598582.404 7079786.455 120901906.4 23273127.41 17922606.56 18826373.36 10668639.45 10102742.87 6891338.78 4844863.546 11752771.9 9903333.105 10415284.09 13411573 7257426.649 7786406.94 4664390.223 7478214.48 4984502.772 10514297.11 14607590.52 6371337.283 7135972.71 14808668.06 10762557.39 5546069.578 8326285.597 5767873.699 13067493.46 15780785.25 25072108.45 5758277.879 6123287.016 107443262.3 46701436.73 64438202.92 13325262.87 11227773.51 7461980.256 9135743.525 9563412.034 5124943.779 5878822.213 14653251.71 13825876.44 10271914.91 11517603.85 11956931.95 7765282.25 11018145.33 12064008.43 7263500.576 12205585.84 4273853.523 4526559.551 12872886.89 10912532.78 3866998.48 9042360.667 8500472.842 1227574.824 5150177.239 9099874.774 28091945.89 6282647.965 20835979.28 7867802.905 19772456.17
AC 45594 47088091.84 23855827.85 50089696.46 36519924.51 49511377.79 38443052.51 31450665.26 48524848.57 48619441.04 39421335.75 31047285.38 32997470.27 24062355.95 23382146.59 25581996.12 23508579.47 32299500.79 39578916.63 21294582.39 36041936.01 39472543.71 22451805.37 20163307.93 39911041.42 40490849.49 33699916.78 27981013.15 52266854.26 43398421.19 51657581.61 32219028.97 17063037.77 41635263.29 37454971.7 34772149.37 72856089.06 40074314.47 17737942.92 20828815.32 35399580.75 48016090 30721245.47 43877310.72 25381031.72 6890374.935 28529335.12 40958907.09 38252564.45 33342868.05 47648923.48 24106245.4 31646134.01 32078128.45 38456820.31 38727838.19 19429115.43 24683532.81 44372644.48 34327656.88 36090839.48 37164762.55 19585965.62 14738688.26 44263039.58 49375050.56 27505839.89 46843983.6 65177394.86 28864778.85 33025348.08 34250008.98 42477816.28 39273739.04 31560367.79 45061085.36 17158065.15 58440982.83 36568033.14 37290720.55 18931929.87 28624330.75 27246159.34 28179593.39 43127198.85 25187066.01 42814765.23 33529108.75 49004646.71 1776781.958 17362930.19 26414191.88 24264725.57 6489647.079 42143368.51 49388747.79 35317479.65
Aceglutamide 491402.0481 443222.6305 796755.7574 311559.81 260561.6174 280490.6977 727042.9119 939406.6354 1013112.926 1114444.991 701545.111 1058512.41 1161441.141 1096969.276 1333185.917 893650.6488 452571.6868 955617.7796 1086811.659 1698709.807 2197571.995 2118665.527 1771613.359 1484989.026 1392633.484 1216324.817 2188537.733 1489406.766 1369908.842 1875715.28 1262671.012 1435369.614 1960186.018 1422552.996 1627689.555 1967551.899 787978.0924 754682.5052 419533.0492 290619.3498 402736.1035 848179.5228 343116.3069 941325.5831 649716.3865 1122246.607 1599952.307 1253775.907 765175.6073 1444209.501 1333405.233 1610792.076 1464437.916 1102658.262 1625799.896 1994884.351 1487905.841 2200082.436 1042461.337 1095532.001 2002223.149 2110370.49 1578344.83 1292002.19 2047219.589 2084542.438 540403.9363 422798.3705 700081.2642 680437.5915 484493.8957 2532870.69 2758022.421 2477371.572 3296395.393 3383449.28 2834294.906 4150257.828 2798322.777 3046609.759 3023084.377 2910659.241 3880950.166 3385372.533 4436507.383 3899034.08 1959022.668 4217191.736 434517.9575 4549752.447 3957193.171 3242304.203 1599053.528 3463697.394 4856409.392 4591224.269
Acetanilide 2428307.549 6730328.887 7995107.435 4616274.966 4744054.654 10014738.68 3181153.779 4682866.741 10221018.63 4538222.218 5056207.285 5240544.056 4037178.135 7807249.629 10850053.1 9023401.947 6049897.156 6574198.428 4037916.324 4771832.967 9747683.671 7042562.629 5556743.653 6281788.2 5146954.62 6387373.056 11958657.93 7758419.116 6062506.742 8221484.45 7705035.984 8425452.175 13720369.98 7307289.261 8326245.567 14008113.33 5860095.285 6917131.078 7655518.023 4758179.57 9279466.042 7127187.515 7394468.954 7348489.713 271983.8335 12129886.47 8586646.616 10341033.08 8644445.492 9449668.267 10969566.59 8180924.545 7016032.318 6179530.41 8468652.144 13657510.53 11650957.45 11082930.87 5988622.439 8617894.173 15873525.98 7482188.154 9673141.354 6852312.176 8568665.297 13140777.81 5776587.843 5344738.035 6336972.109 2551797.212 4715754.149 7396755.862 8159284.574 8611876.684 5334558.455 5927886.28 6405811.694 8682876.957 8143181.173 6028640.442 6708509.121 7210275.743 6667434.105 6610840.224 5842834.057 7763786.141 8093926.881 5350460.54 1105709.607 4554417.92 6436797.121 7488041.109 1174051.187 8432476.866 6015975.541 7915264.919
Aceturic acid 2697804.328 2698864.698 2820900.473 2609618.604 3285315.286 3026032.917 1470087.48 2055359.575 2192869.359 3832563.467 1740625.549 3328124.374 1846674.476 2645311.17 2212370.346 1655649.618 2821318.979 2103397.414 1755987.782 2140424.285 2903941.118 1962676.398 2523959.538 2119422.264 1890386.605 1572130.791 1754258.737 2399823.993 3252418.983 2597076.768 2033032.3 3349238.205 2686206.547 3158333.955 2558409.446 7245541.344 1444533.837 2540005.605 1859592.531 1825802.554 1703813.755 1478591.243 3049499.471 2723615.16 779716.026 2402503.3 1608504.64 3736242.57 2817212.802 2673048.968 2279732.182 1358804.57 2853672.045 2711838.519 1977501.077 2496539.101 2082944.035 3205082.5 2470707.914 2173503.06 2571872.222 1180751.424 2735257.152 2013764.282 2208920.111 2416476.537 2658048.691 2118694.654 2499339.993 2240760.28 1652269.956 2024920.446 2402841.408 1705486.862 1814112.286 2155635.727 1815739.019 1722605.09 1182594.79 1649292.364 1398078.802 3751833.156 1923578.947 1911212.685 1901463.153 1190769.913 3167792.493 1644948.537 1371519.054 1829329.058 3077163.12 5148645.817 2857375.505 5382289.962 2630601.835 5591103.474
Acetyl-L-carnitine 1528702705 1817944860 1645526621 1865657964 1533889077 2053429858 1313749200 1617706117 1174890960 1007083336 1208429647 972234106.6 1952547737 1656720983 2025586151 1384531265 827137322.3 1334594160 1132676288 941932331.1 1848708430 1091754976 1111141341 1050545436 1373786933 1163427992 1280607557 1288030896 1241964437 1622816739 2130671123 1461486948 1331162854 2123597677 1248081351 2527803140 2137547042 1720760274 1903251100 2310557643 2658993766 1015290313 1642598362 2006268367 616764608.2 2461504983 1933654857 2268044118 2327346725 2357102139 2621168897 1139909061 1266168088 1627467546 1850993878 2299763500 1726252447 2039204610 1398970376 1443712733 2256851764 1311086213 1629585539 1450584355 1919402603 1586662589 1887660824 1796323937 1966701870 1395839570 1816150430 2216982478 1971301728 1732148522 1682420355 1679696877 1973743650 2032202199 1308147829 657626392.4 1545512494 1674043934 1475423830 1647605237 1024074606 1119068548 1692984185 1569774851 420463.5698 1464859969 1111562581 1700435999 831735582 1471728473 1133257957 1454990431
Acetyl-L-methionine 9991760.225 15827512.6 20810844.61 16158548.02 6918333.322 11756556.78 10479965.42 12534698.03 14963101.92 15200258.21 12623369.56 12561491.92 18050972.26 16824320.54 15329805.7 13295564.04 17624072.1 19328527.31 12046500.46 16528717.56 12295122.67 18638707.17 18591950.66 19294823.04 25368366.11 28470095.76 18567266.33 25619343.72 30106396.84 29579801.4 33563270.27 51054389.88 26292101.34 24759598.32 27872534.22 37174423.12 15230284.49 12472521.41 6852490.611 21624534.34 23642378.78 18131857.49 22489266.55 6025964.846 4571003.705 23878873.05 22846171.5 23162331.58 9875967.313 32971490.27 29953245.25 15220365.66 12784957.11 7185130.339 21877841.24 20538586.7 40702986.1 17556364.35 13977922.85 33770716.73 39261807.12 36368724.55 18520039.84 22900108.06 52655903.45 45946355.9 23290206.75 23701639.35 30967860.39 14245380.18 23778805.05 20229150.05 19256592.78 17690390.03 15746312.12 16501691.05 9676371.87 12871096.75 11799299.46 3233294.447 11258884.69 4238224.71 4635405.153 4131199.092 3295822.949 3385691.961 7969016.393 11365652.56 380765.8496 9131748.914 7993864.689 14748237.27 3708042.747 11956657.65 18089212.16 18820146.12
acetyltaurine 4317119.192 8155753.463 8060553.114 7584023.173 4663651.799 7224552.245 4642439.411 6742704.307 8881656.611 10380760.17 6290628.97 8578236.646 5125268.148 6738517.169 8687579.978 7528584.507 5767847.332 7286725.076 3987723.647 7298215.86 8015680.865 8520256.096 7086021.561 8221513.798 3651797.855 6536770.086 8925689.216 6199354.562 3945721.674 7878664.105 3535614.439 5885815.762 7163067.517 6504193.741 4280004.546 6422429.377 4293196.637 5054949.859 4511659.517 4951945.624 7223433.01 4487464.975 7084681.426 4140686.772 2835388.02 6314194.839 4852496.562 7009572.434 4235042.833 5921797.385 7058796.346 3642041.02 6290760.202 3591880.059 5907393.783 5806379.898 3932604.047 5014589.122 3721431.652 5195926.017 5831150.429 3632941.104 4460982.802 4533128.625 5439933.805 6200497.539 5277420.028 4819877.827 4794532.658 9060672.966 5232221.752 4298205.778 4718746.009 3052307.727 9970416.912 4358190.117 4787736.108 4911692.038 3581299.259 6158944.885 4571316.77 3498323.608 3958100.992 3335596.386 6839263.42 4007608.209 4078325.667 4634344.487 288945.7935 6734082.421 4666239.28 4427446.352 2171599.314 3202915.101 6660785.931 4283967.586
ACPC 2322001.117 3780529.374 3900720.148 3142375.303 3350474.908 1590087.929 2425699.401 2852785.188 3520272.049 3827825.438 1932217.936 1441282.943 3042522.287 3214764.923 4218368.503 3824262.137 1978671.525 1914513.001 3333707.03 3786118.849 3603601.723 4233599.256 2071441.614 2148597.933 3770834.058 2891714.454 3788333.429 4637689.629 1540480.18 2247730.694 4119310.799 3860917.923 4482689.708 3910102.882 5138150.091 2794377.11 3694496.196 2622816.61 2529273.945 3641206.122 6927822.625 2590195.445 3787553.151 3473134.248 2911205.784 4120704.509 3747231.705 4305703.377 2824214.098 4270187.237 4298614.784 2391983.984 3217291.714 2388137.358 5596690.531 4234981.349 3909542.226 3683610.999 2240110.243 5741379.426 3206030.486 3139292.892 2776218.185 2278535.849 5102220.098 4931107.184 1249435.026 2842324.278 3469081.365 1728958.993 5018698.35 5373636.373 2781593.345 3139143.375 2650398.132 1772694.955 5416863.889 2905412.498 3181097.339 915391.9871 3215515.013 6646942.094 2437457.841 2840617.793 7291044.303 2979991.609 4944686.327 6218839.391 2111904.232 2811367.236 2767055.076 6017824.915 1681125.104 3118715.638 3599834.759 3975112.878
Adenosine 5'-monophosphate 26849272.18 26511992.18 32943387.42 28157424.27 20253900.76 27133689.43 9870753.284 34464565.31 25967479.49 11838266.2 5760486.15 8767870.754 12526322.8 22477975.65 25897181.64 17647311.47 3732230.863 18050697.55 14715848.76 25987232.78 41357919.58 43390214.16 8665159.711 40133228.51 47579727.83 21739329.55 105355645.2 72325663.06 48237951.65 79221282.54 49113236.4 14724382.56 91979796.19 42751846.67 38234182.22 73971029.61 43826957.33 30509889.06 46604259.85 50565191.5 53368550.17 4737886.583 10111397.52 33814523.5 2142592.119 27713659.95 10667538.61 15877235.43 29013439.13 7649502.187 23441495.35 8497085.148 8220163.204 27131620.41 9500663.825 25519610.68 20797500.82 84480746.71 95495452.73 17068362.1 16647633.02 26435276.36 65810158.41 84309244.36 24491115.86 12069078.57 33118660.37 35195612.69 45219035.83 53563423.02 52236997.73 27753373.79 31449683.87 83330943.42 261172114.9 35445900.57 171375867.8 195505197.2 5277342.53 27798500.51 126967602.3 15449687.87 39235157.48 11263803.95 22935413.58 10472600.96 13620937.7 15894647.94 468877.8701 4914121.084 10885553.74 15886528.25 1242241.722 13110060.51 6437078.273 5037385.728
Adenosine diphosphate ribose 41750713.94 62859949.12 53443894.83 56931437.1 56546605.07 72581549.55 22786598.78 50102683.8 48837344.32 22500784.07 16345866.41 21833231.28 36243086.72 46151838.83 45035815.48 28277437.82 21734620.47 37982268.48 42218241.47 57723425.32 60791937.71 43250998.6 25909609.14 39719330.13 19916551 30257558.42 26385485.75 18412598.68 16271264.28 20400884.51 4064648.85 23243286.98 9468165.41 5698161.905 8973037.969 8952849.571 58933292.09 55052469.77 57413531.02 48784012.59 63929956.72 7276519.956 18955887.6 52685087.16 21076123.03 56473774.09 30859146.47 33859908.42 65373433.36 38633439.7 66953577.11 31842482.8 37210959.79 56423305.49 41007202.54 58990306.93 32620934.1 26623467.79 32857722.77 27549729.75 42192708.73 5444744.98 10737018.06 12551865.52 22440816.38 16906531.31 39557439.97 41035453.27 154573954.8 49426497.16 71006077.86 5344504.087 5966972.648 3786298.148 7016393.474 6331925.324 4879275.662 5646297.414 3711389.418 3005920.375 5868107.858 3176412.101 4970344.743 4055559.909 4422745.8 3876563.98 4457953.45 3863542.958 768431.3891 3147935.99 4269412.768 4777642.135 1609549.335 3373249.241 3556976.844 4419865.705
Aderbasib 391151.8099 1530883.424 661284.1842 1749078.696 966553.6826 5209972.134 756865.2538 1312692.676 626667.8414 2702219.973 1826060.293 7307047.876 778490.1538 1592992.784 244020.7827 1950610.957 2221378.051 9129177.691 689617.9523 1382017.241 846813.8388 3218786.561 417089.7721 6872800.343 1130379.94 1390419.116 582277.1208 1526012.7 1435975.336 7215740.485 1252104.377 1515389.295 809746.838 1436285.321 826601.1327 6192145.468 7034259.733 965061.6463 8554573.704 16473522.3 1193169.501 9332209.636 3025314.366 7181079.602 3908029.589 1068952.423 11407082.14 2866082.34 9286157.749 22966991.18 1976228.138 7620859.107 2307475.372 6941361.296 22759177.53 1315626.38 9080867.994 2262108.445 8840455.725 20157015.27 1498526.44 4571825.594 1165249.314 10290299.92 15706080.1 2099493.077 122097.3051 240629.1183 341064.6474 1899714.358 201828.8578 416327.5816 265705.5327 306302.1596 3059385.675 287380.7273 79421.63782 298646.0369 298431.226 1179035.966 340584.0195 106979.1512 245415.5716 463386.4793 2190738.805 158682.3241 548794.4535 243164.3315 41155.56359 1284134.593 392735.8723 293711.1914 166060.8485 121369.1523 2230446.009 368367.7391
Adrenic acid 5493700.449 5119502.226 3842406.534 7528426.101 5674131.794 8864046.914 11042587.01 10298635.09 7603319.744 12479616.21 13229259.88 16169653.95 23744384.17 19870747.15 11074540.47 19968773.57 23187080.84 32901311.05 22360988.33 21352144.22 17172284.67 40706984.45 21328725.39 59022586.03 34165038.58 15521879.64 23613045.19 22739412.93 22723077.73 47763329.61 34915281.24 25034336.5 28904775.94 46315070.65 31854417.67 71599612.58 6921767.596 3336850.382 3995889.028 5392378.937 3697778.477 8757591.442 10952733.47 6803004.336 1316048.799 5544595.055 10492477.52 10713489.21 9280441.576 9307519.044 8864064.268 13969832.04 12554157.69 13359409.26 9159181.752 9691842.697 18532550.1 19775299.09 20400559.15 12819358.02 19476081.15 17585199.83 10393414.1 22596512.22 8866860.477 18124901.28 7382266.543 8028521.759 4674131.296 2844987.767 4102110.054 9115268.171 13170608.76 8835312.41 12389464.17 9934850.79 15458994.32 25398196.6 16031993.19 10831217.87 12092751.46 39983041.23 31456059.64 30065298.8 20428545.35 16710284.25 26436242.44 32889271.08 1571966.286 23199531.28 28993403.94 23812858.31 8923720.766 30428474.47 37448733.31 35899963.64
afegostat 36370700.78 44684544.1 39792279.08 37161733.72 36468604.89 43672645.84 32545536.18 30106846.74 33517745.19 34609887.84 46560661.73 35746319.89 39319018.98 36149668.21 42847735.43 31483045.44 50293776.39 39736022.59 37860467.25 46291926.51 37777917.06 34411802.31 31982432.25 30032479.67 29983720.76 19331685.59 25364927.69 33420473.37 25358469.85 30047339.21 31173205.99 26401762.88 23281784.27 22355774.76 18153896.24 37404508.7 32259259.9 34103799.31 26215142.88 38780859.91 38367600.14 22125439.79 59316618.53 31610388.21 15788916.93 35767270.96 33450039.88 36175628.48 19997846.44 44959431.79 33611059.6 24413863.9 31939506.84 20639563.37 34355675.58 32385014.49 17352873.93 24777766.53 12877008.57 38558309.59 24178118.86 18002201.94 22869477.28 13723169.66 38376687.27 26735616.96 27469983.6 34770449.85 35422714.09 37480182.05 42604804.23 30305464.09 27367074.59 23732887.03 27806469.03 17939353.75 19693589.51 31259946.87 33844753.11 17592805.4 22752764.94 17213948.55 20560517.59 31923477.12 26140344.14 19287135.62 22875378.73 26696017.12 3277151.502 25382779.73 21009034.68 19355133.95 8282248.611 28683511.75 31523604.48 25458255.49
Allantoic acid 22500757.92 9300412.019 7605873.679 20042523.22 15952716.84 16383553.04 11862434.59 22817508.63 22526234.09 16769308.33 12969032.84 22650032.33 17152977.8 25381773.38 25913193.11 26754332.78 16268513.04 23383189.62 41441904.12 14672666.56 30508473.79 41373837.23 14951628.26 29482407.38 23039297.2 24696356.25 30184683.42 30309381.93 23387127.69 26160374.46 47316641.54 27601615.13 39557149.45 35717090.67 22360527.09 33792917.95 14424994.59 20519953.15 16699989.35 11226298.36 26705340.43 20996116.35 30035127.19 17675864.92 12376715.95 23307161.09 34904826.74 27970540.11 21754959.34 28954394.96 29713861.36 18656181.92 31996455.73 19995289.85 27903563.58 26445942.25 28234818.34 30301921.26 22970565.93 24661968.94 26385116.72 25496421.02 21463270.77 27455375.58 24642163.57 25389794.09 21404531.98 7751989.357 23584751.04 17756189.9 8404748.641 21715334.83 20943550.83 21924770.82 7947725.44 21082114.37 20750441.3 24038186.32 23339120.54 14708630.61 20321579.06 23049198.69 25763770.84 26078235.52 21292592.44 24209361.09 24714669.65 24933619.75 4866504.248 14666102.59 24697000.85 24840767.37 13099240.61 22546996.22 12764100.91 28797590.32
Allantoin 85335523.01 122536023.2 158349466.8 157938133.7 124995687.8 179522966.7 94038979.69 109752798.7 137458048.8 172350412 134662855.6 190681521.8 99777775.62 109311618.4 134717326.5 156769259.2 131095571.7 193849530.4 88445807.59 106479457.5 157016648.9 170340700.2 117268260.3 188094303.2 88227045.35 80525510.15 127019690.4 138586957.6 112974152 159942122.2 87714079.7 91147019.45 121386795.6 134342146.7 98845141.74 157762995 64213007.73 76060853.32 43804750.27 87981218.79 81956894.46 71844596.27 91126982.69 48073262.54 43862285.38 75935854.13 73116508.62 89089212.81 47015927.8 85440494.84 76156684.71 54268350.84 78485374.37 41732491.12 84868355.8 82967396.46 54677715.56 75436416.86 46050654.63 73498081.77 82785021 47136718.81 71302841.86 43749010.6 78549713.15 73932488.98 54109162.26 65079821.34 71381788.07 88135277.34 77670118.66 61491329.2 62127606.51 68881717.11 109637203.3 80544988.32 57276362.79 70893620.32 66031720.94 66781588.37 67082641.31 50525342.93 65374736.04 62463501.71 91210151.09 73780103.91 60421495.78 70977854.89 17522300.29 104622170.9 75266032.5 69439824.39 34856272.9 62824736.99 92200661.96 82090759.86
all-cis-4,7,10,13,16-Docosapentaenoic acid 7012540.49 6516740.022 4073733.422 7510835.292 4875813.287 5379968.022 19851435.72 12620224.33 8534928.615 17106075.3 12691023.18 12724193.71 36326189.03 23873783.89 17327087.97 24450168.9 25458658.25 32793337.19 43127401.77 26982609.17 22415393.58 60264717.52 30414615.92 40467996.2 47716950.22 26484365.56 17315311.24 31649255.72 22173338.6 38993812.14 45076328.38 30105560.01 25639921.94 43430216.09 20580570.31 50289647.6 9793360.093 3123011.952 4168160.604 2763748.547 3566908.012 15324041.97 12875278.35 7584951.186 751901.6413 6366843.576 15574153.73 13503581.69 12793211.19 9895277.335 7376608.226 18179141.77 20775232.9 19235190.44 11069543.94 10582689.88 27347519.41 25277562.88 17406948.86 13192203.43 18032285.68 17773992.11 13900832.25 21637143.03 9498283.206 19407160.92 7012214.65 7077314.563 7714726.711 3674492.778 3456815.877 10185352.83 9398830.414 8878379.882 15864348.05 8529685.312 18827301.77 20236023.26 15167949.35 9935992.541 11103239.24 31574483.2 41058996.73 28741497.94 19305349.51 12241774.03 26204013.74 26815827.52 1142411.311 19887943.11 28463364.72 18994977.7 9166546.606 24061397.96 37853041.19 35616159.52
alpha-ketoadipic acid 13779211.64 7779939.285 9983369.236 9027094.577 4697444.415 11296100.04 5382114.576 8594298.047 8529924.152 7166723.449 21359094.12 3011642.83 5868754.995 5692804.582 7181990.735 6520886.838 10785453.08 10673199.27 7597778.335 3599697.608 11463590.35 7126220.679 13923633.04 13248680.39 7390581.928 11616479.75 14551353.62 11540328.14 13752016.28 15027938.53 5266534.554 8659436.09 13659572.01 8152618.104 8879844.308 20990378.2 17007590.78 4205354.784 7126184.48 795386.3762 14232572.73 1951496.498 5683590.052 6242282.954 2666203.554 14530485.27 3611454.055 4862294.647 15835329.94 12284336.54 11642407.97 12378119.1 11393465 10161362.14 4762931.333 9106656.057 7347653.266 11974573.61 9108350.236 7580386.221 8911594.277 6949190.359 12292251.37 9008151.674 9592436.896 13766446.36 11695301.42 15167678.87 15273627.41 5425696.023 11389525.36 10067274.67 6409105.658 11263704.17 3155195.228 7131328.64 10702661.06 10860037.44 11461414.18 8623165.098 9213693.882 9636302.254 7105794.443 10904626.65 18980907.63 11945691.83 7658729.352 19246547.02 622226.7331 7906890.906 15409779.33 24605914.6 4133058.208 11067426.81 13251255.04 12709707.7
alpha-Ketoglutaric acid 16738175.36 82363028.16 65114043.47 71929491.94 59602222.61 216983238.7 33824359.81 74581139.43 49019223.43 131224638.9 266566232.7 265031297.3 67768788.28 126616858 78481241.29 99250452.32 150205551.5 261686562.1 53626300.05 88089313.55 75663330.77 227821793.8 162559483.9 195882841 51266101.16 67414909.37 86026683.97 75430280.13 152648703.3 260604910.1 45181708.47 63868131.76 121593782.9 61242301.24 73080268.7 201435573.3 102301956.1 18190221.7 16156123.63 59810506.94 49321548.67 114398201.7 167341920.1 44694016.69 5497727.15 67696117.45 217583886.1 224045862.3 67349534.2 94603027.09 127059433.5 91098440.94 149684417.5 49340622.55 96347252.89 82423065 105165477.9 138711976 59764056.34 66785700.04 103436182.7 57603642.54 61051862.6 58192526.91 96042184.7 93160764.37 26461327.21 26262565.49 58557648.47 40558363.62 42778847.25 27074071.33 23246504.66 16673860.35 42219573.19 20163430.37 27253152.78 35387681.4 20239045.7 20133687.96 27574009.36 45905202.14 52540023.21 56589513.71 75631933.41 31235303.71 98771043.03 43312044.99 4888573.425 20648141.79 90656087.92 157920419.5 11740641.02 102304860.5 82312162.33 83047671.37
anacardic acid 2532856.104 2592005.696 2281871.849 2450646.246 2324790.106 2547827.485 9140927.33 9105680.449 14759781.25 14855598.29 12296617.02 19859486.8 59382084.79 35948028.48 48398635.83 49609391.51 52787466.27 55158304.52 104540589.7 67961326.72 90426462 115742120.1 102646980.2 109073612.1 100917263.1 62649114.45 90525478.52 82021828.79 104912171.9 103116774.4 102394940.2 68674410.62 103682451 128527364.4 98112467.58 71920946.59 1979128.996 1536237.918 1774494.344 2458341.132 1966542.777 14886615.61 4884038.884 4789755.198 4067031.645 10360546.11 35866150.7 24923475.51 13247236.4 50661181.16 30674193.23 48307957.95 39451303.43 24413667.19 74593334.5 48273648.94 61568882.44 32925586.01 33045673.16 89713724.66 61071935.37 43902509.96 18447351.77 44929365.97 58133190.54 62241229.94 8949885.885 6566716.13 8760122.102 2638052.325 3221348.686 40004117.67 33526223.76 42313016.43 29923956.05 24932675.31 81272940.75 60200322.52 96525701.5 36392027.64 65830191.29 107528265.9 111066455.3 160166153.4 117798242.8 71793659.91 107197810.3 85545676.56 7503837.075 85266275.58 124497732.8 93653397.87 25122172.28 109276731.3 105687722.1 130935661.8
Ancymidol 3817267.11 5133250.166 6359101.549 6062370.481 6991228.156 6359248.092 4514036.274 6329970.521 4892880.667 3709314.881 3326285.76 3312879.191 5242356.32 6076586.256 5991972.061 3040380.051 4188318.832 5879538.508 2840093.279 3452519 3534894.146 3687906.955 3128896.012 4410992.603 3111343.421 3047428.425 4558962.458 3697240.324 3628034.559 4518653.983 5511799.143 4203121.21 4695340.992 6250329.095 5844091.236 12333039.91 5928291.752 4825089.834 6868533.368 4231871.336 7418433.446 2410500.336 4294735.985 4936592.371 509772.9817 5386452.129 4584644.333 5562657.98 5337765.411 3567931.702 5338079.752 2470346.651 2944476.641 3175930.227 2982630.153 4161361.267 2964478.288 3539595.225 3339173.427 2184449.659 4554462.634 3713749.883 4006925.416 4492613.783 3882788.906 4699946.521 4981738.374 6278489.346 7385891.807 6573878.693 8702590.873 6902850.682 6775111.818 7572297.406 7076323.315 6278356.25 7955518.628 8633264.697 6280893.756 2414511.224 4712120.949 5908812.064 5838080.33 5495790.659 6057935.862 3309139.436 5351365.101 3828456.342 380698.2363 4003053.461 5553906.3 5322771.092 982806.0169 5790403.337 5702932.379 8405015.274
Aniracetam 57224.39359 59552.26029 58629.90152 57740.06967 54304.6304 59493.44905 46972.10172 47540.52031 51208.87609 52219.45111 48847.1832 48516.12025 49261.41048 59609.85735 54699.952 46599.60281 48903.75347 72834.48974 45391.55431 84120.56695 146596.062 216700.7213 43917.77086 47813.59505 1015887.287 148595.9717 194160.5548 216189.6968 984254.633 508835.1034 1512113.764 1172218.071 717265.2085 463663.9655 390331.9726 679331.7243 63152.28934 53744.27881 56899.68984 64182.85851 128843.8156 52583.81025 49376.02945 47570.66601 41771.24217 207642.7467 54528.78475 65278.4424 54038.33074 132358.307 268547.9822 124691.1765 50580.18127 116866.8217 48131.81894 136906.4608 1229836.285 969195.4987 585500.4568 94456.69894 811862.234 3754596.146 1678878.671 871991.8042 586848.3634 611886.6185 57537.12252 61994.07787 120556.4486 51492.73161 56776.17186 122767.2298 48412.98958 56548.21076 63863.03564 45536.63162 68849.95801 80245.04897 61478.63107 37982.74717 41494.58519 88715.66346 201658.9521 128691.4969 115975.6462 36685.03257 108828.1906 409536.4928 28603.13483 77025.73535 118470.68 1689630.828 308384.4092 764229.5082 157657.153 425684.4301
Ansatrienin A 11681220.85 6056913.306 9356571.701 5867228.189 6953369.254 8292735.676 5423479.924 6596992.619 7051100.193 6901181.685 6241639.825 4732103.794 7034434.745 5200263.847 5285606.143 3109522.149 9295255.275 8645975.885 5483203.966 4659279.424 7092364.188 5273272.598 5462542.87 7360563.108 5473738.185 7276722.232 5919326.694 7694856.195 7772130.596 10452252.87 6990785.772 2549500.493 6027240.249 6590717.765 8193416.198 14824206.81 5826131.408 2007513.301 2172683.121 4664335.844 10477412.65 2972178.602 5503353.808 4804255.363 1009044.557 6859371.051 9131374.463 6892371.768 6423675.281 7488551.05 6341626.153 5594557.056 8120717.673 6032521.538 4513576.218 2843634.807 3782428.543 6856457.909 5734166.356 4263048.772 6794866.879 3366836.105 4841832.557 8336567.409 6231850.462 7129377.638 5095439.352 7524474.309 6359086.137 7794024.715 6130766.63 7408790.15 7124512.648 6674636.601 4025803.594 6735501.985 10792305.41 6424506.797 7652099.558 3734396.126 6091623.224 5506980.386 4919136.593 3826852.464 5902304.857 7464764.925 5492385.216 10047177.01 202103.1283 2459699.688 8071446.193 5017376.075 1564398.52 6077148.876 7088776.836 8265196.083
Apigetrin 360378.1129 2681330.87 2658122.919 1286408.681 96156.52003 407938.5421 565550.5432 2223254.627 2552994.051 1972744.375 394218.48 796444.2171 845228.4436 2441249.402 2525542.203 1545539.988 244731.542 839785.9222 396714.5733 2134820.741 2247779.884 2024268.723 124281.234 650542.1159 379332.4042 1989234.367 1883270.841 965004.1027 224253.6683 514075.3838 367292.8625 1583941.631 1748762.853 892571.1381 139327.761 383131.4549 3114789.374 944199.0603 2480039.412 4854900.589 1511386.798 5057143.48 3078027.82 2391952.063 1196513.746 1274000.687 5365142.876 2725039.26 2769973.109 6962013.812 1564182.174 3710228.661 2150172.741 1967879.825 6366803.872 1204347.895 3687851.161 1843281.956 1968109.736 5341206.258 1424650.547 2414290.854 818919.3791 2205318.934 3970060.087 1251125.127 1503973.744 1479826.205 1800716.336 7588267.101 3569811.31 1545010.328 1486309.536 1285698.94 9427966.973 3095187.913 1343240.68 1482979.136 1490392.48 3948429.945 3109714.207 1357873.388 1554320.854 1527557.9 7172721.639 2136518.109 1283373.346 1249436.741 61899.20223 4520061.125 2924588.223 1487184.086 193216.0071 1361938.524 6844306.855 3552053.53
apronalide 1335547.735 2269614.775 2558756.609 2486432.278 1029811.953 3245470.654 1127461.513 2436256.656 1552089.101 3499970.287 4602339.611 6423061.652 2423124.967 3265393.804 2586596.02 2571780.046 4304249.179 7319898.245 2452020.914 3249529.685 2969288.829 5658150.061 3574995.261 5231434.375 2066219.694 3035462.849 2788100.022 2138376.869 3653030.957 6770143.199 2172889.709 3041272.066 3101214.823 3325501.161 2969010.526 9116109.73 4843486.383 632831.3421 704438.1416 531481.8966 586107.3475 3406911.131 293943.1038 724647.0671 469900.452 278269.4244 5423338.854 695352.2021 1011463.363 357723.5467 446888.9241 2788588.406 447346.6476 492500.8631 552519.6053 256574.8154 4617160.911 650368.9829 514904.571 368379.4115 722133.8011 2875468.114 434232.7501 373719.8916 850629.2301 217606.1618 941635.8004 988129.5137 1539153.507 1086231.968 2184506.304 1209392.931 310066.6227 719348.1514 1607156.314 1243198.982 1114900.252 799319.2295 858422.7526 544229.3661 1660614.073 844707.5058 659274.0661 1583992.962 1004181.433 1084943.061 653513.8837 629109.4164 162298.76 524503.3492 1657688.505 641455.9807 165857.7751 1011774.927 1294929.281 1640953.19
Arabinosylhypoxanthine 1895205.756 17853693.23 6595332.812 5506816.049 1981934.402 2477878.764 1385133.821 5670190.57 4004654.976 1490780.382 90394602.86 1425211.169 2815220.352 6269919.403 1738247.324 1778147.989 7796736.91 1770425.982 1574361.013 2354757.636 1398710.221 2789666.154 3940229.012 3536866.39 16613393.64 7061463.808 21401268.83 34092604.76 49215065.85 33917360.8 6930865.752 22327032.87 14011364.67 12681630.85 14690301.69 48416923.01 13667055.49 3988799.63 9010216.84 6457636.398 8701783.036 1595830.654 1462756.317 2365942.269 1468480.536 3608973.863 1410291.912 1435323.175 1471434.294 1478549.002 1409434.771 1378380.52 1356186.247 1382527.146 1415186.978 1694343.613 1304064.522 6176385.041 5790937.475 1565981.721 1265516.043 4383066.521 5640741.303 4964126.712 13195602.95 1402479.354 78416404.53 61751053.99 197671295.6 2128634.605 4289129.683 529814194.4 547594530.2 1404876809 4179312283 876017055.1 43782069.57 72630149.64 75917909.06 18301088.07 31758018.79 26513924.99 25829423.08 25778186.03 20378013.73 12508388.34 14584452.66 25247106.96 2493688.244 7534748.859 8246843.027 20845816.41 2624762.188 13950313.74 9353922.856 3480172.172
Arachidonic acid 73064077.03 89014900.6 67933732.28 98110691.11 48382743.09 142502513.6 175685031.7 178003006.2 116061360.7 211386657.8 167359612 271075356.3 230115876 238273259.7 104305509.5 227578562.8 308806136.4 420391101.3 262756352.9 271398377.4 186257793 369919523.6 363249890.1 500126832.1 437027706.1 308483634.2 253326455.4 341388360.6 422971633.8 539327020.9 632078133.2 517623054.8 433643781.3 595363826.4 450338759.5 689809754.1 100599627.7 73758452.59 70386707.42 61060597.92 78481017.69 92455219.11 243718662.3 182530023.8 22096506.77 129540749.5 195171859.9 250920075.2 147380907.8 135832208.4 191898925.5 176742821.6 321669689.6 260012957.9 162750081.7 167945750.5 306591177.6 452089645.8 287531684.4 279062941.6 289023056.3 317941226.9 319499629.8 452456031.5 288342246.2 442667101.7 208460023.7 198729592.1 178348555.1 107265267.7 136636836.9 190288860.5 218791900.9 202828790.4 288587766.9 244189706.3 322929200.5 411682927 233673479.1 186386065.6 206925660.7 639881146.5 589387206.4 477377296.6 312029637.4 303638036.8 655016135.1 670524913.5 53044023.1 415797109.5 462783494.6 570946617.8 349397545.2 390518788.5 745186680.5 682974959.4
Arg-pro 38448854.97 31160627.8 37243221.86 26910002.23 27637370.6 39214793.66 31894211.62 30815256.99 41856730.83 22839957.59 29949309.12 20314720.81 17767417.09 19131680.62 18686172.37 22363076.41 21259807.45 23480918.84 12950385.09 17586910.43 24238090.55 15330494.5 11174042.99 16809557.25 36227725.36 19393435.98 14081511.34 24229149.17 17381569.36 27795904.93 26722955.47 18718255.9 36003264.04 35889657.41 41039707.84 70926999.82 21530746.04 15520372.08 38333719.37 27648946.2 25592781.98 21708463.29 26136376.09 25331441.81 4896183.182 23168921.01 19721695.43 46344049.84 30441377.49 23823963.58 17718181.33 20268758.78 12356787.33 16237275.53 28240914.05 20679752.28 14704776.7 19009090.3 19972844.35 23452717.88 18597162.26 24666285 14525209.32 47694199.98 37757161.76 27097036.85 31865116.84 40922199.96 22968723.04 22239819.12 39287974.84 20619288.26 44127085.22 20006373.75 25972906.44 13215498.88 29580619.3 18258656.47 16623914.63 9265966.584 13446437.93 15027545.75 15790223.58 27179934.67 12579399.4 16187673.98 18209897.5 20365681.55 1352518.56 6412735.757 25500485.19 20220819.69 5137838.234 23726701.67 37382957.65 29996139.51
Artemisinin 1949663.73 4842137.539 2352965.336 3158569.647 414596.6357 624251.7559 2154574.899 3518630.908 2094088.066 3429626.628 527536.4762 597036.7962 2524686.047 4070389.602 2444363.1 2994855.008 721669.5578 796054.5916 2174802.792 3782374.779 2812064.751 4518865.054 504066.0107 406399.8524 1760510.005 3221811.743 2462688.146 2856786.882 343583.3771 586932.1967 1900521.729 3269346.46 2100926.865 2302000.136 581329.173 185485.2414 3578928.101 1451906.722 4386112.689 5610806.72 2985655.283 4510672.11 2705312.085 3580887.377 1108359.931 2653351.462 4955687.971 3469662.75 4395536.769 7276177.544 3149108.779 3960458.133 2289518.957 3262971.696 5727722.03 2432052.831 4203057.706 2026905.761 2640538.706 6396854.869 2118196.806 2858673.97 942829.1049 2371304.029 5188357.329 2776286.86 1338794.727 1592326.485 1842341.979 1554402.648 2436289.222 1634069.3 1722536.885 1271243.691 42361.76366 1792332.807 956620.0208 2088248.916 1866693.707 664736.4671 1661189.083 1264950.389 1573253.74 1098058.538 1521973.501 1520800.857 1349133.87 1516805.413 32398.88961 880214.5822 1769179.817 889790.8733 400150.1788 753654.4484 1651829.544 2184131.365
Ascorbic acid 1724278.809 3023519.743 1987194.446 1628368.447 1447727.289 1617575.704 2805115.536 2195298.754 2581589.921 2956661.033 2401609.178 2036057.982 2951877.581 2959995.439 3049960.502 2326149.726 2758182.377 2549902.805 3113523.678 3330067.66 7522636.476 3645715.691 3402103.859 2947618.799 3137954.27 3258611.278 7906537.685 3319977.486 3023254.796 7355975.413 3756205.701 4327833.144 3444337.766 2792536.689 3949178.564 51070790.79 2872160.697 1049539.644 1948515.044 2548023.112 2233268.579 2642114.378 1719096.264 1966036.186 906111.2848 2622798.307 3369566.399 2381248.297 2548961.965 3244265.045 3157358.861 3902697.707 2959425.399 3268594.97 3353038.804 2973435.928 3165654.635 4926234.259 3193214.369 2987897.641 2782846.061 12180714.14 4751467.896 3007833.916 3056412.497 2897144.656 2609499.354 2386676.659 2531425.458 1781178.303 2346424.567 2931286.284 3104315.431 2840602.496 2653501.547 2449099.475 3102506.329 15989161.59 3145229.834 1791461.891 3702942.058 2693666.697 4768344.414 3675532.042 2556744.346 2564250.646 103040874.8 7394015.784 659405.6392 2289129.809 108460307.9 308887235.5 26676527.23 142929362.2 5980277.761 66148402.21
asn-val 251108.8791 270961.0913 254973.5998 263974.1935 259010.9843 265800.6818 2651468.382 460864.3839 3174261.075 3067638.698 1872934.5 769104.6606 5732035.735 5834522.702 3731988.781 7940739.8 9647678.816 7261778.453 2038341.399 6243153.86 485987.731 4020106.03 4626790.289 5521276.545 252363.6088 315718.4104 246388.9227 241493.1975 347295.6912 563143.813 248143.3073 249932.1086 250402.6759 248192.6561 238816.8534 279507.0446 313047.5097 270638.259 259642.0281 279922.0043 280770.8272 390850.5601 10377370.66 573499.9854 1978464.568 5831562.709 17685300.91 6131206.251 4576559.662 30670485.61 6642135.982 19512267.63 1008063.867 1900799.678 8364293.582 1227599.911 692410.574 255970.9246 293039.5653 255580.3306 258165.1522 250100.0227 226858.0954 246809.2085 274650.5266 261375.2067 265557.1405 264793.3834 278893.0841 248323.0149 256389.3284 258682.5071 274828.5281 274238.623 290864.71 252018.7098 255474.2755 273708.4716 264341.5458 227432.9223 245749.2422 256642.2356 255456.4964 255506.5219 250610.3665 233491.7786 248252.2909 242211.6872 242624.7774 224900.0872 237218.1757 260431.6781 247788.4901 240650.8692 240579.4809 256780.5323
Astilbin 204431.4466 744971.9442 334984.6584 393894.1496 629185.7507 502074.3103 620347.6042 855592.8862 332992.4877 1477345.924 4017970.057 1836718.033 636641.7205 1075946.072 476558.1597 771689.6997 3462974.029 1703500.196 376173.0918 1079631.619 239110.7871 1496725.926 3139549.192 1659310.248 374243.677 1045102.638 436961.8812 612503.9008 1736991.243 673625.0917 244538.2924 841676.2641 317654.9657 280302.273 370101.6019 239463.8331 4043966.229 443679.801 2331197.563 6525338.789 472029.0053 13872332.74 3733592.941 2516781.535 1819276.853 773860.5878 10461604.18 2613140.926 2108995.686 13451032.12 1056804.977 6799096.07 2529376.101 2207835.5 13068305.36 1076975.004 4151337.044 1794185.143 2391660.054 9502193.17 1101633.346 2808866.324 592400.4065 1758098.706 4309017.965 1493868.99 286643.3134 461995.5642 368172.4527 751699.1602 995443.7337 357007.8302 585444.3656 177714.5264 1026183.623 1364527.83 599675.8489 671625.1183 359576.6516 364446.6192 1635791.747 593687.3073 930038.1021 581795.3879 1117356.982 609418.5737 371468.1431 538644.5482 66651.73107 596615.5218 1569756.72 239126.1435 191657.7148 234609.5641 644285.5796 1279366.23
Azelaic acid 92893402.98 92328016.66 89604078.49 71837656.05 82265695.13 89138394.72 67830043.72 69138637.81 69165845.11 67005701.35 81748381.44 62361202.33 59628507.7 60085507.7 49822309.4 46368198.13 124685681.4 122050724.2 114675586.7 106872689.1 100927528 125071848.4 124990918.5 121833588.3 111442640.3 113324365.1 122498754.3 118782556.6 111038610.7 101882972.4 137512459.3 103221740.2 114896304.6 111264429.4 88842124.75 113102024.7 80231910.17 81882154.9 87628676.93 91818634.19 102914396.1 73593485.76 90753023.58 81494895.25 41844138.63 94563884.85 68110012.14 105695826.4 70235937.4 80340401.95 73684266.22 148335180.3 129997397.6 147032106.6 110978845 130223975 109720975.3 129614617 120280632.5 123359201.8 122054226.2 123221326.4 111425095.5 149164854.1 121541463.3 123111167 76554483.45 88474641.03 86368652.11 72172181.66 71605838.23 65715765.14 73499879.43 67606294.5 68976303.71 63530331.49 120853649.9 131493341.5 125230255.4 171128036.4 108381471.1 114862338.8 116953218.7 97280880.52 111505836.6 124157228 124619569.1 106309397.2 96455500.42 96677315.9 108373154.6 121778714.1 79696733.52 91336051.02 105149375.2 128466379.9
Azodolen 13781947.4 16946673.45 19507126.71 26020573.61 17277476.9 24112065.59 23967379.86 20047654.27 13590380.76 26757154.37 21208289.09 20806141.36 18370530.84 19829192.8 15205846.51 18650817.04 25022957.05 17803821.08 11910971.44 13999147.97 12247935.55 15582062.97 10840350.94 13370486.59 11378782.35 12681153.27 8994754.601 14007691.66 10732303.22 10924985.8 10993276.05 12962016.91 9111386.599 11894800.5 6703206.373 12214705.88 40402402.16 21492690.47 26049957.48 27666943.09 24600620.69 35677000.51 31363146.86 29313848.23 8639013.185 21000102.79 30257890.02 29027286.08 22656052.77 20759520.4 19722816.78 21448566.14 20988158.85 17749348.21 14807136.19 12998367.12 22436155.8 18807594.86 13378087.94 13434568.68 10831538.01 15615425.76 9311272.755 12582090.37 11093924.84 12099732.84 21745268.43 17001576.74 23327696.08 21558596.36 21263042.42 11870821.1 14228779.92 13446543.54 18500669.27 15152977.48 8680296.641 12166896.68 12133240.8 8166889.875 7963810.143 9012830.636 11454227.2 11381511.32 9573912.309 5289455.258 6932749.185 12357867.64 1864530.525 7780840.599 10764819.61 9283078.687 7118798.262 9967742.649 8449174.562 10065191.74
Bafetinib 7879372.176 10017271.4 19622201.31 9313542.348 16999645.79 5400592.129 4827958.632 7764851.288 6497507.297 6398287.615 6961759.908 4487948.39 6003583.639 10273251.56 6823157.969 6196114.854 5125445.734 4230882.53 5459776.092 22168880.95 23510437.06 6208837.409 20489175.38 3912196.578 5063270.178 7490190.616 5147602.713 6495779.72 4662211.619 15964045.71 5119106.91 7171570.394 19774853.22 7240378.628 20202708.56 5245278.654 17136506.84 14550499.91 12890034.99 8914944.074 10075115.21 9900132.958 10598216.69 8675213.417 16375762.48 8291404.941 12637168.42 8517445.148 8879529.069 10005023.81 10121614.92 10090087.08 8261170.63 6820445.844 7483507.465 10494089.53 10683210.17 8895629.748 6546740.237 27198852.81 7194691.539 4739951.637 6946066.178 5569907.632 6246441.456 7083217.461 23736350.59 8428295.835 9588007.017 21739451.84 10185126.25 8566943.865 9991327.697 7935795.192 7764799.626 7479332.629 7568465.699 9031796.331 5598930.939 5653112.016 7060808.411 7387511.088 9409937.924 10544179.5 8054325.095 20647461.94 5844331.359 9157821.369 1007644.966 7949828.004 6668832.345 8368414.024 4443409.11 6364544.443 9600283.262 8641759.616
Bardoxolone methyl 3666585.091 3267080.474 6992269 7868109.563 3233616.124 3835959.587 7572269.602 3822101.896 4864779.37 10920346.31 7173986.048 4683494.615 12361113.58 7372061.853 6473343.267 9955373.345 7591147.255 9382654.498 8502321.394 4909228.332 3946248.29 12758637.63 7283088.125 5247284.827 13359770.85 6719341.372 6868363.361 8162071.199 4842629.611 5367432.916 17069350.67 8689184.26 14722388.73 13359305.15 5737226.99 11194759.09 3766996.956 2400673.791 3469857.213 3063397.829 3250324.114 3236642.157 5314731.697 3754705.035 1001389.939 2960353.423 6652851.949 5121255.232 6728974.362 6981050.972 5213687.832 5185528.134 4185928.968 3529332.709 8367583.542 3453378.925 10592581.17 6409139.974 8560854.273 9067266.178 5804047.506 14895646.18 9464727.101 10108252.56 5243583.138 10756663.55 5398756.301 5737390.729 6510506.406 3237493.768 7068663.045 8547320.566 7088785.652 7317354.541 8020083.32 9613570.658 11817389.99 11071428.54 13551324.67 3890798.385 7002010.319 14028648.65 13337654.44 12037425.5 6679408.704 6861498.558 15321726.53 13563878.88 513904.1305 5512362.285 9940755.618 7013465.871 2728416.558 15613203.12 10305378.64 10107930.29
Benzoic acid 8135130.564 26259645.46 25983606.15 25784480.55 12011320.75 34284201.33 13996725.96 27421538.49 21610121.43 20031392.09 20602542.09 20295551.47 24826302.82 21202639.4 44698790.96 24235291.27 36796083.07 43352445.15 16101087.46 37612197.34 52680086.48 48784795.75 27853998.45 48441245.6 30664542.86 31187272.25 44510641.76 32699832.1 32648744.79 53884755.06 38720163.97 30726276.88 46341115.83 29719751.26 31996222.93 53158052.78 22707759.79 32166908.94 26256313.67 24982069.78 52542326.07 24989941.65 39401864.09 21031654.4 15133713.43 43007013.4 41055987.36 32330220.26 36723529.35 37581533.46 54413166.75 34440275.43 39368316.81 24047924.32 33930186.18 42637097.54 28581304.46 46056270.75 36730249.03 40654513.57 60632439.57 31316727.2 45822505.5 48247261.55 56814180.22 52057316.42 22678437.19 19198612.61 25378920.87 20587699.37 27366500.71 31723207.59 36111471.07 23557014.7 26361306.58 25127678.45 22165506.86 33915677.29 30450837.16 13528605.31 21235228.17 19711602.99 31143939.86 31445406.17 18702622.44 22337290.65 24800903.19 34783564.42 3510162.971 25609230.57 23345447.1 35715294.51 23626213.08 36711003.23 28022911.03 32293413.75
Benzoyl cyanide 5408460.429 5345759.556 5748605.628 6452285.193 3685463.386 2724470.787 5864726.674 3860539.16 4991208.819 6295289.297 3697256.237 2481058.146 6713027.592 3842620.423 5048047.422 3612538.622 3619237.998 1835430.249 5061043.937 4194215.641 5590158.436 5583120.756 3567581.221 1561902.779 5342507.101 2497756.035 4373093.086 4195815.89 3052940.668 1142745.089 4708989.55 3192165.136 3068407.3 2973770.566 3058883.586 948035.5778 5530931.511 909142.5391 3153551.733 2693756.266 2850708.223 3826371.685 1134386.077 3702062.497 451894.8336 2768288.506 5426813.64 1123774.432 3193534.816 2233108.576 3229126.704 4613509.527 1422064.268 3251775.343 2553595.793 3001312.113 4087433.156 1347985.046 3300328.8 1955581.636 2517644.759 4043952.587 612425.9442 2446305.328 2168877.531 2975561.3 1267530.685 2086619.137 1562063.798 1193458.601 1802768.921 1651798.384 2151938.29 1605795.981 1659978.535 1563776.339 900346.3854 1597074.75 1153308.6 560490.9775 1478372.976 235155.7926 500756.2513 176406.5838 758512.4113 391378.2719 161676.2414 228135.3698 229554.414 522893.7726 210108.0606 479708.8028 163800.2042 177639.0126 185201.2795 492344.755
beta-L-fucose 1-phosphate 2516330.253 2189376.365 4266114.779 3993334.064 1713474.073 2293364.852 1935048.644 5357374.578 7170700.991 3569922.099 1580639.714 2309749.513 3472977.258 5981090.27 8988102.46 3367003.368 1566810.563 4278208.271 5769872.987 9234291.393 11024704.18 7922820.468 2921337.021 5311469.056 6889233.315 8310945.825 10697852.92 11525519.02 6022829.717 7875849.262 5436974.563 6864584.258 10336566.93 11681677.86 6775851.579 7635771.967 2567952.69 2654004.495 4311142.753 2139264.931 2663167.882 1403588.18 1688887.03 5513336.582 1332062.057 3530363.995 3207010.507 4233729.722 7370023.659 2230878.77 6377597.89 3990861.465 4171187.591 9988511.062 4591291.017 6909180.88 6634932.659 5275114.65 8394149.115 4308687.977 8219380.459 7522138.641 6920864.802 7182344.03 6725925.223 8302928.544 1472411.104 1568793.5 2410900.574 1464079.861 1441393.718 3785675.656 2745690.737 2631672.133 2600128.338 2506298.313 5676224.979 5166770.343 4434645.105 5572771.293 6401505.318 7062160.009 5747747.393 9599028.504 7118563.887 9487849.956 7776091.493 8365668.811 2930600.278 9895187.288 10060160.88 12724648.1 5272255.836 9906654.387 9486756.275 7841821.511
Bis(2-ethylhexyl) phthalate 1485989.553 10019661.49 1504140.131 2994333.146 8151270.016 4043380.802 1668190.765 10195373.8 1887735.347 3990939.487 12140210.66 7345302.793 1619790.235 13386453.53 2488376.674 4532807.905 12501929.43 6515423.664 1989751.889 11019147.12 1077310.875 3633966.617 12585446.51 8465339.167 1308367.659 8279969.836 1667043.072 3660650.282 10962981.86 8304814.428 1657838.467 9053152.764 2374605.28 3887698.319 6193295.64 8532086.641 6369414.634 1855517.794 2926141.601 2425193.974 1762875.75 7920341.458 1721795.85 2978890.368 1435089.123 2055980.1 8021580.839 6376343.099 3759605.572 2731114.691 1457253.801 6391192.628 1880509.724 3069788.313 2667767.846 2293053.341 7622797.879 1296199.545 3310013.988 1618727.326 1261076.789 4528420.366 1491578.995 2753683.676 2334965.353 2068081.705 1576937.016 2994791.641 3407536.705 2192012.599 3906114.025 2355910.607 3883996.501 3110446.778 3179764.27 4146900.414 3129234.325 3710738.616 3472648.521 2133327.529 4393946.859 1757546.393 3895205.397 2877505.801 2398242.595 3306545.864 2752286.22 2823751.01 1685150.123 1728545.111 3702784.886 2289621.954 1899714.833 3467066.792 2092962.444 4927847.56
Boschnaloside 17093505.22 10935788.13 12052108.55 12635217.92 8229620.684 9541260.792 15324082.97 10756537.44 20198573.63 10476536.99 8762525.092 13522829.32 11234793.9 9022479.013 10363292.36 6535458.149 10717548.06 12626275.53 11316689.01 9227446.297 11235907.73 10724884.05 12465015.95 10735316.71 11027783.79 9712732.87 13090403.02 11922315.85 8153971.027 10638537.3 4712562.43 6889165.469 2619616.928 3101098.151 2844004.142 3829208.499 7780516.617 8338511.583 13215764.23 11015471.63 10650797.68 21738716.6 11367992.76 8319274.038 2617865.225 11113843.31 9160485.738 10061264.24 14156119.26 10207157.45 10709179.72 10947853.32 10694877.35 11004477.43 9358383.474 9264657.846 11061049.83 17925345.52 12511177.03 12934963.68 11030377.37 2496160.784 3910057.518 6826145.169 3325300.706 2275920.069 12322652.98 15481362.02 11927960.87 11890713.93 9879638.186 16320777.98 18589527.67 9620345.968 12428972.68 11938991.66 19777356.99 18389384.25 12720890.16 6290825.351 12400865.76 15477572.18 11521422.31 18995028.91 12938320.55 8900306.104 10733569.38 13025018.47 726230.9219 5749886.7 14257278.73 4172672.405 848856.5198 3648177.261 2374146.281 6644335.163
Bucillamine 100920188.5 296246375 453712101 365879027.9 13148420.29 14360917.28 108044007.8 236293931.4 369709777.5 360940376.4 23248074.06 12604211.46 134019544.5 250632398.2 358438473 255491730.8 18343497.59 14466367.79 100659221 206268318.4 321127940.9 376081623.2 19724406.19 12757229.91 92835505.38 163166457.3 267481173.8 212991585 15900395.98 11011650 86922998.55 164222832.3 268023130.6 202320945.6 23343904.51 14919502.74 204678483.6 222409260.5 225667917.9 331845833.5 259009409.3 217958269 464250739.5 192766654.1 54092584.24 216078729.5 228624717 443148541.5 208918755.8 329560026.1 241274235.4 143408327.1 309160260 143740271 278234505.6 177186349.7 158575915.1 289946905.8 142073693.7 221708343.7 180752742.1 113383246.5 145123817.5 145049564.7 223889626.3 173981518.4 40418636.93 58767303.81 67543359.25 21367513.74 75866010.85 45946896.59 54906897.46 47430740.04 22428765.88 49479487.68 39612667.16 63679016.86 53855374.95 8050718.21 49199676.86 33460586.11 46371971.23 48369598.51 18774559.39 29453929.33 33310486.77 41592247.65 1883817.204 11557054.35 40979571.26 33117986.11 7818458.344 35503936.62 18784660.58 44502420.05
Butopyronoxyl 3724066.363 4483740.154 2069297.887 8218464.573 6979749.613 6801873.201 4980646.9 3186255.661 2268948.148 9426839.537 12832097.71 10096381.65 6329195.145 4928545.848 3176499.173 7668405.331 13422960.43 12214706.91 10834068.76 6113032.771 3823785.512 14555818.42 14336329.59 11435375.03 5160189.154 6878835.517 3545611.53 9449793.223 12020685.77 18510706.18 8944438.116 6522937.508 4460428.885 10113397.13 10856204.64 19079459.67 3206472.455 1984041.706 4076378.992 3028052.787 2644288.707 3664735.353 6730050.833 4014322.995 1141367.937 2838438.21 4773187.36 5476139.286 4301865.219 6844612.831 4190236.744 2294875.859 5493411.477 5078467.723 7818629.794 4461848.525 4195995.063 6460407.082 5992219.042 6514565.576 4227324.058 4629760.44 3823150.413 9696261.615 3335084.422 4567352.642 1544975.861 1395374.134 1430046.728 997541.659 1357816.545 6242365.127 2548916.45 3297086.729 2566857.495 5608179.215 4279553.803 3994375.627 3712329.696 1970409.547 3836467.498 5196986.435 3481088.728 5139631.137 4248274.861 3918113.022 4236404.394 2984163.411 650861.3283 2980643.467 4007886.744 5923783.623 1184123.863 3491694.364 3099324.429 5566012.559
butyl acrylate 906808.9732 1027379.125 686666.4907 1685778.176 1051092.968 2667818.437 1376252.546 705158.1599 720228.804 1968695.08 2287067.964 3345055.314 1351485.881 777309.5007 801282.449 1387058.01 1782971.563 3500381.958 1076729.732 713322.8631 828193.678 2502295.24 1280239.267 2818780.949 1055386.505 588329.1973 576741.3075 1684024.034 1090977.389 2655627.864 1119524.314 694546.985 591901.1482 1318998.68 1147580.64 2754708.644 689305.7131 409001.7155 522068.1657 592933.1929 600619.0159 800908.0938 883925.597 516746.4452 197905.1559 330372.0368 737674.5011 936518.3502 584883.8518 687596.1453 428471.4911 712011.1575 697529.8858 402681.057 606457.6896 463584.1602 600755.0591 440487.0503 517259.8385 582487.9974 523171.6533 597277.2642 449994.4141 470763.4681 749888.1079 669120.5773 323944.7228 298819.3122 424132.2263 915492.4626 527498.8716 485891.8941 231752.118 288683.119 1170719.394 320356.6832 366441.8344 497846.9274 344427.631 1123177.896 378975.1548 265891.7753 348615.4476 235750.288 894755.965 261361.608 411396.1882 277761.962 112125.4966 854987.3913 371399.6044 464660.056 143413.457 268295.9302 1052228.688 351752.2759
Butylparaben 13004738.52 10466418.13 8021641.55 8544956.823 7172376.771 10327376.16 8867087.126 5708557.395 11623890.65 10077898.79 10949196.14 9001092.142 11569548.43 10575176.86 9557568.727 8974631.122 8722586.939 6414930.163 6043163.916 4702037.614 7349607.758 4562454.415 15207076.43 11118376 16144478.75 16330747.36 9870689.162 16809008.77 13537589.11 9476399.473 9789429.735 10044670.15 13758463.06 11125114.09 10208880.54 13611976.5 8483893.08 3123461.171 9689580.197 7346639.777 9287105.405 6394191.38 8386606.738 7382643.674 1802773.053 11775122.13 6816292.324 9180505.026 9220753.694 7473890.732 12082127.49 6310470.526 4979583.311 5296441.443 5021473.06 5650251.534 11469842.89 12738657.5 14870966.19 10963730.06 11893840.78 11861158.27 9929766.409 9615380.113 8986130.817 10626546.78 9731535.123 9839963.256 9752264.679 6379288.447 10545714.45 8274687.717 11437202.99 8583425.886 11811472.23 6160003.783 9325408.003 10446010.79 6417011.539 5167304.082 8157984.428 14454504.9 13968363.78 15581084.71 14497646.35 9685868.297 9220529.308 8906402.481 468667.048 6136428.295 10359317.02 7953783.218 3160245.017 6075640.205 10188222.48 7605845.261
Butyryl-L-homoserine lactone 1310416.609 1248661.675 1302543.346 1691721.715 1161730.236 1082532.087 1101972.816 1043272.807 1339446.602 990177.0014 1057053.387 968653.6088 1068767.631 314865.9503 1232619.205 783328.0276 867554.2275 798424.6768 1250986.445 970560.2767 815548.4586 1445836.544 921519.1111 896327.2871 2634612.148 1180366.974 1044990.28 1591253.664 3814602.462 1762825.924 3977973.646 4372105.056 2330696.349 1714928.586 1550440.834 1692601.859 1075026.087 1578143.308 1301800.897 1483788.244 1254233.984 973836.5486 260940.4303 374802.4962 1124075.404 973629.6773 979701.8552 438430.375 1461340.015 1135286.831 970602.4002 1166207.638 1281465.109 1172635.439 414107.6343 1582135.493 4586662.077 3316312.88 1558818.182 1104546.236 3495829.501 15488951.55 6194398.363 2947903.747 2415888.77 2284978.124 1093563.282 1477299.917 1600406.018 1273729.708 343868.3749 374538.2222 1001948.25 1273560.35 1256206.938 1098732.496 1097778.274 498885.6205 1256557.607 933644.7072 407361.3562 995833.4029 1201027.641 701893.0078 1273628.944 447748.8149 748025.5998 1362059.455 586779.4499 594952.2574 1213341.498 5231098.208 1047382.898 3248769.413 954113.0776 1592237.133
C16 Phytoceramide (t18:0/16:0) 9086091.298 482075.2412 1048445.213 459621.196 509305.6752 464941.7604 16251813.72 3154678.556 9230631.714 2321290.741 475938.0702 6460798.778 433171.2334 507218.0832 1458769.82 438436.0823 563601.9384 528414.6508 869617.2874 642326.1654 478270.0963 574809.6627 537154.1772 606636.7933 548978.582 6347046.16 6367483.541 1203905.479 543061.5409 494920.7922 411728.9755 1317234.292 416258.4299 541104.388 18183172.17 490287.5245 407775.0005 316175.6365 3503176.627 6236977.483 525034.5971 14485015.32 5869233.695 4255772.725 3183044.533 2466780.285 478524.432 413474.6374 579257.4111 5221656.617 435539.9662 4094565.47 551550.7284 3246690.277 473526.5169 574431.2819 1078586.094 2909764.048 4079477.73 6751848.543 1757083.313 11439690.45 1083274.319 3315190.344 532928.135 486685.0025 1271824.885 3619324.416 459553.3477 2067601.967 1173697.117 1668952.163 6152859.38 5241724.617 1590212.366 9200409.303 9917378.878 839692.7599 465776.8645 6164631.467 6260400.403 8531809.667 650401.2094 695841.9511 2222051.781 3254160.82 10375233.51 491755.8547 297174.4559 412627.8056 8835003.048 455024.141 284506.1254 24209400.99 3273887.534 2181118.779
Cadmium 51487378.23 65976188.48 59316075.64 61418485.32 56784365.7 74012618.61 40922004 61208182.05 61104642.72 53563832.26 37020639.58 53648227.81 56783056.68 63979408.19 67490383.42 51628266.81 50743056.86 75701014.61 65967278.03 79831036.64 78725444.85 80240978.48 65912646.68 78947854.52 75054714.32 65792071.93 77293805.04 77718498.98 86098589.7 81832339.8 84061081.79 86329062.28 81279552.24 84864230.75 73063758.24 72733512.51 82684079.73 40175901.64 61517994.37 73263329.83 70128451.59 39478853.19 35300714.98 62846280.96 6242328.031 65839887.28 79143745.7 57662630.19 71468515.39 76981460.63 69828690.05 78445297.44 64854066.55 68139181.12 85282913.56 75790939.29 76617919.37 78555702.45 70761221.64 81809834.6 73979416.46 71526754.93 50605862.94 71777263.97 88930851.45 76333220.28 34190621.68 30846038.51 30300233.87 32858860.5 41346781.84 45193966.07 42601862.71 25942352.09 16971344.73 31923693.42 71435274.52 76445471.16 54519010.49 25774533 66344710.25 70907774.27 74898021.02 70241843.72 73064794.3 54161304.83 71435542.03 71736572.04 621768.2114 46083401.78 77230708.36 69982755.38 6573668.513 60921721.65 65379244.53 68988120.46
CALYCANTHINE 14308956.79 16682032.9 18530614.82 17080397.33 32320502.29 43926041.39 18276814.02 13241035.49 9427786.779 21048192.5 61384602.67 41807929.85 26613146.85 17737988.11 14382295.76 13999680.67 48641809.38 51878915.9 17784493.95 14900529.91 13463957.33 25529255.91 47638000.31 41823073.93 14996202.63 11463885.28 11251514.41 15197685.8 34274969.44 38014854.38 14196343.36 14322578.47 11618297.5 13980690.07 17894221.48 35379789.91 19910776.8 7945720.064 15305524.76 23239174.44 19961141.7 24944033.38 18899838.25 13521946.58 4984492.049 15349935.3 24149419.23 18521310.98 13930451.31 29664111.32 16881869.67 14278613.68 15459157.73 10761554.53 21435159.93 13525775.87 20508019.42 11984555.29 12537960.68 18962028.05 16733311.97 13960973.18 6204977.386 10516073.61 17514102.84 15450373.65 5806615.561 2820562.151 3457333.599 7968547.562 8277228.915 5411449.101 1644918.481 2103890.697 8677971.051 6543531.047 4117043.888 3237940.848 3118739.888 3797788.186 6846444.34 3548354.434 3314479.216 2152549.459 6988640.304 6377216.853 4708616.46 2555440.642 146681.8216 3654415.745 6613239.644 4412694.781 302784.6441 2933612.788 6818121.974 7608613.266
cannabidiolic acid 151612.1505 172189.2056 160955.8884 162406.195 162156.5323 164871.413 190325.2659 187384.7968 190134.2732 175320.085 174115.5807 171294.0151 509877.2101 248267.855 172669.3119 145405.6763 173457.058 166642.4821 500194.1486 333236.5715 448912.861 598446.4192 196497.1445 253614.9357 2238223.609 570236.1905 654022.8857 661047.0129 414973.8481 513577.4247 3306040.494 1023750.613 1339481.232 1455330.939 1043712.065 949592.1393 182709.5038 130760.1581 175552.7196 168264.8797 168802.1952 209109.8117 173954.367 161765.9313 120550.193 176603.8164 212912.5903 193001.3622 197641.4259 636479.5354 175429.6321 233601.839 180102.2619 189561.2966 624247.4126 400220.9419 225476.9525 1181639.193 683204.823 443727.8659 523413.0099 1814042.848 1845183.733 2776333.993 711412.0798 638706.7929 156412.4811 180915.1034 168786.3789 159291.5598 174483.9909 461044.7878 306866.6092 179520.5041 190562.9829 181007.9135 536895.411 516824.3233 510176.1576 220233.8102 321219.862 1051655.292 973193.8764 1708289.175 1024078.652 691324.2313 992232.443 779274.5699 135309.9334 783230.3619 1275179.489 2789291.864 727254.1974 2636319.893 1146684.702 1705378.704
Canrenone 1031575.911 797039.4068 897977.8234 834000.103 797066.1076 808745.5495 624064.2619 743862.6452 712235.226 644375.4263 761138.2269 599899.2995 559772.9691 636325.2154 590496.9568 486423.4427 672233.822 699066.5545 657131.3369 817760.0533 699698.4718 740168.2717 628433.1378 721660.7681 1179034.07 723321.2469 747560.0499 956974.3922 787279.3209 1252475.291 4097490.079 1151233.866 930565.9401 1099647.265 866313.6919 915443.0752 780500.4166 572650.7785 855715.2474 937773.0675 901884.642 658782.3155 756106.9864 763435.9335 316124.6987 701406.6295 680792.2678 780805.044 827318.7815 721968.7829 1357578.335 742425.5198 736672.8971 623863.9397 599003.994 680402.953 589865.1957 760761.9797 782748.2175 743800.5159 824832.7053 680752.8911 1082401.048 1294078.486 1113618.618 789563.2087 694173.1913 1040258.834 646340.1282 618577.5341 663241.6055 773585.7267 806822.015 625491.7787 808392.8267 484135.0173 781618.6312 680581.0167 840482.0134 409364.4136 541785.8718 770276.0705 531754.7331 1982316.394 947146.7456 583699.4319 919352.9409 807294.3211 235269.7068 1254630.041 1253521.595 1909205.14 696546.8789 2075592.375 1477610.489 1066824.515
Carapanaubine 1080798.514 1001246.336 912667.5991 974382.0056 1012788.902 979589.7228 722196.2952 831075.2362 809770.2775 901677.4169 874936.2954 836161.725 749431.5902 706005.6045 779255.0941 518478.6738 820668.6448 856858.3885 732884.7668 727279.7592 695118.4028 716451.1526 956356.8011 875091.9818 4205955.179 834198.0602 731834.3359 879385.8779 886900.3018 763990.1506 1238210.769 6721676.685 855991.147 619602.6728 716061.5054 909817.8474 979041.9015 635642.4924 1034256.47 931074.5704 1026222.933 717372.5106 745577.1172 869421.647 411285.9524 958867.7547 664600.3235 661250.6323 876430.535 739731.6776 864929.1529 21997664.62 690319.949 692687.5496 691112.6269 729003.6289 17538049.01 4095029.839 5509324.422 683765.0301 760347.0567 50944055.99 14139996.48 1278753.874 706033.0282 2237961.749 974247.4174 1135153.161 866119.9101 670327.5941 775770.8451 846996.4114 795523.502 798534.7124 871705.707 754421.041 841516.2839 783931.0581 863517.689 576152.9665 726841.7979 705004.7765 779755.3014 730233.8342 770796.1712 688734.1066 801782.6809 819669.4559 325668.4778 561956.0439 740718.2905 667251.5491 358973.4241 625388.7179 727802.939 740877.6747
Carbocysteine 1837979.588 2097316.014 2377714.077 3305961.894 4530218.671 9674865.096 2196500.385 1056909.636 2351810.012 3945657.231 5762177.415 9039058.574 2567116.711 2431580.004 2391347.682 5036540.698 4992901.128 8097461.77 2520197.632 1737458.684 2460043.354 4391461.726 5444699.007 7966339.921 3319772.856 1816288.855 1384502.664 3507298.058 5283452.301 8029526.15 4622115.837 4333486.106 3729691.884 3539371.54 3052077.732 8151722.643 1113481.992 1519892.181 746393.9017 1381580.927 435471.8524 1131797.402 1421268.221 549831.9306 263690.4786 1058545.857 1631789.156 1431866.646 1131074.742 1673643.873 1270730.52 714014.3519 1214009.888 1116533.283 1018665.61 807577.4802 2984981.977 2665481.128 1184950.351 1478252.124 1237403.64 9614637.218 6892413.618 2227914.801 954258.0789 1062989.852 1857389.197 1792018.019 1912690.147 3976677.206 1672625.917 1911224.473 1168807.913 1496069.083 2230935.78 1103581.225 1908757.923 2082067.358 974391.9274 2167815.209 644869.7227 1224070.625 1297343.305 1280324.207 1440322.908 642463.1079 1038866.168 1570335.126 134187.1958 2079192.03 773829.6697 1801555.33 618893.001 1816135.596 2218557.748 759102.3364
caroxazone 3123647.986 2290513.822 1970622.428 5959086.728 4021720.975 4702110.766 2431557.366 2700870.996 2751410.21 2355624.17 517221.8903 2689842.881 1970213.784 3875894.361 2629129.423 1372472.778 584842.5858 1559989.535 3187060.2 3738489.249 2318932.672 6391787.514 2448481.636 3792964.171 2768929.567 1679203.675 1595960.425 3122194.277 4052586.483 4366782.531 1288748.154 1010481.353 853624.9406 2598976.749 2295776.955 5394860.24 1857399.585 954447.3449 2597049.705 1706417.788 4727784.2 308582.1765 1267121.823 1734880.921 753022.617 5300831.082 1353251.025 1303104.136 1498058.439 2841100.814 4980222.743 2183927.669 826977.0599 1724476.763 1520311.027 4373354.449 2407573.896 1141489.109 916573.7718 2070327.721 5030908.622 1046544.097 445263.2182 980270.3067 2172853.547 2773935.113 6896241.025 7396996.019 8293768.945 7720158.339 7396157.297 5910954.304 6664090.066 8073852.99 9794487.922 6410987.059 6208104.146 6968765.901 7476343.165 4764394.969 6393657.929 4343954.789 6205226.398 7234215.864 6003547.347 3117040.979 5019836.22 4450138.224 216856.3108 3286644.779 4178207.812 4027442.443 389668.9525 3696331.572 4548211.391 2199922.033
Cedefingol 28729133.34 18609325.63 20077001.5 20600768.69 16121250.38 19038924.37 24413176.96 21208921.83 34685646.19 23225172.72 16550997.32 25031194.35 25192008.44 18595725.61 22172316.27 13300173.69 20766885.61 20844212.83 22855942.66 19487331.94 20719970.8 21929609.89 30907931.43 22388847.13 31279969.73 25987903.14 31696094.47 30213315.38 19429162.43 26217631.6 3101630.575 5354248.375 2433139.696 3330567.878 5650637.407 1915751.749 23712439.7 15659677.09 29375354.47 20674949.28 18919510.3 39886978.98 21029439.89 21736344.45 6744032.937 23018285.55 21145027.94 16881172.94 21383898.6 22972418.36 24110863.3 24240441.71 21461517.14 19795358.87 17426459.65 23562438.47 27545826.81 35464279.79 29522586.92 26832683.06 30579353.4 3724776.179 3023444.312 4603313.264 826174.5256 2258207.563 19686151.94 26463710.4 20079005.34 17421474.99 18729511.54 28553644.87 27616394.15 25317909.31 18579904.38 22573555.32 29352576.31 32441498 28946120.25 12980458.72 22813630.23 26413480.67 23635806.87 24034749.25 22004182.21 17292668.86 32392507.65 25531599.85 1740482.914 13780506.7 32764309.35 5388195.292 1198014.163 4567317.422 3839152.414 4060641.098
Cervonoyl ethanolamide 39929.17038 107399.8186 37918.46813 52854.07616 41134.83321 45672.78828 705707.9482 765402.4921 856440.559 1054186.693 1070918.904 599414.2043 7200298.48 2918127.259 3338387.591 3420633.027 4661496.076 3145605.379 10455152.65 7774958.075 7196143.506 9998498.733 13122387.82 5105493.333 12410630.7 5410471.545 7608912.566 6781768.018 12122575.53 4791841.485 12113185.47 7635923.821 8293878.737 7960527.472 7720698.968 7920038.35 41865.67315 35970.88802 39748.5206 46873.13737 43018.22726 915769.3153 217123.7733 274524.5992 131194.2223 581763.4017 2962952.37 838463.2727 1028948.172 3719353.438 2072711.399 4146652.148 1455034.848 2405367.082 6908038.008 5064139.329 5071656.605 1885658.541 2817631.248 6888223.556 4796249.801 3645901.42 1052496.008 3069730.119 4748215.344 5478676.778 257797.4134 236979.4168 353208.6039 49979.41192 86565.74856 1617209.212 1604069.025 1847035.605 1275489.695 1036302.953 3030088.115 3000094.793 3921896.521 1189034.362 2191365.119 3691046.727 4421829.521 6415301.388 5266629.992 2786286.708 4520931.643 3988092.598 236189.1741 3260750.261 4375954.66 3722561.669 819820.4324 5404617.582 6633815.524 5600128.867
Chlorpromazine 4193866758 3087145004 4347660411 3438746272 4116988222 4975978147 5422340166 3405619028 5627719809 5182582209 6679902159 7730673393 6375666125 4434056791 7638718224 4134290472 7449662063 8545802229 7129960931 4938040488 6577100210 6561135720 6783436072 8566605405 6689669976 5414174871 8662879315 5230204326 6816958280 8167162931 6552690684 5212026482 7385503433 6347529461 5875908885 5954630444 1217615.526 626700.1452 290257.7996 8695877.145 268395.7288 780974.7113 1788637.503 295338.3772 276173.5012 2264588.748 5749522.094 57094209.96 1093300.065 678315.1113 914980.9574 1044514.003 1533292.545 620288.7366 444183.8707 767629.5582 650508.561 1462453.105 540848.7759 186653.5411 1101916.649 5207691.384 1231268.461 850141.088 340202.8356 796634.6738 8705316.752 8977300.639 8715487.517 9743099.595 22637858.6 9304705.862 16324712.25 13540950.45 13336859.88 39959192.05 15776749.39 19579795.8 22647780.29 9099754.754 53376779.06 20259390.79 23049463.22 25744779.32 20670538.44 50959248.43 22352657.75 19380479.48 2168756.706 14903542.41 75888476.36 12682001.77 6292642.509 19828665.38 18021357.59 64257222.77
Cholic acid 2534926.203 49985239.85 694596.3774 10557799.88 38117098.5 23847745.22 948722.6007 47307885.96 1289129.38 12223121.89 66218901.09 36625437.04 1546415.352 50785854.56 6508070.808 10285442.15 58131099.92 29281330.73 1000120.532 56089612.31 2658002.382 16967764.7 62267173 29497908.92 1167786.818 40676308.86 2150825.57 10043107.49 52003554.14 25006876.9 996103.2949 42158756.35 3298740.944 10860854.88 31477747.61 30213011.65 32030784.64 400965.9503 7027485.407 4759803.006 270751.719 37954598.8 544055.2932 5636490.453 851653.5466 281532.264 42828391.45 17664850.57 5943121.727 5687335.13 537015.0687 30237936.55 1131563.785 6515017.979 6554940.548 1860330.082 35425349 1243400.565 6293646.275 4948443.106 296759.1328 25226148.31 969165.1395 6605039.289 4789646.091 587765.2229 4492636.923 7956149.394 8260021.228 4583762.292 18240890.45 5086182.499 8704847.498 8395713.939 5702162.42 15807156.03 4433389.242 10666885.69 7252497.981 2280065.575 24004201.84 4837469.206 9845306.496 7865326.644 4973822.675 8297445.501 4369951.991 7315301.018 322089.4443 2991730.372 12070375.86 4746964.492 2251312.527 7532710.981 5174644.362 16137491.15
Choline 623109662 813583100.6 484858316.5 620191917 723242958 502953145.7 862750543.1 698163811.3 830456864.3 1151763569 1482165262 626175696.5 1532413594 1112994600 1284510467 977178849.8 1216171007 930526756.8 1639355793 1771538865 1769977837 2439329077 1901829307 1031223165 2130775199 1922230518 1843445937 2100310526 1927598926 2013327655 2281763250 1744387673 2355898315 1758281699 1755658182 2287660441 935650780.6 299508645.2 621846871.8 698930075.1 596048145.7 1113803881 994553546.5 1021959122 393489488 931404074.5 1471467591 1040778522 1085136884 1374283596 1343903534 1833583327 1462702174 1699811303 1586781165 1452135199 1950920538 1480902323 2074104702 2296590417 1717080728 2611397597 1856520629 2300193909 2408845543 2498152793 568786869.3 629883630.7 799023192.2 366264337.6 709023342.8 1084067945 944312101.9 1068546287 1135702294 1213553487 1089757382 1442564488 1649628905 899658418.3 1449681262 1631221548 2021244741 1436468880 2000123385 1491205993 2197769031 2232641502 528868791.1 1357124418 1591745415 2414801486 1418776192 2349754529 1538409443 2309579637
Cinnamoylglycine 17338239.78 123055562.3 88374705.5 45595638 15477445.8 18366678.98 18372253.1 111020732.2 75632174.55 41917871.47 21928429.64 20452177.28 25646705.64 123875627.9 84646414.65 30202761.95 20782050.02 22928839.38 20817319.37 123846596.7 91369487.06 52826494.89 17463034.32 21957214.69 20140173.22 89103801.71 69129189.41 39314131.36 16129383.07 17675308.12 20477897.78 98513103.46 66830557.1 38679988.51 14474441.99 21407565.98 160464315.8 59248278.92 99740869.92 112754882.7 181095803.2 151051821.1 110093508.1 88589167.54 23867544.47 158561300.2 178805058.2 104339247.7 96644232.87 126079141.7 180078715.6 129558585.9 85083278.15 83098293.86 124388010.5 161153290.1 145625566 76782785.8 76437144.57 105134722.1 154631932.7 117478191.4 50366373.39 81695720.76 105095131.7 151319219.5 25379220.54 24560476.98 39024590.22 67328561.03 44086595.85 26964638.22 24956508.3 33711846.74 85421539.55 37945525.63 26584901.49 29108794.44 36053221.54 35771952.55 35181380.25 25350391 26440899.39 38451889.72 72115463.24 26616955.57 21571227.87 21914042.33 1487078.855 48893793.23 35624600.66 24512690.94 4577459.776 27816656.95 65256484.97 37786742.53
cis-2-Carboxycyclohexyl-acetic acid 1793547.534 2042397.731 882272.8692 1818050.857 707987.6676 1840221.885 795874.4234 2246220.742 1235807.233 1677936.616 1611353.299 2332549.211 1351401.574 1030644.595 873512.3554 1439969.386 1301974.886 2769427.575 1382606.495 1121492.693 1493583.243 2499260.027 1302501.793 2349725.955 1407049.289 992216.7158 1091641.414 2031772.873 1304947.842 2033360.288 2128088.332 1248588.99 1923293.005 2216026.205 1241911.016 2402848.181 902613.012 779899.2653 974829.8314 1517707.824 2160141.109 1096169.501 1392651.489 1266792.85 535416.1345 908416.9143 950887.9082 1698362.846 1065879.723 1482344.594 806262.0016 1498585.279 1462054.505 1236141.535 1464899.771 941855.2516 1427315.311 1403680.521 1135301.435 1642787.1 988269.4873 1741542.689 991439.9593 1863302.885 1461114.08 1222069.513 1454131.002 1498734.855 921439.9298 863761.6893 760991.802 1691411.333 1347814.199 1317592.523 945752.5258 1307844.787 1393096.771 1561182.231 1396160.597 843553.9733 1493327.383 908936.8518 745120.1174 703212.6256 1086104.97 1328002.918 1457622.769 1182897.465 736943.3896 811537.1186 822051.671 919708.3741 883763.507 1317301.78 1999938.779 1217517.831
cis-4-Decenedioic acid 8572957.469 12118151.09 10541468.21 19140753.45 17231174.45 19181217.78 9671591.313 10239616.7 8565683.062 18533009.88 27820699.56 21188752.46 12871983.79 11448216.93 8908171.547 15520722.96 27477453.66 26425459.56 10524137.59 10977570.82 9948065.851 27264613.42 24588543.41 23233684.21 11188528.29 9257893.229 8064457.181 14930887.98 20729523.64 19531395.99 11577646.87 9448904.894 8546676.871 14566383.89 14258561.6 19819776.77 8091248.992 5208004.122 9567775.631 7859809.75 8062767.3 9702775.755 16593700.8 8206535.294 1667421.331 7271175.258 11334210.43 11197522.93 9004327.663 9733143.826 7892813.659 9991559.016 8635644.078 9014428.21 10242350.14 7854882.264 10377034.9 9444536.246 8700130.709 8029645.863 7513816.039 9348108.721 5912180.333 8840394.758 7640704.402 8400867.533 4509928.574 3850032.033 3642642.176 6882777.669 5128933.536 4975958.386 3547413.634 2587195.674 8051636.903 3841391.931 4574096.619 4083132.559 3618417.477 5654535.928 4194445.384 3680143.258 3824381.516 4359576.871 8308965.139 3217266.71 3487152.865 3388525.107 630780.4455 4333464.925 5361642.756 5579791.579 888379.457 2637794.169 7199384.936 5811891.676
cis-5-Tetradecenoylcarnitine 33877575.1 51103479.85 21378795.75 35542673.37 63548946.96 145754885.5 37426407.86 19669555.38 21077971.92 26670242.34 124902832.6 125944686.9 34394381.33 17017047.09 24753658.26 16543021.18 120190589.3 103166899.8 17584334.28 11164406.71 25170538.88 19664222.9 99541790.42 46858789.16 12962871.61 7724671.944 18481535.81 9057375.932 80089385.1 42278110.97 10757325.12 6021324.699 16362524.77 6941823 29546605.82 21909122.89 22662661.07 19123923.87 39284441.69 15212400.28 22967785.98 21689755.34 32105498.64 29130616.46 4174539.408 28110264.69 35674225.97 42517009.32 33057716.16 15870470.91 30522597.07 27685891.38 26254002.67 19951699.03 11747267.9 23745623.61 28723057.46 31416948.24 19318427.82 10029180.54 16319751.99 21834494.17 14728480.71 11934378.86 8009925.914 16469941.38 25313772.72 16483310.07 24195858.38 15570655.37 18578256.98 20844041.24 15855211.39 11079743.58 14495569.81 20961031.36 16077386.4 14384815.43 9055257.69 6004195.746 18402492.63 15361426.59 13971183.6 6301685.963 10700128 11112616.97 13805899.61 9098487.993 422884.1389 7206146.595 13577487.07 15140902.14 2624831.392 3994311.279 8985191.96 14196031.68
Citraconic acid 3109869.308 3868265.412 6291721.532 6160575.515 4314933.532 10429771.19 3892049.519 4333505.198 10309054.02 13593198.87 13446031.92 16868903.64 4696183.12 10231779.86 10720718.24 3889056.558 8135706.097 18791833.8 7722430.479 8319856.527 12902566.3 15835286.08 11375805.39 16176676.01 7326031.643 9041023.681 9975281.198 12637424.12 12136305.34 20550532.76 9487313.841 6821736.181 14979799.43 9951368.61 8469149.712 16046959.59 9294797.521 3894877.106 2156000.634 4150231.124 2273796.763 8891289.053 6026231.159 5814496.444 3033101.023 4751964.68 14917000.22 11567388.1 6074254.797 9968419.756 6263021.543 11182007.75 10194184.8 7531909.364 10913825.31 8211022.076 11470812.29 14252481.97 10132026.57 7809800.6 7942440.382 7574769.546 7892021.422 8071288.906 7950493.292 7839693.543 2673777.553 4975971.408 3133363.808 4891052.145 2809520.866 3366932.25 3669740.546 2199032.017 3161933.201 3136090.137 4992415.702 5089189.41 2716491.712 3361441.094 3615100.998 7676790.003 6561451.236 7781331.16 9708380.113 3409363.747 3142295.842 5565227.084 622493.5332 3835318.964 3841015.478 1601032.242 1736820.744 1963870.145 4729477.034 4770148.674
Citric acid 218232897.7 720161406.8 549185780.3 531437164.8 531999619.3 885555780.1 360098461.4 548074677.9 477420633.1 1007538830 1918665242 1641030792 603926100.2 853667594.9 587179992.5 1086859136 1971525413 2177174118 467231667.4 653774380.7 617473037 1358567011 1587288136 1641972827 326986021.4 572685174 502704804 596043082.8 960624823.6 1261424788 290014870.4 587609948.7 771587656.8 482242328.9 365562466.1 1012342591 829281887.8 488168452.8 250259066.1 505626480.4 647991406.3 1153943910 1658672348 251299688.3 122359089.7 428765145 1742597543 1736624924 436748076.4 787473166.5 811715479 814253950.3 1161162459 258407012.3 824600901.7 506108409.4 1180336969 970065043.6 294422537 454607548 616532410.4 522915902.8 562705001.9 371176581.9 863475326.7 562625355.4 397930799.4 385185538.4 780022192.7 788970639.7 677518130.5 307270942.2 203330173.3 238934493.5 330194155 152210453.7 113186240.5 186899000 363142144.2 88538254.77 119182558 161739428.3 172559988.4 297130576.7 178005120.5 74180126.67 190311939.1 198103327.1 12080791.43 158579517.4 138624724.4 694974012.8 35388459.03 181693324 242215510.2 167586146.8
Clozapine 1638665.012 735937.9203 985406.3973 841926.9332 1365342.789 1546132.312 676373.0934 668085.8171 1011603.187 753457.2474 1560347.015 1334146.169 819474.0997 2190612.031 947929.0532 605705.0927 1393435.564 1463032.903 707740.8808 666524.141 932824.8358 965613.8665 1247102.614 1471446.628 717681.7384 649551.2655 984606.8694 795976.6403 1552238.86 1633558.382 738338.4137 643522.5937 956994.2394 782230.2892 1465019.823 1754768.707 831565.6781 549713.631 753480.3238 740257.7773 836655.1469 552462.8441 554850.2178 748246.0987 342292.4881 703382.968 586109.157 599232.0272 796516.2333 663160.8361 1108717.227 587902.3148 585584.7814 553766.3924 449362131.7 641002.422 599559.845 753571.6667 655626.6323 608011.9619 622643.8601 546950.3856 538782.9281 676555.5779 561444.4833 636798.5989 3225061.113 840736.9054 660349.2317 617105.5457 637700.3738 727050.8685 631060.8578 619822.6077 721678.2668 658622.6649 1272179.998 3780826.156 701015.2919 449274.4775 545102.0855 1291109.491 550929.7096 780762.0065 664176.0917 569856.4596 1414461.472 753217.2316 337914.6467 501715.4976 269735227.5 2614232.55 359546.5702 573279.9547 641245.0765 734795.4887
Corchorifatty acid F 1046570.799 1442254.997 898729.2922 1569157.171 1780487.698 1679796.039 1373577.497 1532483.652 1181523.261 1071907.738 1257323.068 1259801.474 1985953.789 1564891.339 1376532.446 1277375.574 1528712.243 1701829.94 2328334.655 1855008.988 1597996.358 2177795.674 1724892.102 2167815.627 44433825.66 2228797.291 4416968.662 4835342.025 2867160.802 1736695.506 104141154.8 10001809.51 8608173.225 10460419.2 7556693.03 2936472.864 1303387.788 991045.573 1578414.349 1433852.294 1353982.077 1561295.784 1377315.152 1373367.238 672602.572 1573677.118 1624748.953 1949468.868 2673652.932 1756059.672 2497956.809 3229306.062 1654268.951 1409486.734 1786111.771 1801534.698 6042232.244 12220584.61 20117976.29 2236196.439 2471750.763 60827787.65 33769113.41 69887121.16 5243070.814 4729688.486 1318570.281 1488521.799 1149471.377 1232173.64 1449192.235 1561143.412 1492206.304 1403639.783 1593561.507 1511327.93 1377328.867 1585258.567 1795732.264 1170092.668 1462088.257 2100447.474 2087037.603 2664339.66 2519109.269 1902528.007 2354901.019 2660986.286 759604.5078 2083429.688 2672779.68 11566784.71 3026253.302 4726951.284 4309754.031 6686226.502
Corticosterone 31151008.97 31786611.44 30377074.85 34043761.14 62424371.01 79536535.34 35851577.71 29007975.48 27929358.83 39414336.33 104434016.3 80368491.32 45246269.66 33211341.49 30970673.78 32686711.85 100060878.5 90704617.82 42058206.02 29281914.84 32375054.04 47672852.27 85880317.84 82247651.85 42123780.99 26152661.28 28484562.59 31915479.61 64920871.04 66464945.7 49815684.93 30783214.73 25900485.77 31264576.53 38289808.44 63759491.81 38588616.04 15913048.53 27942687.11 41023854.57 29485375.1 35935589.64 32990818.05 25507364.97 9237971.673 34208072.56 49815472.44 34706829.82 27987235.92 50790333.88 38489802.32 36289596.33 29981603.82 22297289.26 46493344.7 33321894.42 38343171.2 31736800.29 28936411.87 40090102.36 35790768.17 45480586.97 20523697.63 32514597.86 35607435.36 34673272.57 10279155.97 5629969.074 6816834.213 13188116.1 17851560.71 12039840.05 6830875.753 6547398.918 16380148.29 14916533.18 10945590.48 8887863.497 8759680.046 7476022.541 12801172.18 11550777.74 8395692.343 9716067.57 16731608.86 11324152.69 11258858.61 6985118.601 327730.072 10256282.71 14152887.44 12049919.5 1673003.317 8043320.488 15801695.64 16847178.3
Coumarone 2632654.807 6328853.292 8661596.595 5350439.936 4746504.095 6923057.759 3435847.98 4797272.926 9567286.97 4257783.139 4857436.014 5345272.441 4448332.747 6043127.532 9596561.64 6611807.324 6321573.621 6621779.01 4521590.217 4875913.106 10922337.21 7364036.843 5889013.213 7388068.358 5991742.812 7314361.211 9410944.689 8638726.832 6844182.966 8834782.229 8047910.379 9608623.134 14704895.85 7982443.73 7530101.095 11793113.54 6143953.047 7435343.755 6098453.269 4972720.95 9621879.186 6309193.535 7259324.374 7196087.8 479421.283 11855350.55 7868905.595 10246162.6 8038794.126 6160631.423 12963553.94 8359256.267 8144286.975 6661005.96 9113045.258 13202193.4 10569079.51 9117028.372 6677329.116 9828690.266 14208838.24 7892102.723 9325077.398 7852201.531 9175074.622 16793792.1 6323997.833 6015793.743 6520936.394 2638063.059 5033004.45 7536038.711 8562412.52 9189244.501 5291687.874 6308507.278 6492343.257 10936280.07 9143082.524 4384403.187 6980179.96 7509975.398 6956812.757 7018700.672 6412573.288 7441864.338 10126433.78 5852108.29 968210.2417 4225851.138 7008569.795 6530767.788 1077938.101 7903149.689 6508509.598 8222167.286
Creatine 202404284.2 242288222.9 360611937.6 187807379.7 191437347.8 237921323.8 250410255.2 199713784 215039694.3 183848025.3 347292919.9 220857799.4 214366554 228959706.8 321766752.6 156345376.9 248331664.8 248763148.1 251512542.4 267437838.1 378118085.9 209819968.8 276660808.3 274283298.4 122657148.6 253446617.1 182716173.8 89282578.31 292377404.2 252106872.4 230233689 241495633.4 224366577.1 217920845.7 220285981.1 326695847.7 226525777 175197690.4 182072634.5 209651825.4 205603674.4 250811289.2 238526040.7 189533378.8 191930602.6 182077826.5 274031483.6 224017486.9 214794399.6 221557693.4 146346994.4 224264122.2 210226789.4 262757684.4 200157133.9 446972918.8 245740411.2 236799956.7 202484318.8 220492265.3 237060660.7 208710467.9 189719677.7 213211086.8 225108374.9 237443491.6 201517642.7 314675108.1 335643961.7 204372396.2 214510986.6 276385605.7 358646375.2 298855453.2 248099155.3 121998061.5 286456219.9 394473167.8 363095230.3 179445674.3 246548408.8 233094556.5 327005198.6 372920072 249022983.3 216346702.3 291076241 344762010.9 254302529.1 203489897.5 123359509.5 280813513.6 294490143.4 299979321.4 239801960 252444540.5
Cyclic ADP-ribose 33830682.88 51253972.29 45038328.55 47210544.15 48805924.86 55539169.35 18711602.3 40693795.62 39798505.1 19216728.26 11338255.62 16669658.33 27691360.94 35124538.02 37147559.83 23441785.29 14452301.44 28909861.88 31291488.45 42935089.52 46835836.57 34865232.72 18462799.96 30068945.08 11792577.91 22710095.93 18267698.33 10793724.42 10272348.18 12596307.03 1244918.45 5062231.332 4421623.048 1898111.948 4877294.994 2790406.918 47851566.8 51627649.6 52020557.95 35899895.87 58918062.41 4338614.232 15831069.01 46276103.07 18427980.85 50326288.44 19440798.68 27428059.47 55958722.24 30527966.26 58375004.73 23938915.64 30529926.92 45672767.42 30389242.21 47199204.6 17832624.71 17854803.54 25211734.11 15863048.28 33235515.74 1685654.992 6815576.957 4687398.695 886838.3512 7548534.846 15288527.68 17176801.11 17932628.17 34810809.14 38466091.28 2169749.566 2130779.363 1394870.483 3306195.308 3697553.391 2305094.661 2155129.474 1236404.2 1499930.441 2772069.204 897324.6091 1669864.47 1414944.503 1942167.221 1565813.398 1874355.785 1203988.637 181799.9562 1088564.458 1696013.812 1779398.15 404492.2646 941682.2501 1288448.573 1200791.144
CYCLO(-SER-TYR) 5992901.985 14120337.78 5179749.83 13573812.29 16186180.32 32758335.54 7266118.797 12391409.98 4725898.731 13452961.72 32280726.76 44006154.04 9525070.412 14730654.3 5371579.105 8901954.738 30214047.38 52267733.31 6519767.374 13404279.26 5578130.559 12154304.8 24524636.33 42644585.05 4680511.229 10233955.88 4167469.472 3874789.258 18877004.99 32617739.11 2393187.885 9214545.691 3778779.144 1308868.697 8205128.994 29824766.42 10230996.48 12207849.53 11729288.18 15604843.07 25216336.52 13890013.08 35667470.81 10973258.57 3182721.902 22195492.67 15758278.54 32947290.39 12639359.89 21002199.33 27645150.76 10204175.72 23646949.84 9587957.917 19827205.8 22760546.18 10927240.84 22957271.96 9765423.611 15101146.3 22797824.93 6528381.756 10359905.76 9001186.319 13509922.25 21567951.9 10564788.44 13078824.01 11725850.42 8872496.578 8168546.314 11309497.08 12845127.35 8222069.969 12213292.52 6441973.3 10234674.56 14175757.43 9032303.094 3922334.95 6503189.642 9921569.159 11505749.28 8118594.204 9275924.318 4799418.433 9200195.197 9636514.89 166601.0264 4665414.519 5896224.324 8567703.627 1586111.189 5525680.644 7910545.732 6394190.202
cycloxazoline 18313824.44 15911228.77 26438424.58 20561710.14 21824268.37 21542245.7 17726883.76 23365726.03 20984591.51 20521721.02 50395933.48 18014098.4 8047906.012 11926717.67 9573115.167 12322170.52 14600604.28 14265184.24 9523591.123 19074139.16 20873410.32 8591378.88 10036068.02 17737110.97 23481904.41 14413801.32 14567119.31 22958584.53 16580515.95 30368115.68 10736601.63 6113090.72 14937056.71 14535193.23 16832448.18 30889899.49 20846797.12 8578994.281 12331287.6 24311627.98 22562052.18 16373512 31509961.08 12237438.53 566177.9374 11721535.76 21710782.39 26910212.31 14084619.91 23501237.94 11077521.42 15802618.21 15982364.76 12139692.22 23484122.4 5330356.457 12449426.51 20546356.82 17007298.48 17933141.23 18806431.96 9316816.306 5850468.523 18574065.42 26774887.67 8241516.669 22255949.49 35039267.49 14211678.57 13439465.44 18241742.44 22797794.84 23132861.32 11543466.95 19307970.07 9900322.132 28199074.65 17686497.71 19436875.45 9265313.768 10224281.95 10546014.63 11106773.48 17321967.8 8027034.794 22212119.8 13147763.51 25151940.56 5734006.98 5875798.551 10400193.51 7584295.809 2322878.015 6200351.173 18905636.11 12522228.03
Cytidine 5575174.37 10224029.25 4842885.155 7040926.385 3027634.838 7368175.827 4807675.141 9173845.844 4433082.301 7495435.407 5774213.145 5197915.738 13200334.21 14474887.38 8463432.591 11558339.41 12152864.07 10917177.33 19532323.26 24660633.97 15349301.45 30052592.82 17103383.79 20331511.06 25790613.57 20130978.71 25220454.82 26215123.59 30265930.21 28651994.66 31205694.73 25177864.88 33330809.37 31770993.88 30937921.83 45308328.11 4322303.596 969995.7798 3378762.039 4270390.128 3652910.082 6611663.276 4102690.298 4999132.339 4711970.205 8757403.983 16279211.81 5114986.72 7246718.544 11705663.45 11004368.43 14632362.3 7302438.85 9058698.201 11625813.5 10779369.43 16449198.64 15563105.15 13165085.57 12617371.5 27323382.66 17892742.1 16507860.48 18893217.88 20800028.47 12721377.18 3611514.302 3856566.921 6218284.411 2303707.105 4167488.134 12758354.22 8652300.771 14042948.62 15502880.3 8931099.06 15777901.57 20610107.51 19467279.72 7852674.672 14665027.97 27472512.6 34642304.66 29784546.37 19005586.76 29510673.18 34405462.32 38912690.75 206513.1272 30134473.47 31132552.38 41171729.54 20948343.22 26708924.94 39354074.11 37879890.52
Cytosine 6545579.256 8984876.55 3666626.141 6352522.442 7295589.319 9166109.715 5014859.758 3635887.949 3960307.507 6731843.414 5872081.008 7311804.387 5808778.703 4972815.63 3023892.372 5035878.42 5757457.392 8189034.676 3406738.11 4113671.949 3866560.883 8447603.68 6559195.472 9760241.232 10227958.17 4397613.176 6031171.644 10268080.49 13826843.31 13242684.38 10840745.92 4857804.382 10906344.31 8117122.83 13291154.55 17889311.51 4697292.334 3100543.289 5634293.487 5421940.195 4316228.555 4458574.391 2753062.712 2459233.326 2752041.856 3667217.755 4192801.558 4415354.616 4193984.64 3446182.848 4111266.417 3341957.154 3712224.321 2028209.646 3829181.581 2548596.859 4149588.69 4600445.046 5815090.502 2563915.09 2766254.193 4323174.708 6757643.034 7357873.053 4527258.697 3756375.434 3619930.7 4752893.665 4633226.772 3789204.331 4164665.351 7875700.291 3864262.09 8427031.327 6817762.742 4447626.899 3763347.485 5744247.838 7707800.597 3850069.36 6258542.804 9168495.374 7274657.973 11925661.16 10047061.05 7806293.928 11267509.38 9208398.258 1611753.036 11259652.67 6897992.666 12299238.64 5866236.28 8083698.469 12409901.49 11182845.28
D-(−)-Erythrose 7740873.244 23718195.05 14661712.65 12287967.34 12947495.96 11294968.21 15022445.56 23159102.5 15014903.72 20807788.57 18872641.39 18833186.12 17568880.22 24008963.93 20348038.21 23277486.7 22008188.16 23569408.37 32376533.32 38365381.91 44595971.68 44400093 36711470.81 28162461.39 34670586.62 31732104.52 32604209.13 26385138.58 30517994.43 24132932.94 31003755.57 36349679.16 29273303.87 44332484.58 32043608.45 29091771.03 27850235.42 6813933.603 8786857.75 20999388.17 15292448.98 21923739.46 11139813.11 12016438.79 11074464.88 17764430.1 38802388.67 17169446.46 15067739.1 28890274.8 22983645.57 33999731.89 27115046.85 24536389.96 45636445.66 31430613.65 42531531.42 30255343.9 23210795.06 33152268.42 32869032.09 35135462 22859155.62 25237890.34 36009675.99 36305926.25 31217438.71 23664171.26 18055814.27 23907470.57 22149053.54 39038758.91 28328033.32 22974638.97 41852039.2 26225940.18 44221840.24 51605400.02 34309995.57 21842773.25 36255635.27 60643942.22 41143623.39 56613951.06 39083568.99 49430995.55 107004982.9 40305822.82 5745475.89 38929385.56 43271371.04 75148122.96 15637190.87 54277985.86 54279326.07 56570520.5
D-(+)-Malic acid 50800697.04 179432263.5 141558798.9 133802835.5 101754547.3 139466697.3 100144175.7 191677049.5 175401301.3 175533960.1 78924622.61 127291372.9 190001289.7 253947272.2 229751219.6 195293247.5 114293028.7 219609066.6 233733718.3 346126036.7 351669617.7 370184244.2 182322154.1 313115493.3 245844113.8 345449036.2 291074265.8 264907622.1 219047657.2 361833907 287054254.1 412287950.5 383104328.4 307552799.1 218043356.8 415421349.6 253175619.5 77912464.48 125845019.1 135757527 192225040.6 202428908.2 90990360.54 114272475.9 67206552.48 157940804.3 376116559.5 163297281.9 178970026.1 234927122.6 240082987.6 350360626.3 177714689.9 165465705.5 302196252.6 244339770.7 504430685 199076719 152737015.6 289360889.3 296272905.9 446651788 158261729.3 186515512.4 530505367 356991163 191002079.1 196515075.3 248135183.5 147516977.9 160393911.4 417351620.6 343667555.9 294549590 251280972.8 335475048.6 358525494.2 431350371.2 529011635.8 175599057.1 330776663.5 494992503.8 544380600.8 684621890.5 350880875.3 438557959.2 491063584.5 542390777.4 2676496.649 322803655.9 458231425.5 646837223 219394804.6 526358922.7 390589853.7 536707195.8
D-(+)-Proline 111217342.2 190223433.4 228254317.6 106537273.4 87350050.59 94221544.33 133153452.6 236828200.3 284741714.2 166076576.5 156162141.3 150248767.8 230499979.2 314055025.4 376945848.3 222285952.4 186946981.2 218611878.2 292878084.8 371766829.5 526623373.1 404520486.6 319712712.4 348006999.2 318817497.5 332559013.6 459703282.8 350842481.5 352927534.9 408244093.1 406887624.3 431618620.6 580015206.9 444003674.1 361799676.9 599566010.5 195906172.2 271325176.8 166307793.4 307966044.5 433319033 241314605.1 377600129.2 222352250.6 138335096.7 414899326.4 433941648.7 459517030.2 288846927.7 490779413.1 568855323.8 416456906.6 441721085.8 335176358.2 553109055.8 596963797.5 570941189 480601423.2 369754457.6 519784709.1 631480316.1 555415800.3 448280805.4 462912336.9 717270681.6 705019484.8 221979011.4 247899418.4 369647975.9 147993821.7 248829372.2 343065322.4 385349002.2 458490204.6 263051235.2 360157378.9 386221470.8 438760183.3 534164650.5 216734652.1 391800403 401942915.4 488292376 594770935.6 333115592.6 378906514.4 373662113.3 458991792.3 154292088.4 273336981 435566721.7 476286472.6 196888287.9 531073559.9 399391122.3 519009877.2
D-4-PHOSPHOERYTHRONIC ACID 179632.5988 381662.1344 577807.0558 193604.9382 151600.7612 293083.9063 213970.1823 593052.6119 500221.8668 200451.5039 184253.1455 440165.1815 304378.8867 681835.5624 1288819.936 481306.2644 450295.3488 1601976.405 1255591.018 2273015.993 3043197.362 3520675.195 1376895.573 4212010.809 3615083.891 2489525.726 5236242.657 5574688.241 4971506.313 5798745.736 4406738.967 4351736.239 5602585.24 6875433.7 7085922 4109761.335 1113829.589 121860.1298 363684.822 1076352.786 854978.631 842286.5352 268439.1742 968677.6442 237350.8676 1599056.166 1689318.943 882317.4879 1426421.77 1840276.486 1639888.06 2039601.773 1373337.223 1683913.607 2616427.337 2532632.663 984977.4523 2851076.172 3603173.686 1914209.812 2489045.299 4040193.692 3299553.763 5647074.749 5654641.539 4400424.915 410213.389 434268.3099 205528.1325 352057.6961 764200.2268 1409991.454 1708181.911 1850074.166 619642.931 371021.5692 5753003.54 6788663.732 3419964.46 2577663.535 4142114.441 6599687.775 7647779.375 6681596.926 4829252.15 4206138.381 6287889.297 5811898.966 113080.7868 4527509.513 4970993.6 6225992.101 858892.9261 4552760.589 4698844.92 5090962.114
dacisteine 1190255.828 3310981.458 3350698.92 1762525.587 709657.5124 2220428.829 748798.5634 2265725.473 3210206.189 1462247.64 2276334.798 1935601.051 2456594.524 3965227.039 4110280.068 3292749.889 1840107.105 4476623.04 2826469.807 4322010.178 5049143.271 7706637.567 3882302.396 10628148.13 14509255.53 33005435 17445423.57 33306363.38 12193186.01 41906312.05 59125715.18 107048154.7 53126723.77 98231383.28 46508752.44 180473601.9 4128001.038 2691961.174 814217.3942 3279154.375 3008641.881 1972045.007 3303563.736 1048245.489 850560.8431 2886737.813 6414124.909 5618906.614 2080313.799 4520398.823 4411212.175 4168174.487 3914444.999 1888275.129 5815498.494 4106023.771 39382393.27 8072761.921 5611710.79 33449567.04 41199065.72 70988456.79 48572859.45 21960104.79 78624503.4 73905627.58 5576994.187 6535689.66 8178792.01 5610210.684 5691816.727 31112036.82 28717270.37 29547318.63 21490187.5 18309315.97 35398699.74 57026022.05 61820546.1 14504466.85 28882372.71 30163079.34 41635342 43242677.13 15576532.21 33157949.21 28273446.45 35562736.91 2387086.6 20055295.09 40045478.91 43739399.4 9248309.655 37163469.5 29147464.5 54943000.59
Daidzein 6240390.723 13515288.03 7598314.185 11661639.32 980985.044 4566492.677 9281141.414 13740747.46 7379526.635 15862498.99 1248131.09 6470517.852 14341810.41 19077960.09 8573981.148 15118819.21 1311631.253 9260358.687 13202676.65 19312601.99 9969718.104 25677661.55 1992450.726 7555116.136 10236830.97 17030463.64 10081168.61 15423670.86 1331839.555 8431752.347 10882032.36 17271698.6 9387815.362 17083424.19 1729239.804 8074265.731 11560923.16 7313596.357 6461003.305 27544710.54 15201719.96 18505974.1 18661018.53 6379940.78 9530450.506 15860114.89 19343593.81 19849511.59 5506912.741 52070516.29 21699790.49 16088675.71 18594885.98 6085715.105 65994729.39 23502346.99 18934810.36 16279791.79 6204227.547 56327087.94 25352215.6 14369245.35 9604559.757 7717561.307 42656232.13 26574599.86 10740584.06 13298671.33 18549280.43 14635160.29 22910361.88 12932906.49 16825868.96 18221517.75 31574041.55 22133581.13 13212394.15 21098153 20336950.62 15122742.31 26137506.45 17695323.9 22618543.82 25839396.85 41994531.75 21389451.75 18496300.31 19924771.11 1147411.904 30948894.55 31026987.54 15772320.92 4686091.565 20652511.99 45853785.27 40885856
Daidzein-7-O-glucuronide 288466.8976 247976.0285 325114.5927 575174.5165 46658.81694 126589.5123 400413.9464 265221.1515 331539.8873 1103383.105 48214.85941 300019.2387 502330.7632 440001.1694 408531.1904 773147.9185 59697.62293 311469.4252 455220.571 250460.0012 289125.1326 1119197.295 48198.67075 167415.2489 244011.8025 150135.4671 252864.8066 552920.6473 46981.56987 331485.4946 264902.173 153214.4008 225718.1273 399680.1647 47897.63915 157596.5315 593212.136 908278.1788 581742.5367 2876865.924 1616388.867 1563357.955 3215430.113 416110.8978 783860.5695 1455926.2 1091927.818 2660493.926 546677.5619 4443192.152 1984137.882 769407.1249 2204559.746 336688.4295 3943686.385 1495715.898 667687.3826 1726927.688 458949.4042 3118608.32 1416517.495 410172.2963 607782.9914 393704.8441 1730586.175 1526801.56 296682.1213 481788.8989 599718.2834 1453289.998 723333.415 260769.4792 504831.9716 461062.9572 1554243.822 744981.7007 210295.3859 612025.5273 457434.94 604415.8803 586020.7624 251135.5792 435164.6959 456357.0612 1213194.994 378885.9892 276770.013 345555.5235 31698.54369 672028.1831 669669.7202 377255.1376 41775.47675 365582.6777 1178240.32 690780.6865
Dambonitol 295158332.4 186856574.8 340163012.1 150281635.8 247674859.6 250066012.4 180525121.3 190468377.5 255236858.9 162761604.1 227535388.5 83279450.45 170274491.6 119084567.6 188342582.7 39281596.44 203688133.7 274442953.1 151887739.6 110742761.7 242579024.2 171378737.8 143938423.1 206836143.5 227047487.1 217605246.7 167024088.4 184317412.7 238217758.3 242886143.7 136414169.2 150513537.4 248505049.8 237860227.4 231114106.7 337251198.2 177897766.7 19211888.24 157394502.4 119653739.7 241378573.7 96386516.53 88822665.36 107577754.9 10879662.77 191750955.2 179339405.7 206906176.6 262566661.8 205742600.3 193735355.5 161285548.7 168645734.4 177506344.8 158834432 142589106.6 92845015.96 293722178.7 126360642 106006995.5 200904172.1 170267030.8 56922600.92 287854936.1 223665721.7 224629588 303005439 294683858 204174480 77476632.19 184056047.6 275741042.2 268568416.5 214570420.7 128957738.8 163202031.6 249771696.1 135017784 245765706.9 19624216.51 143269349.3 146875701.3 74048199.81 209574879.3 259962046.4 55755156.37 109105023.6 101841534.6 3308077.574 35870415.71 169529426.9 114398611.5 3981763.069 89190240.21 147353247.2 201363472.1
Deferiprone 46499517.98 64059145.84 61121168.86 65896008.12 53835109.27 56759936.42 33459445.05 57791091.68 56142757.61 31003982.02 19060521.19 20445139.38 45595467.45 50898895.53 57659173.13 28956110.6 29288124.86 36135755.12 42176597.75 54645329.48 71699009.49 57472808.48 31462867.83 34380115.43 59129960.08 48586897.59 58652848.58 58176587.1 47668461.33 43476321.1 56793134.79 56486689.26 59883670.39 66584139.78 62136423.41 83583371.83 60850940.23 39689271.88 73764576.1 53950684 68702575.5 10515922.6 21935835.4 67190094.43 9540571.782 59628995.1 36467857.2 36331133.67 69668020.01 48696453.89 59182964.53 33302846.78 33744208.54 59584800.48 48234419.36 55318771.94 41046405.19 43608761.56 62666545.93 44913221.39 63706544.98 50694391.92 36552114.07 60086077.65 65624871.93 54078218.44 71275818.18 69603151.74 76840361.59 52468876.67 73873204.32 67041948.86 63721407.06 60777196.11 55753778.11 56408229.2 68589890.63 76973243.14 65102507.78 23550016.57 53997511.59 59206308.03 60734882.56 77973197.67 57742909.42 42558122.82 63212401.57 63589989.71 3644086.41 39272010.49 54010362.97 65258628 11888671.44 66548281.35 62785123.26 63495944.33
DEHYDROASCORBIC ACID 3559297.602 3825938.794 9205388.679 8113339.761 6420327.796 11920893.91 5176804.865 7173202.632 10906411.65 14759530.3 13653113.56 19769259.64 7613984.59 12278158.43 11222794.5 11123003.18 7496725.151 21103745.54 4872593.523 9752880.908 21228626.91 16533856.18 7421875.61 17203103.7 9019516.851 8315999.954 17716770.85 19953022.72 10489301.64 15860151.33 15836902.91 7418396.035 13004273.33 21507295.94 7732203.918 12495486.88 8806575.665 2286881.179 4670535.825 11596925.66 5941417.579 18972729.06 10516139.85 7637329.168 674554.9122 4192772.075 14724436.19 10881343.82 5910420.354 11913361.99 10373500.73 7254128.267 11295860.2 7910677.825 11698403.5 14126009.02 7510656.804 11777043.15 13677134.08 10108447.23 14139774.57 8271043.624 2980514.208 9561368.25 18290897.53 12818253.63 3748154.782 3589509.95 2480880.791 1404261.729 1885001.932 17392932.49 14376355.42 7254757.304 5320755.977 8371994.772 28022993.33 25412174.06 20499101 6543713.692 21379297.41 7748089.377 7912613.885 9819574.03 11060806.92 6593518.622 7068322.018 8761983.148 687141.7149 4926177.023 5123231.637 6473090.36 451570.4864 7355333.509 7440720.25 1342815.619
DEMETHYLCHLORPROMAZINE 636824689.3 88596658.81 402318053.1 391234977.4 525034726.3 576002602.9 672113290 104674357.4 516574376.3 562969761.4 1183217628 694209810.5 843416356.8 122630233.8 593435868.1 445162193.7 1115787690 937210073.8 1072754151 160750319.6 875616322.6 2998301174 1302363692 1008327016 1044169761 214576506.7 889441570.9 678683564.3 1060659345 790575391.9 1230622069 313771416.5 979413337.8 801454133.5 1027730417 1219325110 170053.8179 122533.6748 147922.1801 1642006.279 167077.9584 137542.8656 150630.6226 139064.712 99254.69943 151928.9398 153157.6414 6089153.308 138150.4287 138023.153 129495.5331 147546.0274 141453.4434 173391.1258 160133.6979 150228.6121 144714.8641 185433.0345 172716.4348 165009.2867 148290.5329 141758.8868 119446.4794 185698.576 191683.0201 153060.5411 218728.4879 196113.6428 134837.2665 153199.1996 230733.1894 173416.6775 165477.8015 140818.731 135929.6962 549520.2379 218808.7724 181376.4069 190405.6119 132174.6029 597422.4356 434095.3604 501427.3401 450324.7555 367509.2379 535565.2019 378737.0361 161495.1245 97080.5131 201425.5854 947228.8564 362592.0364 145108.307 498403.8959 176643.9406 932068.1847
Deprodone propionate (JAN) 623235.676 469023.1169 483779.4853 524233.1689 524183.4308 452344.9424 358045.6093 481675.1499 419333.2723 404807.1145 408747.4184 430571.6482 563937.8745 320370.7322 297245.3402 258005.3487 370762.6761 404321.2526 753268.407 419928.6462 592251.6968 856283.5903 334596.2126 383100.6415 404777.413 329900.6616 491970.9886 354800.8211 496753.0897 386050.8489 336773.2622 856740.9654 366110.0357 697561.0483 387282.7092 437989.398 563698.6339 331562.1607 397384.6312 521737.167 567717.998 418580.2226 479568.8052 388997.4334 187986.762 393660.9299 410186.7164 348424.9196 401034.9214 385019.2675 321044.2203 357617.034 360257.5258 342381.5265 315289.4206 292805.9539 321220.5339 365883.0567 356971.8911 316084.6365 352475.95 523472.9117 346304.7922 325426.9096 457372.4283 907240.8184 490070.5196 624653.0894 408353.0551 394569.2183 405654.0741 443315.8975 337449.4541 376316.7156 506391.5722 284379.9559 464808.6658 376023.9682 389429.8908 270104.6307 316732.6108 3076885.087 3768395.127 3596786.29 1943014.601 1617170.55 3572756.284 2580174.975 148611.4347 1306268.787 2799911.157 5457734.83 893099.3048 2517495.796 1822658.323 4066747.271
D-Erythrose 4-phosphate 2228262.586 5475972.505 2554120.65 5627076.049 4491423.321 4379457.865 1755253.825 2720898.384 2764695.98 2130476.694 4483655.93 1197971.839 10676459.22 3939854.875 2996920.525 3469928.743 4420020.69 2251493.196 2271154.68 2055230.907 2448975.602 2393021.901 2224390.15 1274334.522 1189412.953 2030838.641 743719.3779 546104.7077 684281.3325 556645.6558 680546.267 2492165.946 377262.8442 1063657.767 316197.5375 369324.9272 2342141.579 3560498.964 3301942.37 3119291.728 2886096.462 1221148.032 1345188.823 2227248.866 623958.163 2516400.435 3306444.364 2838667.151 3445811.973 3056005.396 3473048.786 2496186.471 1819596.121 1544666.752 1975519.477 1785368.612 3687948.364 807599.4324 747377.4016 3115025.902 2591324.915 1965644.57 203475.2732 403705.2667 1830390.985 2762539.129 10846928.64 8866158.127 19416035.62 5124041.121 5413282.803 12441859.69 9451743.053 8459847.724 11547482.57 9959856.719 645772.9226 853094.2618 17765021.88 632540.5568 776960.3531 836760.1692 1183074.759 4116328.087 705749.2867 752607.4141 940085.0246 705715.5596 442547.0236 542466.384 758754.1899 941165.3918 418118.728 1065304.56 394177.708 642438.4703
D-Erythro-sphingosine 1-phosphate 88889652.49 168110298.4 176388673.1 136385182.1 225661870.2 203068778.8 101606487.2 157784106.2 176644139.1 144730999.5 214939262.9 175671765.5 108436811.3 165023315.7 171323811.1 94082268.57 218372741.4 192046070.5 89230852.51 145026836.2 160127501.6 135781598.7 203341740.1 170941033.4 87482267.47 126804003.2 154691450.8 104766509.4 178404906.9 152481711.1 61459949.03 107219867.6 126472286.1 95299754.64 128923528.9 149064369.8 316575129.7 208525380 282797194.6 250684818.8 352146320.8 337500652.2 348508828.9 267596867.8 68788790.61 347997169.3 341791880.3 323869830.2 225219974.5 331490321.7 311203956.6 313793148.2 277811434.9 219311904.5 233227751.5 270165867.2 285631648.1 269136029.8 207159513.6 243974729.7 233886816.8 230731113.8 115150892.1 180986828 120719983.1 232470207.2 247075797.5 229126852.6 239009046.3 271453042.9 302693445.8 284415631.7 272010188.9 251076326.1 302072136.8 289863228.2 229701691.1 214348235.1 230362852.5 135270485.1 243559483.7 164046078.5 141513599.4 198750789.5 161641405.2 114363622.3 143345285.3 110836235 8268190.793 83010971.86 137638618.8 58970971.91 14390770.92 79905385.23 92451902.14 76014759.74
Desmeninol 994090.7038 2084382.464 1909447.047 1891853.575 392255.1856 453758.4641 1263243.017 2133039.072 1964006.651 1690930.41 922538.1418 504334.7821 1637616.742 2447587.954 2354288.062 1543504.119 676344.6411 808428.0087 1966732.925 2746743.938 3175611.761 3427489.011 1409739.69 1024465.062 2296913.502 2262422.36 3019399.839 2579859.52 1598672.575 1303234.821 1936011.8 2875772.29 3009402.627 2986737.757 1106988.805 1440095.176 3119298.432 1826997.224 1716862.855 3053224.584 2053094.56 2897248.924 3372918.941 1767825.446 537984.4669 2249530.532 3593401.216 3798228.706 2047582.075 3999093.512 2818452.909 3595081.466 3785023.02 2003718.821 5236967.991 3624095.63 4100273.814 4409794.186 2359660.818 4125293.113 3535475.289 3891825.855 2585313.822 2571730.013 4794324.725 3921760.617 792378.6026 866852.8506 1183560.743 1580562.654 1274844.807 998458.4669 938947.2315 1052110.382 2385185.102 1321808.602 1043813.459 1159628.369 967217.3097 1035988.181 1268247.312 972058.079 1108283.972 1070643.703 2359529.52 847253.1538 924968.6692 974334.5347 171970.3481 1349773.35 1419035.588 1227640.552 276130.6518 810134.7583 2158374.227 1632260.6
Desthiobiotin 764196.4677 2162608.491 2723577.301 2198894.556 743006.2889 1251511.797 1381004.923 2177562.361 2152015.138 1499290.403 1980664.421 2081474.905 2737049.909 3140720.638 3228634.629 2247247.575 2676696.607 3926119.305 1215477.716 2828859.917 1573545.977 1583819.86 1196904.573 2800491.305 5083194.032 8235535.172 3319513.092 4509808.43 4796497.22 4407545.823 8802313.493 16408211.95 6206410.682 8087704.857 6764175.163 11403980.58 1012046.282 1147394.985 2606568.834 3059546.689 3139860.591 9983960.874 2603683.811 6606493.516 1111805.613 24103124.67 10804294.5 4803579.388 27730323.18 8613722.44 11195083.62 4527657.762 1306876.144 4104998.168 4971148.905 4028202.321 21636117.37 3749309.78 7799222.898 15625763.33 12684934.59 15650446.91 5841409.658 11603739.68 20804814.16 12554994.43 10942015.96 6617787.345 15197781.35 3873814.23 6315873.928 4066746.56 6410543.778 5132375.122 4565485.026 3950769.694 1599873.615 1910918.678 1958923.905 2249280.909 1152290.277 1530111.596 1397408.224 1416336.319 1153537.281 1131458.052 1566675.568 4076973.006 587283.9099 2447768.482 1542963.939 4054530.569 844610.867 3262753.341 6086656.206 4389381.695
D-Gluconic acid 109900505.2 94128941.49 165328841.2 151635541.2 42652382.66 133714947.3 137641430.2 110193451.4 172962005.9 241737819.6 45730298.71 97659360.32 132167618 105175315.8 179233285.3 194525159.6 49702416.91 129403914.6 108515835.3 110648769.8 200054949.7 271984227.3 58815048.41 150101267.4 96895477.59 113626390.6 217636779.1 162237448.3 59140119.72 159480117 79300857.17 54962980.19 174380457.6 151433281.2 55846630.03 174587072.9 71499121.26 79789032.49 41225940.91 54432236.38 56078132.44 62864934.09 90271056.81 45538602.09 100904699.1 49264293.66 55489181.45 91348644.86 48688053.78 47721933.32 50726270.38 55398724.67 89442815.4 45929124.05 53481852.73 85719449.4 52318575.86 84272214.28 33197204.87 48599349.79 55023308.27 53063585.78 44566259.96 16902110.14 29822222.06 81452033.99 38699033.56 33963831.55 40818687.95 63172675.85 37183043.39 73473285.16 61730889.57 53501423.27 59258221.83 52966316.16 77963994.99 67752728.6 65087925.99 45967588.44 68569752.76 71581066.69 76162908.32 74409396.82 82171082.63 61425795.02 68551817.3 64547359.73 11574986.91 62903512.57 69094588.88 84413396.52 37370106.67 74331139.77 91961828.77 86005336.8
D-Glucono-delta-lactone 10775865.02 4777749.121 8685780.84 5991545.815 9453465.625 15442094.89 3725738.799 9674043.803 9666073.546 9693504.973 15120293.45 4704414.841 7599505.905 5063611.902 8625235.915 1379206.117 11052771.6 13008807.36 8355946.034 3963922.851 9532779.559 10082437.78 8948949.755 13799356.86 6113299.535 14392795.49 14999334.24 13761202.05 17044060.35 21686660.99 5472758.944 9251069.212 18972610.5 15957131.75 12429240.2 28573294.17 14367695.47 1060675.208 3684759.997 5626347.72 9982599.668 4816513.959 3687164.076 4277572.345 1645174.526 12789509.61 12629089.76 5429391.289 18001265.6 16997975.25 13072530.07 10366765.67 14868424.48 14605763.46 8738897.645 10381230.64 6498116.705 17833011.85 9486289.463 11912058.82 11975019.91 8381634.737 1191942.72 11292673.81 15935485.92 21120132.47 7254464.295 5721297.01 6706241.615 4006367.786 4889179.567 8521744.807 4798978.977 5979334.687 4646780.467 5909136.656 8815900.404 8111589.624 6722826.653 1194047.465 7111800.28 9809790.685 3929472.962 9338658.386 14089948.48 1565942.158 6252641.952 2848061.699 838743.1035 2087857.759 12971446.96 14546903.22 1640480.207 4352705.034 10377616.62 16758675.3
D-Glucopyranuronic acid 1005692.574 795560.9207 1056807.898 1268661.567 953506.2194 1304682.647 876464.4232 877911.1222 1243402.391 1046200.688 892946.3831 1185697.875 1287724.494 1872656.623 1514931.163 1378210.684 755188.7788 1372796.618 1351409.717 1877707.816 2578089.484 3465475.739 1235667.06 4973951.435 3046840.247 2221180.65 4852404.518 7473282.702 3016918.656 10669377.7 3227179.434 3515919.7 9900377.291 11544143.31 6855364.482 19017944.42 1803671.824 1153529.106 1101821.761 1315738.766 1477566.508 1930192.673 1171685.438 710591.6524 599006.0537 1229039.516 2529656.413 1190961.583 1130851.305 2268169.822 1894475.045 2579131.11 1260650.26 1436075.575 2162004.389 2368031.343 2711773.959 2099236.059 2422184.955 2354653.526 1757974.02 3484699.123 4541496.324 4903378.797 4165491.67 2795094.206 1235107.187 886766.723 843737.6966 669911.4733 1283761.295 992118.0654 1106652.153 845053.7849 691278.2649 594871.031 3847093.477 4739854.276 1985388.685 959303.2595 3708758.685 7515959.541 8676997.071 7633298.389 6442403.731 4730631.634 6254915.81 8568635.797 259478.8748 4294997.95 5578432.485 5737938.396 2885938.364 5290579.073 4102623.496 4768720.473
DHK-OH 124787373.4 56813005.42 107372142.9 48326631.79 101895137.7 66036637.03 48404704.61 85360294.94 85376334.54 64401574.61 98301562.44 26008677.19 53982287.03 24379078.46 64330888.35 32647735.48 91518135.01 70205511.18 59693549.49 27202365.91 70210675.72 55805984.23 59915157.88 80975087.29 58934116.74 77810895 73977880.01 75603491.94 74003085.23 76608312.5 39758261.47 27582216.81 75032863.07 65555446.3 80177937.46 150089580.5 81027032.42 17164386.21 38751264.85 39159785.66 108878256.3 27535859.32 37145205.84 24810204.5 11996004.91 75181801.94 84620876.15 60533176.31 91023640.15 79547267.55 58175174.78 52143085.53 70555182.57 76075409.15 56884079.77 25462739.66 27859877.84 85229326.42 34705591.28 66815002.44 93003838.52 42765053.29 45211924.27 89533517.71 78909077.95 65854351.04 83668324.17 95772517.8 71049498.46 72616474.72 65433013.76 86088882.96 70316298.42 71916078.29 28917524.04 60122096.77 76405115.33 74196637.39 72141701.23 27509136.07 56554930.14 59682173.67 23285644.12 72784008.82 72926517.24 63483680.36 28115451.09 92219539.37 2497853.9 26395116.45 63357190.65 60110247.24 12251094.91 45230103.52 84045576.2 80551258.12
Diafenthiuron 107510.8392 95246.76226 87197.1545 79010.47833 75247.63511 101846.7577 282541.6184 297592.7479 513175.3483 379898.7857 401746.0481 301216.5467 1114255.814 712518.2779 882869.71 751079.4672 903644.5476 1132912.51 2052627.511 1709238.723 2116076.208 2843270.295 1715903.181 2142085.298 3092086.844 1717981.078 1674477.845 2858981.994 1938946.695 1964012.526 1506752.382 1500620.419 1971095.114 2872620.182 1646508.765 2409235.883 92599.00383 74567.64495 89597.89577 75763.10738 83021.23019 430330.3606 197343.4643 204881.8419 52426.62572 291063.9112 844436.2063 439815.6352 182047.9415 988903.284 638852.9267 1723832.073 874130.0345 813846.4958 2035699.451 1357900.724 1568898.9 961317.7028 1280034.589 2049642.539 1429686.03 1022613.244 584356.6302 831288.3856 1433291.632 1234803.6 215154.3249 270988.9927 274515.4567 70274.57452 79866.28157 488903.4022 591927.4471 633020.594 485010.3232 293510.5493 1296447.532 919528.3305 1521406.604 568647.2374 822747.5973 1655540.394 1101169.666 2083626.526 1004780.33 917567.1231 1879358.085 1027626.263 38930.0747 674239.7886 1085675.619 1070217.447 230945.4001 1044173.885 1636585.248 1105645.855
Dibutyl malate 843766.9315 2180305.079 1136943.271 1680469.778 1539944.705 1882252.182 853079.7631 2487133.834 1269938.61 1723994.201 3084472.06 1870751.181 1164959.71 2121662.964 1187468.856 1899989.68 2781215.322 2368100.204 1231006.631 1428902.083 1069306.411 2562283.216 2410282.556 1682541.756 3399409.859 1420693.639 926819.6941 1728442.584 2009518.525 1810359.414 2037557.988 1482645.882 1358552.3 1499505.065 1591623.745 2180902.995 2494227.686 1718804.265 2339222.765 1331865.986 2624095.888 2590428.633 3373175.854 1856370.292 528706.6276 2436824.002 3150293.577 3619259.275 2128692.027 1760984.139 3248325.239 3328684.782 2287060.15 2703833.948 1686415.399 2320950.581 5874168.864 2275716.083 2087084.814 1516619.502 2305599.317 9238668.473 2559091.605 2173621.302 1781963.186 2341389.718 800678.8382 898782.7792 1483489.735 1782542.693 1297535.684 948472.6326 2454099.495 2073914.89 2333019.612 1059061.469 791758.4003 1078284.054 1047339.616 855124.1512 1250119.087 898821.0068 888223.0576 1232107.758 2204999.678 995419.2453 884777.8961 955279.3811 185754.6944 1129997.198 923748.5585 724064.9164 220453.8809 919934.7887 1929142.252 1406425.043
Diethyl (2R,3R)-2-hydroxy-3-methylsuccinate 401035.9469 341792.1467 423111.1829 363946.4082 310554.7168 402581.6235 474116.7521 532146.274 269447.7758 434132.4948 149422.1161 386494.1358 302563.5161 298770.6786 212471.7253 408618.8464 364493.661 461679.5033 564773.8181 505320.3895 422257.6635 694669.9056 546529.7304 501144.1778 661047.4824 692368.6747 632238.3525 585841.9154 493685.7235 504514.8258 1114870.356 655121.1657 437757.4794 604268.6246 633136.4988 418635.1391 495687.169 428853.3617 382809.158 402952.3444 346115.9451 342965.0251 409380.4723 405077.293 385961.5451 546133.3965 532087.8635 470145.4515 305435.9305 398736.1776 237160.0024 671236.8884 551462.4255 823688.8588 562682.4585 417417.0491 550721.8926 816864.6091 495916.3894 646288.285 487515.8826 858579.679 642355.0115 864523.8867 853268.6114 505710.2915 445216.6669 490349.1482 347738.9384 459862.5466 373111.8013 385708.7529 399198.4103 467592.8845 427405.3596 471736.2524 397373.2155 580606.753 426852.6827 801317.5954 452731.304 611082.2174 556264.0101 413416.4194 796744.533 408591.5012 768850.1699 432401.1648 537914.4409 410662.9953 394002.6599 556278.5513 391593.062 441123.8225 687940.1593 459306.2836
Diethyl malonate 267187.9943 1030251.362 1224516.111 458956.536 565539.295 409741.7153 353329.4996 820450.7692 1164900.121 338751.0758 611710.4906 495691.2802 490253.913 1013171.465 1114987.962 232302.4911 279318.0514 438376.7901 398658.8198 1102877.475 1260730.261 344762.5973 617288.9076 458599.6007 324380.931 829873.0886 1162060.255 329851.0858 167094.8528 509890.3761 414902.0956 795323.1886 1361381.706 397631.0042 133528.4961 371853.2854 777144.4808 434477.1126 278900.3832 1066500.721 1259841.71 723752.6466 918660.3969 380932.1718 64244.72469 997881.6591 829689.6399 972749.2943 381623.6882 1184626.569 1309999.192 698592.1759 851800.7231 277278.0413 1169351.341 1219828.222 652246.7995 737975.2885 313126.6798 1093878.629 1253963.628 432738.7448 479757.6297 264964.3557 1020452.587 982774.7359 643239.5691 380777.4389 638523.4931 1883779.636 844697.3778 620294.0284 611689.3107 471751.1912 2323193.137 966744.1262 561372.3588 512005.9099 570888.9738 878662.4435 764762.6044 494185.0636 499633.257 615210.5965 1888377.775 585512.1231 484150.3143 551450.48 475707.3295 1224387.288 789972.0007 507026.4095 481415.9999 277864.949 2081485.667 1031650.235
Diethylpyrocarbonate 5148317.827 9635200.693 12860663.16 10734890.56 9038657.183 19420407.94 7009768.919 8891415.7 12326511.46 12731021.15 16991066.94 27339961.11 13158947.37 13084398.17 12011185.39 10437426.35 18159779.39 33013338.97 9835999.415 11663122.97 15054042.8 37968025.36 18880432.49 26067872.54 13366603.5 10056678.11 11819113.56 9896154.522 28658590.49 27526442.62 13448223.69 11728539.11 12711949.03 9031744.862 11734019.65 25731671.72 6676692.463 4994031.633 3361716.708 8274561.639 6682346.121 6683729.503 8784557.906 5269735.7 10035045.02 4415324.793 12063925.98 10235941.86 4543167.055 13223018.65 7903922.551 7161632.069 6593772.421 3983634.246 12309889.82 5286333.3 8757095.909 7485496.616 3476218.391 9109634.224 6483140.631 10745879.61 2918048.513 4160964.479 9149442.369 7830269.463 5410229.058 3184772.088 6340780.775 14562072.01 12149121.4 7288727.441 3877626.329 5581624.235 19543031.59 6161934.324 3160395.619 2843465.185 3627096.62 7903120.457 3394963.801 1264199.057 3905216.067 3800107.625 6404821.563 2400810.589 3366119.729 3669285.805 5680325.789 5583481.39 3582995.322 6343250.5 5899615.119 3328879.288 7026212.164 4409126.517
dihydroxyphenylalanine 2624007.819 4193748.939 3755208.046 3619209.27 3387948.885 3872941.735 2167285.276 3928657.393 3584509.248 2125685.573 901189.1964 1317902.049 2838295.11 3512437.269 3348788.37 2094380.598 1305055.04 2223918.159 2432525.886 3588821.907 4031644.599 3554871.367 1506602.765 1952332.248 3358356.19 3048954.952 3036622.469 3352145.072 2982456.915 2283325.538 3428863.244 3500193.005 3640871.164 4220381.693 3689239.2 5660950.126 3397960.975 2801377.378 3679505.643 3284248.529 3975395.565 676079.5189 1403431.603 3221551.742 405987.4324 3874918.121 2671719.364 2230771.819 4086082.544 2997374.536 3406083.764 2056305.608 1869884.003 3167536.533 3020409.832 2768928.448 2448899.105 2294631.501 3630200.472 3075426.126 3551501.473 3289983.269 2227465.376 3137464.223 3651922.964 3632730.851 4705801.111 4229463.553 5018260.443 2605199.698 4761293.911 4586669.49 4653414.956 4365688.382 4103970.81 3782974.965 3773076.994 5214127.951 4403174.096 1249444.981 3560934.975 3385529.152 3255767.662 4466028.27 3434114.874 2438000.754 4072917.2 3098300.539 198973.5364 2199831.568 2944173.609 3554277.558 686617.0997 3461666.26 2631340.866 3158530.38
Dimethyl (3-oxocyclohexyl)malonate 86845.03937 82178.74036 45315.78575 76694.14584 48871.09871 150461.784 86859.05454 74835.64526 144722.1427 44968.1682 93118.06709 74226.89223 52817.9399 63578.80533 53073.27095 51710.36821 93252.79502 85126.26532 131893.6334 173561.3222 191999.4202 153254.8935 149629.1863 91330.07033 1031497.076 174385.3463 255271.5095 183667.6977 247841.5361 72054.15284 2013492.177 293469.8968 222895.1204 409470.604 531665.3191 91686.64875 53737.86286 35275.12428 64286.10944 103744.3886 79238.96504 260160.0984 53106.31706 73399.83722 35918.44262 74553.461 105560.1628 101588.5667 90198.31233 85303.34276 103758.6463 392807.7786 116945.1986 81530.10055 95765.81081 125493.918 507914.5382 451294.6998 493075.5197 190585.7623 128401.1658 1244989.402 299569.8623 1014688.164 109319.7951 193127.1209 77014.15211 93244.09214 63768.84421 66009.00736 42166.19957 229448.6364 89960.65155 77525.8495 98002.36935 41281.98339 159893.2556 87217.38495 97131.83024 94180.91077 103317.5961 195116.1151 166169.24 152592.1407 204597.7882 87538.68493 317678.0051 134312.7938 39028.92407 103381.1475 116095.0566 206943.829 82159.15561 239551.0708 153143.2393 247270.4217
Dioctanoin 3434296.905 2235662.992 2494011.256 3768583.159 2898204.616 3285209.857 11112026.46 9619825.646 2370850.806 17486075.17 2299711.958 14211390.98 61383702.92 32695472.14 41417745.16 37433600.12 34692977.36 36311485.46 94321505.14 60727779.66 78668573.12 125036296 82203240.35 88674826 95898033.2 64004772.91 69228077.97 94761755.78 74982949.06 91482938.59 97697150.98 73681830.31 82490006.75 103441569.4 80643932.88 129431432.5 2404636.395 1577630.514 3608580.123 3488489.725 3288321.048 15127838.28 7848847.256 7030127.919 3898042.39 10995157.37 39639095.34 17998462.54 18196352.02 58855559.68 31355206.22 65226509.18 28639206.12 26997761.95 81252304.61 50506326.56 65295055.67 33494025.07 30189453.98 69272097.29 59964759.25 48425684.17 21159266 42621935.34 59001440.14 61984446.21 7282168.047 3020353.623 8378042.91 3128181.38 2091887.092 25375894.93 26981770.47 31388665.25 7179326.31 17211316.59 50899312.37 47329450.08 59387376.04 19733014.15 39652683.72 65589677.28 64334534.02 78274161.93 61766234.93 40866935.04 68218272.9 62312509.73 4693917.049 49363974.1 58751424.53 72137250.84 15818697.15 73239958.06 75851202.76 74597231.72
Diphenol glucuronide 1063392.54 5645417.836 5988989.135 3631441.718 1279631.733 1864629.825 1137269.538 5520405.013 6660732.673 5049805.054 2295945.647 3103630.3 1737976.477 5599226.213 6779385.058 5403489.895 2500171.209 3057633.577 1312788.909 5005305.693 5945631.102 6124000.335 2651332.445 3014713.939 1206416.096 5452315.618 5830720.669 2938340.493 2144790.496 2424986.99 972207.3002 4513563.61 5556689.863 2949642.073 1992256.076 2142396.346 6955931.83 3422553.618 5190739.499 7352070.507 4569486.491 9769217.325 7299638.768 4862257.193 2451916.892 5646793.208 10410126.46 6451786.056 5719676.765 10618260.4 6273338.767 6898933.542 5220484.358 4198882.699 10393537.92 5202389.229 7067868.624 4445079.702 4578900.813 7398522.101 5060989.373 4621381.249 2567374.12 5096151.581 6754156.707 4611496.718 3685045.236 3656801.183 3021386.78 10142783.17 5754124.434 3845774.177 3153119.03 2126605.878 9132503.138 4364118.445 3148132.283 4465622.185 2769844.019 5955538.078 4396472.028 2928623.534 3479561.764 2497494.941 7673137.609 3857671.877 3416304.719 4055830.249 185391.0293 7615184.176 4257695.19 3379827.844 1224995.944 2402727.533 8631773.759 4883822.778
Diprogulic Acid 132455.5442 819290.2584 516127.0897 955657.6233 118590.2102 122535.8509 333563.6295 662243.5299 614668.3678 1177288.913 113658.4769 112778.9147 421568.1823 715287.9261 702475.2146 1202262.739 115024.3303 125706.7483 400437.6784 777490.502 1325073.017 2161414.184 362184.9848 191591.6751 605144.6056 557862.1568 777131.2169 1020181.344 258562.4658 348748.3447 900714.4111 644941.6543 979483.7415 1212602.962 295695.2393 698127.8845 282671.048 853944.4555 382690.1373 833601.3769 828259.2581 284684.9088 2254007.413 348018.1416 146261.8642 617940.6245 564227.0424 2642089.97 773872.4055 1094808.758 823770.5899 281388.4437 1680663.222 240023.7491 1144797.998 789466.5444 467085.3182 1785881.41 395513.6815 694236.3748 678149.8358 451759.5763 1064195.459 791407.5386 946194.1648 749075.3194 343900.9468 164915.3126 236009.4996 125029.1635 239881.3629 139347.5758 139818.7134 199464.9802 210024.484 123854.3667 134349.9673 481459.3845 229485.6574 114099.1321 155213.9961 916890.4041 780436.1558 535753.9842 2541078.901 830013.2753 1537255.337 1287017.7 83924.95872 2098693.872 3057400.877 2663555.142 105883.215 1096760.884 11704364.82 4858559.084
DL-4-Hydroxyphenyllactic acid 51755485.42 48359084.78 63347580.8 89226227.52 36906404.49 90712834.11 66533545.39 38620698.64 68044347.9 86870250.46 49357660.91 93093665.57 87253807.46 53928053.07 77675221.95 73732661.51 61691132.93 106426078.9 83180970.39 55741028.66 85395374.36 119119321.1 63809461.81 95897444.02 80363624.62 36481711.89 76641095.47 73278925.93 56864697.5 80180048.46 76538895.53 55234907.68 58275654.99 58532815.94 44131865.31 96102601.42 75996643.78 82355659.19 65296598.85 105604229.1 117544918.2 72613491.18 157093456.2 61255755.57 19894537.25 111730459.8 97556094.39 169282150.6 74713940.85 120530839.1 127896813.2 74179466.47 131114502.5 59264389.01 133375315.9 97232241.46 85427331.65 128415446.8 45268907.31 95529463.73 127040537.6 71310214.04 69569279.57 58262377.21 116921072.3 130405736.1 29329666.46 31191355.16 37579296.06 23017349.72 39729746.58 42263177.67 38782467.06 33435530.36 65930725.44 61968867.98 32721091.52 55725552.64 40459929.98 27466978.17 61488458.63 28752998.46 40199233.11 43145722.94 49076184 41362328.36 42920867.95 42997419.07 1765127.183 38446549.69 61477626.65 44585790.39 10653599.09 38540920.96 55516195.7 73775315.54
DL-Arginine 24614115.84 86364655.93 65432837.09 23956644.84 20878966.33 45985830.26 32988084.24 44503635.14 47786396.26 35226947.18 59902951.98 33431598.59 43489484.83 51446323.61 69673933.75 38778385.67 26710024.51 56057939.97 48067818.11 12418878.02 84959027.03 81377380.3 36294754.69 62973247.34 98319225.11 102774155.1 100612400.7 64488954.38 75777236.46 104923349.1 20254286.28 101795744.7 162900991.9 84919978.86 81505413.19 68357658.44 57014863.45 54771423.65 37454257.16 64514766.72 78733965.6 72520003.93 125527871.1 54577202.61 10305143.81 85759895.52 120726462.5 99341960.12 70597569.52 93456558.15 102880743.1 82559144.22 86577577.36 83197338.38 117799981.1 131809019.9 122812566 143613342.8 123957817.6 146570066.5 128947680.8 100977053.1 108705332.4 174543181.9 153168219.9 149102198.2 46225752.67 76124225.81 97501174.87 49304843.65 54399432.37 98669596.53 65699542.82 54886743.54 84213177.62 80008176.29 98676497.7 114169085.2 32014198.92 42824609.63 96344854.37 107403928.5 89846405.1 71821940.51 86780051.95 79366815.47 89038573.76 149137857.1 13176295.91 115125822.6 78964783.01 189409004.4 115583511.5 53755688.66 127886182.8 183428395.5
DL-Carnitine 356948107.8 216060243 289538653.1 185702852.5 190367601.1 178094540.5 251747825.3 212408638.8 280066839.7 203513532.1 232986617.3 207846447.8 252961515.9 259317100.3 209468924.4 134866076.8 119150554.4 151130645.6 152091936.1 223644209.8 172014708.1 107348349.8 100557041.7 216354100 140507269.3 173007162.8 206934120.1 129812826.6 116597077 252879200.9 220170698 271249484.6 266221861.1 146251545.2 113392033.6 240487709.2 373986500.8 335472598.4 248955037 294688678.2 307567458.7 538797503.3 292401424.1 257951047.8 285399798.9 189363004.8 377046040.6 337530364.2 155396200.9 264882734.1 262889554.6 277227164.6 249579092.7 137251831.4 227847302.6 149284738.2 371504234.1 178782263.1 141810986.9 237228849.1 132322990.5 263480296 187179696.6 200042373.5 210008847.7 193644466.3 150778870.7 173816542 219570079.6 155080334.9 295834298.1 187124684.3 97436486.41 140182121.4 93089938.53 185119501.1 105676931.2 122172100.6 151245502.2 103836403.3 166215373.6 90195490.11 118065381.4 122272729 101129908.4 100013859.2 111093293 119719931.6 91861586.38 118690724.5 129390531.2 122747234.9 170243376.9 166357012.4 90219640.31 146806963.7
DL-Cerulenin 3017408.237 3511443.44 1735815.226 6620285.011 5945892.199 8866185.745 4686831.053 3458561.516 1911006.28 8057327.096 11895576.51 10334552.03 7398120.918 4673971.602 2711696.525 5705443.686 11131711.04 10993330.66 6207306.702 4563129.401 4088000.658 10356153.49 12022901.5 9875008.203 6669997.553 5292892.862 3042296.066 6352021.105 10445732.05 10056791.3 6238261.275 4874863.202 3552744.418 7196822.138 8092677.665 11590356.35 2127947.551 2927846.108 3236287.563 1515207.061 1738663.941 2109323.533 3478504.167 2693542.31 488257.263 1914387.999 3764613.98 4283731.848 2908127.705 2907698.651 2883933.506 2028514.6 3706543.356 2616952.137 3273105.558 2108329.071 2648158.839 3761668.836 2182997.885 2593382.59 2670608.101 2854079.213 2800060.854 3484641.945 2356507.292 2422585.412 1229435.631 1729541.376 2080125.752 1587469.421 936364.0401 2003911.297 2179726.479 2164896.432 2653797.662 1975803.64 3033813.506 2168637.551 3056951.014 1475120.237 2591899.097 4855176.743 4301021.099 6486195.817 6599000.924 3859279.113 5171679.526 4009435.591 337639.6154 2270459.183 6018043.469 3865483.787 602173.4374 3664697.197 3189422.087 6619791.179
DL-Citrulline 141779131.7 177147426.7 146922901.3 157578526.9 133906058.9 123908250.5 131081611.3 144654166.8 124184653.5 146339514.5 98925180.67 90065907.44 138464666.4 149682366 138013460.8 126352078.4 93103537.34 101269059.9 127460481.1 136682414.7 158958364 157336910.9 102859694.3 106117029.4 133554245.7 118262526.2 127354904.9 165937398.3 127711874.1 113194083.6 140988022.3 134341769.5 129801967.1 146563541.9 137870474.7 131438600.3 203602346.9 342483107.6 160634361.8 277603096.2 299251296.6 188019805.2 386551861.3 136005618.4 380705508.1 259300370.2 204096286 386006086.2 165323214.4 257462865.7 264804132.3 168900689.1 317919060.1 151283090.1 262458815 247819795.7 183576633.1 311626656.4 134881609.1 240596046.4 274195399.9 177946458.9 275311308.9 142398025.5 255803976.1 288298865.3 185884870.7 188287427.1 214766989.1 208843203.1 227000642.7 229254007.8 205172597.1 183673839.6 203533569.3 239527282.1 212065366.5 221636126.6 219406476 235303455.4 239234730.9 204845692.6 237137033.4 226017316.6 193693201 237543088.4 221436500.2 210131990.3 96988518.08 207222064.1 267467375.9 211341691.6 223034450.8 222914120.7 214133269.8 264309264.4
DL-Cycloserine 5062370.99 7036250.148 5086452.733 6201869.731 6024738.396 9561438.14 1993891.446 3169954.793 8383813.037 5645937.041 10513693.18 5961479.515 5377104.279 9110176.219 4448586.595 15594331.06 12953201.46 13945592.91 8807783.322 11688228.05 17069056.6 10670925.31 13287318.82 11368057.49 6540189.712 8406378.347 6276394.698 4810038.039 9367695.868 7925013.28 5674285.271 6558122.939 10026339.79 4847256.507 5414567.374 8472106.848 8072643.649 5514643.871 4870027.654 8758981.808 6607529.121 3027866.99 5037849.672 1838517.102 1153799.435 4576898.273 9494479.371 10270188.67 6160377.485 5829521.496 6961162.19 5383446.873 5754456.645 4114023.965 13190257.28 8328574.004 11876741.48 8245874.506 4038133.811 7860435.374 9774515.308 12201855.49 6893939.781 5440251.823 24402736.66 12182994.58 3144022.54 3551499.576 7329829.818 3133233.63 6741047.979 3019746.382 6788236.676 2740188.26 3645159.962 1797447.674 2067128.774 6610699.923 3812227.717 11821026.81 1321979.186 3251318.201 3771920.326 4297542.623 3292053.792 3310493.451 3040407.056 5414894.697 659489.0773 3023173.839 2985194.998 16432334.73 2109033.055 2113536.037 1790232.844 2260031.742
DL-Glyceric acid 16423859.93 12741162.55 34131997.94 8284869.678 11298569.69 11402863.06 9870745.11 46492539.08 51913590.13 37972040.44 7431300.222 51902719.84 5518707.938 52950008.95 74163630.2 39846942.21 16879240.03 120951802.5 108673255.1 141192151.4 208904226.2 334829444.7 144760743.9 566116430.4 266993857.1 155840440.5 474472619.2 637262409.6 345232678.3 861363447.2 393645985.3 309898308 787445889.4 941666355.5 742104708 1291228710 73970948.86 22103509.09 30511944.75 63091677.37 62288143.31 80844713.23 69489471.17 82692014.25 41690563.38 90084627.31 122144279.7 96661206.86 95557078.38 114823953.5 116773297.7 128160908.3 109061349.5 124510279.6 169176511.9 165898669.4 59726469.41 263688453 288930382.1 115713315.1 157388146.9 222679513.7 463737255.6 544243512.2 335048304.8 268368187.3 23771218.57 25618322.87 14345587.93 9572694.304 46829859.84 66061268.15 65150486.99 102349515.1 17418698.86 14433581.22 417204503.4 467885592.8 260124927 128229346.1 325162839.3 695883438.1 772167845.3 697643137.8 551974112.3 551452693.7 590020248.6 801452274.5 67901403.63 473336415.8 523465853.7 530814360.1 288214968.7 533186681.7 522811958.7 527195478.2
DL-Histidine 90123282.68 88609031.39 79096513.55 77358734.41 56270474.27 80097809.81 106904493.2 88212398.56 88649741.9 97620761.89 62842638.27 83208005.62 103592419.3 76949692.25 87838679.89 67229851.37 58575412.31 89680187.46 104210018.1 89397406.83 113179963.3 105540432.4 69320071.19 97078118.41 108583102.4 92370166.85 104961257.1 89132808.01 80330025.73 110813130.2 136183169.4 101077094.5 133747913.2 105732523.8 99063336.08 125891201.9 65237261.96 74776756.48 82094977.04 67687274.85 76535033.81 79103420.78 95847946.2 84570006.13 56062402.19 85339213.25 104420425.2 115463084.1 75537705.73 82008004.2 96844921.28 69135719.81 103268507.1 79052707.55 82165770.05 109160992 79699887.02 151872320.2 83179119.77 85608345.92 105822963.6 82375599.58 89740991.38 94122461.96 92350008.19 100102111.3 78955699.51 82686334.86 88496059.39 63692988.22 72080225.87 105966787.3 98796081.93 87056052.97 95435169.64 83354365.43 106972427.1 110769740.8 109542867.8 102070518.2 98907483.35 111707263.4 127497666.9 132843816 90592436.57 82468722.03 100207187.1 114854105 59225218.81 77030351.28 100057120.3 113285495.4 70644478.77 145654922.8 99559293.26 112280013.7
DL-Lysine 308631538.2 311275015.3 453656403.7 297303734.7 341459814.1 527842802.1 320046160.1 331733694.9 420141554.7 269735777 397487691.4 461657140.1 434952665.7 416747799.1 440986584.2 295103547.4 385407040 611279878.3 443875586.7 437807405.7 525090783.1 437992639.7 487056783.4 629803098.3 492238986 417669444.7 473057518.7 472595692 541721967.5 771152312 594068833.9 522550137.2 631676709 524877538.1 551440746.8 847879386.9 414331036.2 434457170 327600460.4 502826642.3 549449732 370683703.1 626685914.1 397893529.4 296989728.2 537084160.3 467588601.8 661440534.7 426877984.8 580937625 670042762 449895103.5 629326503.9 410329319.3 699140617.5 710112805 766980106 655316088.5 475938347.3 674896872.2 751136965.6 512537712.6 589801264 802678740.6 747512328.8 753739327 405126085.7 412943096.9 796298963.6 331705830.9 467843941.4 489227772.5 483176985.7 499040682.9 567574564.2 525216588.7 515666292.6 609288978.6 589506119.9 321722567.1 526166198 568223484.4 571848372 634879087.4 523325651.8 505034402.1 513311142.1 534234250.2 159363242.9 349868073 584503989.8 576970190.2 258112003.7 448929257.7 574473994.5 660059804.6
DL-Mandelic acid 344282.5195 443881.1434 832576.9341 754302.9343 1396744.439 2232704.354 382103.8589 276795.771 713404.0878 780185.5629 2307404.273 2698932.419 647522.8438 447896.9078 732307.5819 743047.8508 2316766.349 3465687.02 427392.1394 498602.9259 793410.016 1240314.539 1997586.595 2908566.906 450719.1262 313038.2284 701035.8047 824496.0487 1716265.654 2829440.92 497570.078 430870.3541 670510.0973 797521.6993 1258184.532 3242845.869 455498.4411 373591.0037 271974.376 551349.1507 663281.3158 404443.1575 779785.0199 310916.5672 93207.82531 627842.3356 554427.7407 877680.7605 397206.1243 879022.2893 779093.4558 438508.29 652789.4295 243832.5383 797960.2546 686339.3318 393203.3126 448283.0715 268282.792 526131.9996 616094.8627 266028.4033 363052.8697 352372.0246 564144.2707 601042.471 471958.8978 644156.3237 522792.3638 1388822.264 788035.6925 614442.6496 473884.1639 460454.962 1705617.672 593204.4909 487513.523 706721.7881 649920.8028 652968.9359 586441.4537 640445.829 575441.1064 533633.2642 1764610.246 403964.1538 587730.0444 508065.3169 206939.6633 798964.8342 633938.3754 725207.3423 174798.2665 317311.0731 1599714.363 804491.5816
DL-Mevalonic acid 2543433.357 5775537.7 6986678.366 4627427.767 1376502.74 4416818.989 2302034.082 4659295.516 6205419.073 5224072.893 4295895.668 4958767.66 3421504.706 6758766.696 6617690.257 5256621.318 4309999.192 10772730.76 4429716.962 7408632.684 8462956.496 8253439.235 3881215.763 4189313.639 3631576.078 3801206.911 6015972.747 4905095.192 3607000.842 3579128.928 4884971.946 3990607.081 6954579.648 6149443.07 2801345.912 6028803.85 4654972.628 1615614.059 2478315.488 5522358.27 5093733.004 6161516.472 3239989.533 1586279.638 2584456.253 5736455.677 6532193.607 3150827.009 1901427.531 9262407.425 7659650.499 5473028.36 2151423.589 1245230.455 9533470.535 6610589.012 7213545.226 2074559.339 1683009.055 6655145.712 8189651.753 4527967.412 2550522.07 2355114.366 10973180.87 8382435.033 538056.9402 1434282.92 934688.439 4729372.434 1906308.623 953954.8677 1424207.966 1446747.002 1213295.566 1042967.685 1282563.367 1517167.309 1679080.329 767329.9591 1031876.586 1197448.76 1991424.651 1877293.424 1026090.44 1340665.554 1359306.198 2674729.19 214865.0077 1536141.056 1207506.854 1363404.607 739658.3796 1591806.167 2047958.388 1867726.638
DL-Tryptophan 1072606759 1729228502 1738682336 1387007353 1427419976 2518169160 1213032717 1671175622 1654742680 1409530154 2027009499 2755025691 1793003481 2109804062 1895095697 1164818896 2080161648 3269063528 1430348140 2099349354 2301248929 2421067724 2104506927 2980965969 1814591780 1576235744 1952399413 1731434685 2013816618 2844315579 1968848187 2032103431 2009079022 1961122323 1868028946 3756507022 1989329029 1056532483 1997692789 2231036968 2415833565 1767289664 2294556858 2089052661 390328410.7 2526051594 2138829544 2432391597 2406356750 2618151308 2859155924 1781669760 1864209834 1983800331 2178684421 2731182256 2086854919 1994200959 1825920848 2485030431 2678604362 2080616417 1238310684 2396227836 2596263302 2782541577 2765445459 2975523732 3995541241 2765869414 3442400931 3535717641 3498579833 3214452752 3838232750 3772652758 3850856487 4036663679 4079558603 1583306814 3474898854 2566064212 3332260739 4163171075 2865208776 2473600406 3446396085 3314508166 156340728.6 2061876213 3613066339 3096353836 662708911.4 2971467559 3530139917 3926858345
DL-TYROSINE 31923074.42 92360651.08 82536500 44267799.62 76648410.15 72154535.17 35657541.31 70788992.63 89712720.14 77519116.54 63882754.79 71467565.21 46954196.9 84820480.62 103553719.1 106449423 63536070.98 97082710.12 56668201.24 87893769.81 137580097.7 160609755 78240685.51 101275839.9 68147422.02 86508428.16 116023924.4 102644404.8 83456541.67 120807049.4 92354149.35 104349036.4 168708899.7 119217860.2 90426054.11 332947095 95405391.97 113418089.4 67287773.38 61994323.08 121004746.3 74969939.7 87226904.9 103906004.4 1204539.314 118094099.4 89398199.82 102160174.4 87076820.22 85535718.78 134868712.8 97556978.07 105218432.8 79582022.05 112553127.2 176521094.5 99392154.28 108539899.1 101669963.2 100871397.8 165635154.6 106479338 200048048.9 117587555.4 179633189.3 166963345.9 57076274.1 71670284.17 71654695.55 55914986.02 53079049.6 115946328 119928687.9 84985548.54 79457648.2 106391952.6 88848399.02 107222427.5 115840094.3 89091624.41 83392045.71 106719566.1 167040878.2 110352873.9 74936434.97 135457700.7 97257714.66 172754697.7 765252.012 70569069.82 90336188.73 94651140.97 736330.1868 169544673 89921939.68 110703577.7
D-lysopine 630291.5599 1640463.032 820647.1087 917054.3587 799562.4064 1501249.093 101589.9749 718849.8083 400013.4304 435592.6315 899514.0346 279178.2084 2595158.998 1673097 1519990.719 1357446.076 1164218.271 2046082.902 1326445.248 614449.199 1522270.66 2722872.527 1739732.848 3047091.379 1388623.356 876166.9093 3687381.17 1291888.321 3530628.748 3890853.81 3077602.503 631418.8835 2168361.061 1895654.976 1863351.744 6327402.819 1925513.679 1526980.031 952142.8569 1593756.309 1225759.664 101035.8247 728814.7813 113080.9364 134634.671 578715.4273 1534000.396 2316040.938 1998779.425 1505035.985 2827209.244 690198.5743 927486.5479 177697.6371 1221239.88 1028417.862 1277358.857 1253102.515 1613445.624 600759.1819 893092.5918 946496.5068 2367921.344 1375572.374 1397705.006 776203.194 519892.3951 238043.9874 1417628.24 795833.2424 1535830.144 629708.4595 490827.778 102932.6731 275125.1552 122776.8394 280507.7833 969666.1018 770329.9089 1739186.652 277585.621 197877.5283 1454714.678 2145521.747 572295.1532 408544.1515 669624.461 7601664.25 272747.3467 8799795.006 738376.7851 3888970.06 1930293.704 3937439.694 7266973.779 4441553.478
Docosahexaenoic acid 90466749.54 128261769.8 85952704.79 106902895.1 109375732 177796241.7 276623345.6 232944104.9 186000787 289267110.7 254439051.1 419865096.6 433986388.2 346991121.9 249111486.3 400093770.4 418944778.2 620623051.1 522314061.6 461156916.6 349090709.9 578927788.1 468908718.7 739298236.2 566804772.5 371815105.2 402223755.3 414598337.5 419552344.4 646286139.1 495536669.4 422786874.8 467692554.5 519520707 396689280.7 594614991.3 118042468.4 52823227.71 72920778.94 47060306.5 69952842.31 173075781.6 180966040.4 153641460.6 15811648.97 101641825.1 229706053.2 225769637.6 205801568.7 129631914.7 172858645.3 272244408.1 295041000.3 305317145.2 175142591.1 176125539.1 376162082.4 317665196.9 350889737.2 219036270.4 260947801 245107796.5 162487219.8 292019790.7 143384656.8 306791753.6 166053471.1 163896521.2 148681675 65057670.28 77179897.13 276068744.4 281340245.2 237346563.7 323754027.5 225320279.3 333121803.4 486915431.3 357271206.9 261122190 300642188.9 586607213.4 591810593.3 534843880.3 435276806 379579554.2 480971705.9 579802953.1 56955548.75 465271100.3 459824556.2 474747661.2 286309744.7 484833659.4 601934629.8 530131125.1
Dodecanedioic acid 15177228.31 30678526.57 12004894.28 19872812.32 14983950.98 33489694.28 16525167.39 28655420.56 12583314.52 24175351.36 24649530.61 37410896.23 17384622.85 29892120.63 11225499.6 18117453.64 24846533.81 41977730.33 17193316.66 32975855.43 13382438.68 20711245.78 23323876.32 37243492.61 18335603.24 25817651.13 12795919.21 18570565.15 19968168.53 33009957.76 19330812.43 25070551.67 14333333.95 19507381.09 11330672.03 37767215.05 19738985.55 16507733.3 24143149.14 15722826.81 25244628.57 22068199.78 31028023.71 20689637.42 5045951.02 23057325.79 22925185.37 29411251.44 24736918.04 19045060.95 25464954.66 19010238.01 26033078.75 20822508.55 20244682.6 23983841.96 20445974.35 25946692.09 20136435.76 17212769.31 23445541.28 17246014.84 15253747.11 19964253.68 17488389.94 23679681.23 14112079.43 16319823.68 15378166.85 12884943.93 15258970.47 15214482.36 14958219.14 12234197.29 15587902.32 12287163.01 17042586.28 17260208.84 13885339.98 10524284.56 14245402.37 14540137.62 14992284.1 14808216.49 16544579.76 9962414.042 14185155.34 15401949.57 3612536.032 9898146.993 14017668.88 14540394.54 6431120.371 14957758.34 15568593.65 15506476.41
D-Ribofuranose 20395050.35 16506936.55 20866232.41 26220916.91 14247188.43 23575378.48 18095171.32 17918355.23 27060216.29 27846031.94 14375715.73 30519499.81 21596915.85 17797278.42 27118793.91 20222075.77 14755053.73 27324613.92 15255613.61 20001763.49 33342928.96 23414561.33 15286992.34 35772478.28 22129729.13 23429631.98 24454070.29 43825261.11 20693274.28 40062941.4 36094520.79 41001688.55 45728511.17 56047992.92 34362873.11 53142602.8 21047310.37 25511340.24 16283412.83 29291510.92 26427245.47 17430299.29 30114022.77 33777046.34 15676077.34 25783496.76 27166893.89 31918223.18 33929708.09 37828699.21 30876024.02 29226901.3 33950665.54 41311796.43 45879512.43 24728483.32 32581919.3 26908256.59 62418813.22 47782038.86 29995631.85 32106584.4 50275208.14 59839301.64 36525223.13 22930353.72 21006966.05 21381532.6 27040792.13 26316152.12 24440560.19 66081614.96 91974986.75 69969650.55 131850784.3 130317767.6 39679498.53 52147935.67 78155527.03 77094093.84 140803868.7 44245109.12 59374789.75 62904148.15 114973595 141143732.5 41944888.31 65664595.58 4844436.995 108489520.5 134504102.7 40341740.86 19115583.86 58112924.77 126352704.8 133912706.7
D-Ribulose 5-phosphate 140394352.4 121468446.5 139497309.9 148213159.8 144547145.5 155566394.8 60990545.29 124139824.7 141962438.9 61743384.84 47294976.82 53295672.73 85825606.96 94608062.87 146442900.3 67007919.36 51831785.06 87710413.02 61313447.16 86776440.37 111187489.3 64047500.51 47804132.89 78925069.73 220658061.6 188784127.9 172398001.4 169160912.4 140629889.2 83724363.69 52926825.44 319968111.2 78861381.22 70404689.16 94424779.79 57840796.37 200932165.2 176521822.7 189244536.5 122055343.4 171701308.5 31174159.07 50351129.97 227873301.4 140152621.6 199201258 113564064.1 101372348.1 235145100.7 119319149 189790197.6 122524980.9 78944482.87 198569080.5 109923797.8 159760569.9 191396251.6 208960737.4 312191209.8 179042534.3 191252992.3 381011042.6 516720516.1 336157673.6 112322064.1 108006563.4 277906911.9 281993468 310092124.7 263854465.1 244309911.4 74888909.33 85007525.66 117530709.6 229520010.2 125794574.8 29738826.91 26497794.52 43629660.52 47304926.45 35909600.87 31392011.67 33238225.13 37649560.43 46760497.21 35296258.03 27017079.62 29038189.28 13209956.14 50431272.32 34606074.6 30936190.38 25638514.03 34013318.23 44455406.08 32604765.1
D-Sedoheptulose 7-phosphate 32712881.81 27535512.53 42342694.1 30045274.46 26202288.37 34813377.93 12553440.63 49130497.56 48382001.97 15385027.83 8257383.94 18298241.48 14716372.64 37614186.46 45514061.18 19151499.86 13274257.59 40663909.16 35657484.31 59912551.06 85905858.87 50464929.9 31789715.05 47462506.9 237849554.1 129077362.5 184959642.4 181214668.6 139499193.7 66480292.47 40757620.75 315394431.4 72253147.08 64708394.42 73099989.44 30893985.61 74181978.74 66310640.55 70213870.54 50270974.2 63644705.33 17808731.18 25186203.97 132926793.8 81832147.92 86733465.1 86179380.65 59337769.13 139319498.4 77127696.25 92459954.13 116290677.7 65312627.3 152416932 93810924.12 132166985.3 98237562.17 214839542.7 346571256.8 100656091.7 125394342.2 373551999.2 640912010.2 404134439.8 108096574.9 93384685.79 76338975.55 95001340.53 83626999.64 121508880 130309282.9 19696946.64 20831133.91 27478560.63 50175205.73 33433355.75 15846169.27 12433808.2 19120299.29 31048258.03 22154575.05 12222553.64 13471340.36 19600371.27 23445260.59 19249389.32 12955359.53 13735458.31 8583071.856 31133360.35 21256574.86 16300182.26 12979925.5 18856420.18 28282928.6 19496182.98
D-α-Hydroxyglutaric acid 23880276.32 24225487.03 36610506.58 31882270.44 26354447.56 30397649.06 18837235.93 27768092.07 49096224.83 28145930.02 23352356.57 22733120.43 47959107.05 38340622.57 65174116.62 35232126.4 33211588.54 43391907.47 59274251.88 67710641.56 104528644.5 78438585.42 42589439.12 53730906.03 82721953.93 58616690.74 79670751.6 75800368.63 84211409.46 78141178.14 84904356.77 73154996.84 96974613.16 83901686.24 116010205.9 113994899 32644170.9 22084283.89 19487770.15 21609616.08 24801986.23 12596955.89 19920015.63 33047468.95 6042612.151 32831881.52 41248432.54 46153733.88 58486091.98 38397963.82 54065932.05 73901807.25 68029960.17 87552614.99 63554593.82 75471191.82 118068865.6 108286431.6 90063608.35 66896633.26 74637124.23 107552781.4 104681794.6 101733181.7 98306481.59 79019064.9 33337702.4 32766117.16 34517374.77 36057307.45 37442473.31 43263793.4 27120378.93 27986475.88 45583068.72 32064652.17 26476677.47 29846081.21 27957685.43 22883956.38 26368682.18 27853599.88 24961004.32 28108603.05 43918694.83 18164474.19 21142564.11 21171952.08 2546095.686 32744482.08 20058480.04 32347137.08 7063439.487 17095648.27 37887507.54 26229987.62
Ecgonine 2373649.227 7617834.671 4015878.123 1799639.811 781389.6914 4472012.146 2204700.338 6248656.8 5768180.041 1520120.821 1323089.86 3529809.837 2556075.205 6283691.747 5774762.309 1676607.484 978045.5272 4158470.495 2562553.316 6117086.7 6362664.702 2721535.93 1542052.367 3800053.584 4637111.422 4891586.986 5084617.36 2144316.287 4055424.727 3932912.504 6228297.631 7356661.787 6256690.444 2429903.693 2298486.521 4913089.448 4638956.132 2382492.109 3517705.244 3523331.348 9692888.666 3394143.621 4125734.077 3594356.463 772152.6175 8208506.896 2694263.574 4818195.095 2847964.025 3457040.411 8661708.847 3668855.779 3451896.349 3007551.081 3907415.82 7305744.195 6014205.583 6115140.284 4178492.131 3106890.793 9086848.91 15633068.25 7071393.454 4646226.348 4744363.034 8316983.081 1850447.354 2028111.751 3046702.649 2993179.309 3727328.015 1761880.941 1678672.072 1667565.929 4492592.401 2388646.533 2004514.4 2541559.888 1857994.204 2603712.563 3505075.1 2127794.745 2275800.382 2312834.009 3609690.923 2289681.437 1649008.739 2409394.559 361913.495 2598756.996 3093734.534 6046986.002 1313462.883 3414129.605 4135464.557 3324937.244
Eicosapentaenoic acid 5952834.583 12870519.89 12007289.21 14484602.84 6785211.463 6138664.011 122679272.5 135139938 194887222.2 181237394.7 126843487.1 268301780.9 734174085 523984345.5 433442968.7 551270067.3 452865062.7 553162953.4 850513860.1 701546145 715872522.3 1222842873 840910721.7 756946133.7 825085883.9 732114319.5 622704443 671354363.9 857840084.1 696757423.5 791435709 720304522.5 730553391.3 690230441.4 720549362.2 1388209840 4074988.988 1748153.786 2861364.828 36684374.01 13685624.11 115750481.3 67759011.63 53328235.68 56532432.53 168113191.4 327538557.3 235038495.3 186896331.8 484293013 446353279.1 464077410.1 343693092.5 278335774.6 828454819.2 561154772.2 479378030.9 407746498.1 325275705.1 780195741.1 697378815.1 306081578.1 319447083.1 411614616.8 685455777.8 658116575.8 178027057.5 138289641.3 147907821.2 22014528.8 27215634.53 795441504.7 516477794.4 660845880.8 558596409.9 473339956.2 1143829070 932096745.8 1214010857 572157742.2 929728466.8 1307789056 1164436048 1450080847 1222654129 937613212.7 1354531921 1155378288 90202632.1 875680328.5 1410639211 1394472266 352868231 1321171831 1252023291 1204372287
elpamotide 8638508.536 3012984.602 8200790.528 5593369.102 8979119.552 4994320.992 4986384.297 6377812.682 5090439.828 7382637.685 7178048.398 4130950.736 4417268.818 3519625.503 5417216.215 3266731.101 7770373.581 5903871.967 5642890.641 4992804.424 5399438.752 6691376.001 6945959.819 9821184.082 4729499.356 9934829.112 9293209.436 8174364.31 7662307.14 8561341.829 4504207.782 3303118.622 9968428.526 7026363.594 5894031.884 10957109 6651127.05 2441065.747 2410245.941 2659009.403 10129781.01 3047056.966 2831766.951 5033158.928 1359774.528 7402163.321 7053590.616 3387772.948 7552394.418 7417349.986 6103649.45 5134166.651 6911211.865 7280779.406 3437920.213 3166003.14 3786582.307 7975714.764 5174016.224 5810645.855 7407343.841 3474294.495 5006007.345 7595899.101 7624279.95 6952995.836 6974462.811 9168956.003 5413990.292 5663061.611 5943488.828 8096358.132 4155231.552 8138227.965 4994503.832 4917600.295 5113689.125 6451353.25 7023072.771 3398986.347 7203409.601 5375125.293 4289976.696 4833991.454 7785072.537 8085095.226 3556398.675 10517519.12 167739.9319 3149080.857 6017347.373 6269463.551 1322917.904 6052301.459 7672797.856 7941229.559
Epiguanine 2524263.351 3850287.385 3420329.322 5028488.677 5515410.071 8189945.003 2416488.512 3212494.031 4121837.988 4309823.926 7935709.383 8157907.919 4452944.665 3911214.448 4743217.603 6295717.407 8958185.126 13849114.16 4802845.523 4973765.57 7222917.685 10519718.77 8713608.149 12167346.61 3625266.916 3565786.886 4061743.191 4701524.614 6818957.055 9637829.123 3633793.681 3744114.349 5132396.708 5119524.347 4459180.903 12631739.86 2709652.032 2255677.088 1586923.189 1968848.696 2336584.505 1912753.775 3330785.467 1890501.886 816813.4721 2579571.008 4518567.706 3914901.689 2810335.783 3471516.97 3467654.777 3792204.087 3224976.446 2322721.764 3973205.177 3270031.8 4192791.807 2797878.64 1830145.899 2593577.747 3325666.6 3307962.892 2406576.64 1819016.775 3773436.883 3432421.263 2339324.362 2894878.417 3329738.426 7082394.567 3665488.702 2051237.91 1540264.575 1458928.76 5748877.049 2083307.125 2018541.149 2071202.605 1378306.143 3024180.58 2254388.712 1851029.83 1852115.554 3321904.449 4944290.271 2828646.605 2660130.899 2774985.928 182734.149 5826755.416 3041011.798 4114864.632 1285913.523 2500846.233 7397393.69 3579625.007
epi-jasmonic acid 1140339.828 318842.0223 1502690.603 998688.3222 1747361.293 1119810.138 1225411.83 1525430.483 454837.08 1638356.453 2031325.011 1784677.475 1074959.186 1237040.948 1674847.977 1415511.859 1451934.281 2544011.415 1511691.804 1655943.168 1368451.843 1444155.412 1458764.98 1539234.183 3026698.727 1343951.566 1360629.858 1255014.157 1020981.728 876080.6757 5877483.777 1968363.675 1575059.272 1465975.655 1501243.856 1385848.804 1116859.525 481830.1321 1447748.736 1055403.15 1091289.044 1474356.246 974216.0797 898495.4097 1036284.773 616336.7252 452221.9587 561657.9007 1426253.547 995142.1045 1208719.282 1251683.433 1093953.387 1137273.733 1410684.521 1089734.858 1681911.609 2228405.183 3204475.219 1655047.964 1227028.096 4478484.291 2070509.382 2781652.093 1383661.868 1053450.599 1219828.771 821534.5937 786033.5454 685409.2261 935561.5647 1851631.569 679658.8625 1653450.205 1344838.257 654757.2038 857868.9394 793438.3752 1347708.529 792569.0841 779703.3163 1370391.175 1217330.014 2262807.433 1990742.271 1665923.697 754751.5656 1309922.407 198155.9012 983516.2207 880603.0777 2233862.881 671468.225 1132174.423 738222.0243 1205640.555
Erucamide 548760938.3 288087366.2 246529217.3 165541624 182715138.5 167088186.7 150198768.3 115679099.2 267220943.4 122579509.1 136400542.2 181436978 164532093 178106654.5 231016521.5 115120886.8 189301744.8 140373349.7 160024852.7 102556471.6 174457157.5 143412355.5 164720670.5 140642190.9 278071673.5 423052046.8 213544014.2 396425965 181826289.3 142023364.6 193738818.6 221855527.3 270298293.1 175843455.2 502803054.4 383746427.7 166833241.5 149657917.7 328233433.1 240442400.2 220849513.5 255738680.3 128394117.4 285120146.7 63416930.07 162814447.2 110338155.8 146053556.7 283671500.6 210025833.4 169321784.3 126984348.5 196656098.6 221315070 143306092.2 189634192.7 239671462.3 298704633.7 243174899.7 335176406.9 580511265.9 245369674.7 196832525.2 226760743.3 99771190.81 220868270 199222146.5 395449844.3 416336157.8 206540363 93707445.96 183418679.2 316809029.3 124233166.1 247579680 131312212.8 319709223.6 355632127.7 417732518.1 652042984.7 161592072.3 210416979.2 181913651.2 194903252 304882941.2 133278385.1 207296374.4 163112235.7 67344894.15 202186797 457404366 130266767.6 100497771.6 317536973.5 177355728.9 351519219.4
Eslicarbazepine 1911698.691 3854524.123 3063708.208 2499755.642 2805157.063 3439309.566 1081255.168 3046236.127 3838678.643 975835.3735 750577.0386 853346.6774 2286627.141 3829094.019 3295227.614 1329126.025 1215925.702 1706869.49 2035196.65 4126438.333 5825710.431 3219029.241 1639916.441 2287876.576 2858864.28 2636592.902 3507642.723 3198548.755 3086144.257 3269929.378 4512363.795 5459418.37 4096300.492 4411793.418 5366683.284 7875780.648 3282064.346 2434196.364 2998041.165 2036210.764 4663963.624 386466.9274 910191.2437 4264196.286 458323.1737 5015795.132 1529087.128 2418344.044 4362100.507 3173039.133 6902852.43 2333109.17 2212335.856 4103947.41 2902779.113 6214387.192 3795523.221 4254762.411 4032564.048 3469509.047 6787211.86 4110255.225 3308986.736 4387141.112 5519151.416 5369480.262 3729083.939 3348545.001 4141286.847 2004356.521 3779407.958 3602166.826 4000664.206 3322021.123 3787017.963 3245467.067 4064859.789 5659522.573 3830094.966 1266758.157 3302594.827 3302048.755 3310452.097 3663564.204 2904150.302 1894375.182 3114977.568 4730762.796 112536.9231 1677526.802 2721875.545 3332695.275 530576.2891 2865201.666 3207875.554 2982333.321
Ethanal tetramer 300075.6094 439517.5144 349998.4879 395535.5683 323535.3198 329112.0738 215647.4725 412372.8312 286909.6916 422552.2187 247167.1608 567598.1596 389211.0723 464905.3952 455884.9946 243670.9592 435469.8449 541339.9385 305401.884 544050.7757 574862.8263 529151.3307 396912.1392 549676.6215 911906.5959 589671.3738 651924.2266 520528.4052 618712.298 497308.9538 1466248.903 628335.7334 664147.0316 585674.8741 752647.1233 691337.1927 432656.7512 251716.2494 345573.1878 488762.8739 741377.5737 334165.6497 745300.3698 249181.1407 179451.2893 698563.5773 363021.1193 664814.3342 643299.7944 691465.1234 641838.3204 587543.5605 543302.7659 473091.1739 796060.0931 702499.2531 860517.3849 921393.7155 880714.4113 715465.7861 843580.3672 1571220.032 877865.9213 1356672.369 963625.9709 851655.3417 338742.795 576747.2955 1079361.056 1716009.783 727396.6007 767817.9857 588885.5376 523140.4163 2255411.857 616247.877 437687.011 802912.79 743906.8246 954614.6121 620005.7952 733265.8766 455859.3101 748323.7747 2306056.736 566157.3962 473576.1212 498664.9885 98958.97615 1102245.924 814853.6805 1102788.178 297292.5404 497334.319 1807721.31 915676.1886
Ethyl eicosapentaenoic acid 13213295.77 8794203.999 7693523.687 6908813.534 10433508.86 11248572.66 10510611.85 9075354.271 13054088.58 11407904.21 12192064.48 13824940.88 22791511.89 17018851.16 21344316.29 18543768.18 20873667.59 20893052.86 21114699.08 22634356.35 30445477.8 38998297.68 33365090.38 35996309.98 41366241.11 28896164.55 25398051.16 28060030.24 29184089.41 30982977.11 20392783.93 23544796.32 27029539.33 23261000.49 24992074.96 51106012.72 10476164.95 8213892.508 12792670.23 8966802.34 9468548.698 10862125.61 8279327.777 9319615.438 3449141.549 8199675.785 15303736 13249569.74 13387095.32 18368997.29 16981866.34 23447643.4 15403296.1 15947494.29 29764470 16549925.57 21149496.65 14457049.32 14720990.94 26177573.52 18342403.31 16530768.95 7609507.83 15234038.67 14998128.44 17925996.66 11002425.95 12657059.64 14072087.94 7774937.147 9795298.543 16678512.77 18259409.63 19104429.64 17939971.85 11003981.73 29267985.45 20393826.33 28636152.66 14486791.28 23153456.45 30349851.16 28464418.34 50020943.64 26362498.66 23916865.54 36614290.13 26818207.09 2009975.905 24716062.48 25882910.35 22694360.3 6614806.338 25268542.59 33713459.28 28158701.49
Etoglucid 5197063.546 4583332.292 6322331.021 4116037.098 4200474.611 5728897.389 4219837.804 4641200.519 6875865.016 4022963.033 4063250.214 3079858.178 3622280.31 3386656.554 4285302.767 3354194.046 3676215.313 4311762.263 1957973.119 3716845.283 4734309.151 3246958.662 3341093.615 3119259.739 5913341.559 3875249.168 3977533.546 4075172.547 4021384.921 4257147.143 4337451.279 4210417.98 6873963.709 6173980.56 7391704.729 11479435.77 4290928.441 2732794.852 4928913.864 4626854.429 4671654.328 3818584.367 3978527.127 4317529.441 762086.1378 4066663.633 4186641.013 6712299.299 4388512.691 3991795.166 3750778.549 4025447.048 2816143.291 2959747.795 4912746.305 4092683.521 3524668.536 3707031.69 3631930.526 4282539.954 2478729.004 4621753.095 2798411.575 7985646.492 5882640.64 6360894.953 5181482.791 6210398.146 4875533.311 3377042.937 6268914.155 4251154.784 7149575.698 3570652.296 4597787.816 2798046.695 3981087.565 4191211.798 3148073.551 1958058.749 3079438.221 2997290.754 3273736.549 5070518.88 3229246.206 2966990.999 3686568.689 3616855.694 474989.235 1904249.51 4246555.52 4374847.694 1412051.081 4701367.748 6941865.619 5468176.647
Etonogestrel 597915.3949 578760.0143 602426.825 489018.6598 553065.5591 482140.6627 458090.1786 524785.9293 565312.2391 522117.0455 533718.8861 471653.4739 398998.5384 377648.4685 438885.7183 360317.4007 466467.6982 467147.1151 1090140.563 503343.23 635750.1235 2068498.185 1440518.946 1843477.286 1737671.096 599782.3346 743971.4649 1477893.595 1133177.961 2077019.799 1595098.408 1217872.339 1675325.357 1174647.22 1114250.32 1246235.676 518688.0612 409534.8801 449900.6199 548595.2485 578033.9586 555901.6382 532927.8096 448035.9523 221358.3042 434526.0521 489708.8909 564671.2818 483444.8269 497991.0108 781448.1032 459055.151 456919.4528 461593.9315 538927.2049 1390380.323 419955.0388 808282.6488 561289.9594 996877.9973 1135185.68 1078352.678 463164.4687 695995.4092 882737.8144 1337739.957 514776.7612 700650.1683 469630.4806 471185.9589 493531.1117 509132.0458 551460.9 474123.3084 513018.8965 354708.6347 1496000.683 955198.9269 805326.5284 326165.5092 1174649.647 7275728.554 7118415.635 7065537.488 6533715.896 6050507.246 7694036.287 5901840.195 627314.811 4184517.973 7074377.656 8236074.397 1807436.024 9318046.947 8754686.31 12640197.46
Falecalcitriol 11454910.17 7454445.403 11259338.78 8745758.962 8651811.893 7092262.073 9372876.158 11112907.33 11075414.6 11677978.99 10546461.36 9510804.607 16371577.82 9730752.517 15084934.17 12471198.18 15182370.27 10438479.66 11503090.94 8603450.577 8070068.724 13220531.35 11589580.86 9990067.639 10684045.38 10601470.85 11302720.99 10311006.67 10472122.35 10446018.42 9345736.914 8103535.314 9281913.093 9385613.006 9899624.27 7553243.965 9218060.318 3293654.843 6377150.791 6413007.703 12306352.97 14227322.24 7650415.754 8774906.484 4731288.544 13603578.35 16208089.26 10712504.24 11249819.33 23058634.99 16018358.08 9165066.881 10936706.01 9697204.587 14674992.46 9416954.836 9471166.285 10784456.23 9197426.234 12797784.89 8269584.038 7143839.409 6299483.992 9287550.275 9657820.828 9568794.609 8075741.72 11737580.62 16086341.86 9382260.091 8480049.54 17543793.9 13633679.45 16318026.29 14501987.87 11858325.85 16019514.89 15885306.77 24009470.71 8583307.304 14625583.42 13791364.03 12858886.1 14282741.31 19681021.02 12799312.54 11810788.11 11200802.37 4545451.913 7145672.294 9991225.162 11182019.99 2899772.447 8885842.964 7214975.542 11820349.38
felbamate 20083790.41 15208410.99 13004173.18 30393483.79 30134353.11 28759798.8 16384781.88 17848674.49 16308759.51 13299448.47 3854180.847 15135304.57 11830922.85 20293860.77 15545580.81 6733110.679 3723593.161 9758613.966 15156742.97 20810579.06 16216526 23571805.18 12027371.64 13719126.09 16033452.48 14409733.37 11239572.15 19176194.34 17650737.02 23255830.91 9980853.415 11938750.07 6975922.434 15591145.04 17322410.31 27549685.84 13168667.02 5483008.234 16918207.82 11658825.63 23008301.65 3405896.699 7746005.413 13352544.13 4867726.949 38721465.13 7345305.709 7341332.674 10107653.72 20683053.17 30261813.9 15343586.22 8695673.146 12242427.89 13120403.65 31762450.6 16496145.73 9062976.725 11179026.94 15712499.27 26403342.41 11199455.77 4276914.401 8874235.197 17047904.01 20673955.34 45634434.39 44530898.04 54500961.78 42318920.51 53399553.31 44179262.85 45421324.35 57885998.73 68102828.83 47115233.17 44728122.65 50771400.89 44536821.33 28236026.22 43904569.33 30955541.91 33893104.32 37281528.08 44242166.41 19412522.87 30075850.6 25677976.68 1142631.245 20706239.73 22567410.6 18866870.57 2286135.626 22382443.3 28489997.47 14604081.69
Fexofenadine 6398790.134 4624908.284 8390721.611 7058305.219 8846620.512 5076943.867 4672391.808 8427479.689 6377312.361 5624486.555 6330850.423 7484114.264 3435960.437 4643649.769 5028818.08 3103921.744 4808850.289 5567616.159 3909216.63 9832252.075 6389501.79 4751441.752 3165512.573 7354123.346 7555765.596 4140920.097 7022623.901 7968315.447 6726608.607 7902686.689 6811345.939 1667951.583 4789626.913 5355140.025 6338795.22 14279697.52 6626618.479 3312548.841 2568551.224 5563806.538 6659847.071 6008219.922 9505924.669 5799293.036 466300.5896 4914279.638 7303874.056 6163713.477 5169207.486 6475163.031 3764535.831 6455388.609 4347438.095 5900132.948 5446180.029 2981138.807 5132251.232 7248531.321 3971360.51 5367833.019 6670357.468 1397029.693 2232257.094 787299.7136 8166851.368 5333805.997 5929242.814 14194009.68 4586108.769 5462053.134 5373131.978 7805224.232 5419019.947 5266290.427 9141362.672 2911015.524 9187255.935 8042333.589 5772025.328 3064174.935 4637388.767 4917262.246 6823541.731 5539444.034 3429937.362 7508149.491 5231216.206 9058698.105 106127.2011 2687551.461 3054515.42 3942303.84 643754.4243 5500997.514 8176634.353 4700367.553
Formiminoglutamic Acid 8259029.765 11069475.34 10250828.34 12258420.2 745556.3316 817924.0332 8705451.282 10714956.62 9037780.728 12684614.66 588462.7649 1130695.052 10535014.85 10824095.4 9035357.879 11145327.47 879432.7534 1082332.318 9249798.294 9896329.994 8873604.48 14153332.15 877266.6605 882628.4048 8350445.443 9126150.738 8182229.87 9797797.598 709309.4912 1010598.918 6578654.292 8484523.765 8195630.597 8487364.539 1339792.084 1112071.318 8394382.618 4596388.861 4523631.21 9476961.598 8182191.772 9931617.784 6237723.973 4105547.672 3188982.811 7127332.398 10270862.49 6712148.202 4688705.499 10335158.75 7188766.425 7600569.552 6176829.142 3631055.143 8814574.564 6644722.5 7974446.875 5815464.525 3462400.825 7626443.253 6256458.584 6071590.881 4725510.803 3758647.302 7689181.356 5820389.17 1878822.82 2500470.607 2707995.147 3120856.74 3179775.503 1631290.088 1837700.162 1790408.767 3649484.416 2205868.076 1237862.167 2523941.066 2164384.348 2059603.9 2302098.467 1475977.202 2278562.581 2304608.918 3131335.503 2258550.588 1861140.15 2427532.119 180354.849 3213541.904 2588310.073 2344519.217 870383.7178 2428225.233 3591919.981 2591791.963
Formylanthranilic acid 886813.7555 2928164.261 2685441.09 2145135.881 3698323.162 4201200.65 572036.1812 4332965.226 2948217.272 1205253.82 1034097.609 2225791.987 516094.5737 3908388.344 2677224.515 664982.8076 855731.4077 1821123.268 722466.4813 5534025.446 4723405.672 3078532.211 2386377.473 2734567.38 1171168.096 4820410.295 5802717.777 3567936.13 4876911.206 9065441.73 846160.206 4604543.373 5126824.737 3811435.781 7566897.159 14746664.23 3274130.208 2972599.069 3785699.802 2550159.167 7739435.943 870422.7238 2892364.527 3808061.876 581713.9178 7884755.415 1265202.717 2949106.177 2529002.61 3336353.425 6627602.384 3047873.985 7245271.407 4221322.17 2557181.289 12588039.07 3769216.39 5777928.502 5993268.214 4245661.6 9478553.996 5568772.429 6229151.557 5806667.179 6609740.899 9417823.932 6620074.984 6421187.71 2230616.852 6709341.058 5754421.681 17701331.72 15294632.05 4648038.705 15986938.38 11744887.1 21255454.6 21355770.52 6817158.63 13929324.87 15067229.43 21706287.73 18175167.88 7078945.962 22987950.98 8518962.925 18802765.64 14297429.03 211135.3082 12722274.17 9893962.234 13335554.06 1433691.954 4692414.708 14018376.89 6632490.319
Forskolin 1988166.536 2457557.751 467190.4569 817483.4167 2306789.857 3482600.859 1196921.616 432452.4544 389146.2615 653060.3954 2136854.724 4556667.07 1944030.165 1115879.616 1126122.037 1350722.097 2164865.33 5628141.836 4626916.299 3533095.65 5330337.96 9533870.485 8238576.575 7723781.911 40932771.17 4314627.997 9965943.855 14109444.59 10165927.81 9497313.559 99476345.75 22249980.72 20339219.14 40825503.51 18531943.47 6768780.022 1644387.532 389190.3022 2384712.267 1747147.847 1502188.006 1187579.189 1289472.822 1876720.736 826719.3215 1101780.166 877692.6522 2417744.095 1769695.871 3502200.405 2483471.966 5213269.119 1840414.893 2105974.002 6185897.499 6206788.517 13717307.82 16643877.06 23333930.56 6269624.355 6304200.842 57132389.75 55438793.32 45504440.09 12185916.08 8546565.279 1060079.376 1052685.572 2895818.023 842430.1906 1039736.304 2374164.421 4298217.564 1558609.403 2019364.565 2365337.798 3094361.052 4649782.446 4926000.007 2145142.958 3680045.164 9001072.46 5760762.914 13325759.33 7563105.611 4292921.95 8713327.88 7565289.547 370860.883 5345251.078 6765506.437 13997664.88 1595040.267 13538277.56 7680385.54 10596658.32
fosfocreatinine 8344882.982 9159308.751 8411737.763 7573219.675 5015120.839 7729273.469 6164061.522 6135754.273 8574163.351 4044732.98 5699310.383 5108905.134 7949989.761 7559684.429 8585737.98 5415494.954 2444863.03 5627933.41 8900684.663 9280009.199 10990928.27 10041672.89 3488380.359 7124930.756 10898954.02 8728360.58 11099926.52 12180795.3 8607379.872 11427199.14 11202403.05 9959439.509 12283152.53 12089195.99 10067593.59 12834696.35 6851806.846 7683191.796 8100239.904 5585318.135 9621729.041 1626636.882 3703161.5 8237179.525 3646929.205 11125787.85 4369178.01 6925571.668 9289724.491 7599431.676 10521561.97 6766295.616 7558381.996 8554002.925 7281074.208 10281369.73 8154501.405 11331991.46 9714595.732 7672504.247 12592956.41 8617253.784 10160366.95 11097695.36 10354324 13778333.46 7957013.943 8179373.935 8902393.213 6745479.121 7114152.464 10064831.24 10875380.57 10756979.1 9997285.029 9054058.41 10749056.77 11131440.11 11472478.4 8077985.424 9733094.998 12030649.02 10512393.46 10378617.7 9730163.089 8663011.67 10142879.62 11718799.49 2500437.004 8014517.568 8877883.71 10737933.65 7056593.398 9240407.314 10671621.27 10430793.45
Fruticosonine 2558816.544 21918191.79 13664152.23 21997940.99 20821160.85 19916963.7 8284438.843 15641586.92 15149553.31 6004296.776 20815991.02 12590531.95 14205631.84 19375414.22 37180615.72 19879566.11 7775070.145 17634264.8 13465537.24 3029302.81 56518393.43 2817898.87 12161587.01 28785184.07 3193492.119 19984091.34 4808847.86 14541614.8 2411943.226 4861840.306 4334683.579 14942540.92 16967728.69 9814354.903 14155745.8 52604884.93 16125589.32 7819567.428 42443532.28 20807021.65 26525676.2 30743254.6 3044330.44 20478667.64 3836334.471 3874222.627 12090964.64 24543924.03 21764304.34 10315648.72 31145846.98 15526745.96 24373190.72 8837271.615 2509108.408 6862006.575 23033053.87 14904781.35 40153885.68 10558279.43 32867536.8 25131056.57 14410637.07 13372764.61 15446760.79 7042847.437 18450328.69 13975453.05 35825374.39 16369035.48 2730080.517 18269898.61 24415223.97 23496839.2 18483332.98 32811266.07 1962959.852 17535331.04 15251854.1 4866095.052 17526599.98 8742951.783 6623888.398 191138.8644 13355453.95 882440.2765 2048380.292 179762.2194 122654.6419 4193938.227 8419788.484 5140130.732 1831192.877 9334752.346 1450962.876 726921.5989
Fumaric acid 12540026.67 18018889.37 15343848.7 20857068.62 10369974.5 17520852.18 14499777.88 23525577.73 24152525.13 18854133.71 9794895.41 18739621.98 27455505.21 28611152.1 31114555.27 23327903.66 15891384.25 27232863.35 33602047.41 36411712.54 35582842.01 46476192.25 23887894.73 31448967.28 43336929.79 40584417.01 48217425.76 35649454.58 33494210.22 38033064.43 41715948.91 52915766.6 65368923.85 31171819.47 38193715.2 43452819.42 20725901.36 7686565.226 13051148.4 25332450.74 17227186.32 27924438.27 10391002.62 15533336.6 4135722.536 22180378.82 30511255.31 13676301.03 19275040.4 31905779.38 35648311.18 39124397.86 19215594 32433601.74 35474037.84 33136269.99 61118346.78 30793557.84 19264984.08 32171478.02 32719052.83 82102259.94 22819329.03 31285277.36 60091943.55 67110705.05 30676847.37 30511822.57 31680535.22 15139699.3 22838450.1 44356576.58 37137201.31 42176389.26 37914671.68 45095300.23 45947095.13 56985555.2 69337811.87 22803374.97 38256995.78 56589946.35 70242329.97 85363200.78 38661121.28 43521725.87 73113024.75 75305405.16 4270906.481 38859358.18 64875621.35 93253093.6 18007787.95 70167503.79 56440765.56 62958962.43
Gabapentin 21877989.22 17031221.5 23519290.37 17533701.28 18002669.5 20218279.88 15137159.42 19301378.57 53444715.97 13678681.91 17323837.62 15016988.74 24549827.48 18116000.74 13161170.01 15712140.92 11654882.23 17800782.72 11505689.92 12188979.36 11454545.56 20083151.55 22082372.64 13874391.29 22705962.23 21298720.63 20289873 21951984.9 26228843.51 12247845.3 6891268.196 17482274.94 9548874.051 7190155.657 27223801.28 9370769.757 26263855.18 14980764.38 23119432.06 14990061.11 16547667.46 17356639.54 12191810.71 41963506.87 4307913.155 15636378.14 13667707.66 22721065.18 27449992.22 25070325.51 14750591.56 10772021.39 15859875.39 17998915.44 15218657.85 21906026.77 26557053.99 22957211.21 28580986.46 20032512.55 27889215.2 9861241.117 7450454.974 9407244.847 8171329.018 10160434.08 25921866.8 28044038.74 35122959.92 29705167.3 16548416.12 19304702.55 14726860.45 19100172.37 29025632.97 19383622.31 16646802.93 23959469.9 25660308.73 13083051.63 17333992.84 15892795.99 13800778.29 21437028.08 17768637.1 11660107.3 18706099.15 14561355.99 2074867.385 10148981.78 8980358.189 10519909.56 2904766.137 10934413.34 7884002.252 7509819.565
Galactosylsphingosine 1165578.439 1228992.637 804880.9733 1752450.251 2082112.602 2863063.886 1047688.055 531294.2733 790292.3677 797021.3976 3046650.689 2677560.624 2101676.523 986263.885 1460690.514 872859.5309 3182540.234 3382339.899 1789854.192 1222503.252 1623584.713 1567370.556 3013181.086 3472142.518 2389853.607 1051829.896 2482709.375 1868699.514 3515940.207 3980941.371 2189402.6 1596695.58 2672702.069 2457518.886 2558546.822 5638237.661 1110953.051 805570.8966 1344988.048 671286.0209 687895.1187 635098.7501 1213614.506 1376548.327 199938.2594 958833.2021 1072911.882 1569459.257 1641916.311 1111308.306 1430422.134 1069890.679 1331767.28 1712078.733 1040252.056 1297817.988 1339046.237 1458553.229 2889051.077 1122220.102 1306796.73 953640.2155 963493.4974 2866474.775 1217527.571 1490027.213 369303.8773 327512.8828 342240.6233 325369.8825 186741.0205 1289908.199 988845.2448 1295914.811 659233.8976 635579.8922 1563471.638 1332479.947 1494045.169 316710.6588 696804.3848 1621043.802 1335583.202 1597672.91 626921.5069 590154.4698 1549386.252 1080876.964 54796.41649 488336.4884 919001.5217 1448340.924 197266.2287 1216743.671 830135.3777 1250613.047
gamma-Aminobutyric acid 9763543.995 10496911.68 10151107.73 9831087.699 6318370.843 11697961.4 9638480.273 12336720.42 10581528.37 10532698.78 6588372.967 11694517.81 11620506.41 12767485.19 11294652.22 9434430.615 7587060.273 13455545.56 11097428.24 12426591.36 10826169.55 13172633.42 7494062.837 13097971.1 11029796.16 12036130.21 7102099.992 9470669.738 7298654.609 13101405.97 12682459.84 11415359.01 12117106.65 11955462.95 8474291.917 16043387.8 7012620.89 11908485.7 7180521.072 13338196.94 9743019.324 7684572.3 15889003.75 6934849.626 9126426.974 9582905.025 11228124.76 18454271.5 6770591.827 12987717.8 12159465.45 8262242.215 14786621.68 6118481.978 13768824.06 10269659.69 8453108.142 15511900.51 7459105.479 13366848.86 12582527.02 8429051.652 15836784.72 7318299.527 14796313.78 11579901.84 7481421.201 9424333.055 8839670.047 6895444.728 9145991.066 7956758.192 9061593.865 10210032.05 9278518.188 9699378.741 7757935.316 12104506.15 8346675.243 6296581.211 7851426.434 8436576.729 9604166.28 11016230.66 10164436.92 7269766.371 8944964.106 8805051.757 3547350.538 10401219.62 9226538.382 9676470.4 6505287.308 9511362.772 6552244.497 9253676.03
gamma-thiomethyl glutamate 8614812.386 8665459.874 12099802.95 10325603.13 6998180.349 10783502.86 9149457.148 6767315.049 11354920.93 13697627.27 9111438.934 14571468.87 9200086.466 9935019.027 10705412.62 13577678.12 9484243.846 13682635.69 8522207.569 8189673.75 15881847.38 15949460.95 9954931.986 18245095.38 10917455.68 10261091 14695165.38 16299753.69 10515147.6 15379638.46 7566844.07 8367077.915 14554494.99 12001120.67 7636438.773 15723090.75 8010911.13 7973327.776 5238465.903 6884515.112 6643709.893 7683234.313 10862948.76 5627860.617 14689790.87 6456344.032 8472399.646 10233584.09 5293653.672 6586748.887 7142364.095 6249502.181 12814735.89 6341609.62 6859239.636 6820660.584 6705114.507 9587813.341 6356948.174 5443061.875 7550138.325 6122839.574 9323183.932 5961433.624 6292302.728 9898973.017 2958654.703 4076562.357 4177502.754 5365973.854 3601077.095 23022240.78 22837258.94 23143947.95 33817436.25 14880533.21 24631933.68 29433842.24 35278506.43 29761487.22 18055469.25 23343448.61 29766417.55 33966291.16 43907905.36 18333348.06 26192258.07 28475336.69 10344229.39 33722084.23 25758398.96 26862582.67 15372283.83 33152765.89 40211253.88 31372249.01
g-Butyrobetaine 166783021.8 128497092.5 170427762 143550542 127562676.9 83639168.01 92017513.96 135480214 146720903.5 83348896.77 41953888.78 36448739.7 103897363.1 120039404.2 144179447.5 86309681.03 35423357.99 46478997.55 77226349.75 84598206.07 114565418 64309696.31 33123009 38050818.47 87024135.76 77654628.38 101066137.3 91556556.01 95139783.2 66890524.2 101902414.6 74531595.91 97820383.02 99265685.89 79889479.48 102023668.8 110387489.1 178867383 145993828 166349136.5 224902137.7 41216190.32 87696484.94 124407803.1 58501365.68 160258582.8 57433347.92 102526497.4 106043162.9 84117302.16 158503514.6 47382108.73 66816743.99 83906442.77 63565576.71 109694131.6 51759931.46 88948866.2 78868011.84 68083118.92 109662246.8 63554910.42 110545281 69172373.77 90150364.52 134205768.6 75005358.4 100246443.1 87280251.93 70425943.76 81818470.12 58007681.07 70482330.94 61293967.07 64862681.52 67224469.89 43071037.17 64791739.59 58679040.11 42432403.75 47194581.7 38731848.18 60074707.17 54223135.79 41132025.54 39117267.99 44378665.37 55273823.41 20563440.86 49187115.91 39186842.41 50980704.54 53595348.78 58691402.98 42139338.2 50406489.56
gemeprost 84909.19408 140871.7675 81887.69261 161777.6305 541552.0001 6868841.975 86811.49148 141048.4773 78178.21622 579113.1748 884474.4491 7760579.53 191641.4447 91030.96381 74704.76027 391235.4209 695491.9368 8539696.661 91371.08535 85209.41894 84776.58238 326303.1446 741076.0251 8983411.103 105384.8292 94162.07156 93027.27998 202361.5355 572454.4892 6616832.594 185250.9389 94947.46515 95467.3179 260257.298 360246.9923 6478425.549 86954.35323 78188.5078 85357.99569 83736.79145 87096.64506 95995.81844 90032.95698 76885.37715 62753.33638 80827.61716 131523.9314 102188.7489 81846.70527 94833.35205 83225.04347 101069.2179 98927.6077 82475.75482 87980.34704 83640.1726 106971.9666 111124.2515 99075.23697 92773.67693 92476.30007 122468.2647 93892.18604 103724.4615 89526.6273 89196.93774 151818.7731 86583.28223 424135.7149 205075.8314 667744.0888 95301.36591 95962.10291 309731.1595 93450.71297 400728.8417 111167.8045 109594.7053 368424.5083 84591.30794 412490.9973 87725.93014 84393.10717 355791.4533 100027.8228 246459.4092 105089.731 93271.51862 67081.58096 80812.2448 476554.4224 103439.0401 67976.79236 285832.6088 215590.9485 553953.0913
Gemfibrozil 2686353.451 1534798.907 1840777.659 2131556.582 2160342.009 2325772.41 2523040.137 1891783.16 2766244.191 1814971.505 1776688.196 2692003.498 2331301.602 2163940.985 2107095.873 2166753.104 3031058.681 2777036.376 3316757.576 3954435.738 1945645.242 2699382.613 4154514.216 3748336.406 1998336.422 2445205.039 2549607.053 2231002.582 1486769.037 1693883.645 1360264.007 1467194.458 1352793.362 1675185.164 1972950.014 2380250.779 2369069.335 1751670.392 2893062.547 1908787.825 1802247.943 2946256.87 2578371.385 1514101.893 1518242.627 1686196.982 1734514.655 1994769.512 2487135.645 2120388.197 1758771.815 3892652.289 1830507.834 1604809.572 2411914.464 2121654.383 1533019.724 2863515.951 6855395.155 3018043.479 2279940.484 1516974.716 1634677.989 1923640.7 1698692.83 1333915.381 1911026.331 2182332.2 2191555.941 2224905.551 1792658.964 2720346.085 2963087.194 2492461.2 2115838.684 1545230.3 2697483.97 2873244.966 2275800.545 3312039.174 1764284.943 4816254.316 1996417.88 1530959.687 4706997.945 1502379.052 1655704.852 2152013.666 1127649.215 1646763.32 1791209.741 2265681.359 1831385.611 1529532.389 1902885.389 1808454.031
Genistein 688354.8831 1662253.373 456446.0793 1482427.532 44766.93762 515678.2849 1299588.698 1622187.64 669365.5739 2197126.779 272357.7441 1125553.081 1890068.508 2398981.511 702802.6314 2032742.284 240757.9269 1071006.767 1782970.351 2006713.472 723831.9274 3622816.582 339004.1662 1476101.73 1268975.434 2123376.549 794404.1125 1804592.245 215452.028 1059768.703 1595717.657 2474019.176 812078.4345 2233500.267 220153.1933 1130825.702 2410170.273 1448784.882 772068.8365 3248495.306 1621025.115 5097325.392 3660107.083 985104.071 1486137.085 2122638.535 4830387.2 3568030.74 1009010.147 7809442.309 2754593.884 3936752.429 3686723.802 948099.5561 9389069.298 3457644.282 4217433.277 3231265.228 860145.5422 8709782.623 3088360.002 2835992.772 1820438.431 1085705.828 5215330.389 3717621.875 986858.5308 1440525.443 1939126.213 1453838.354 2824358.253 1212480.429 1913050.604 2173757.199 2408795.191 3281804.468 1303942.332 2376110.377 2486481.307 1987695.597 3627535.143 2163850.861 2909975.207 2643485.087 4349642.686 2921725.422 2179119.12 2075238.157 257153.3886 3060305.731 4810898.531 1471720.185 802647.4324 2338887.62 4402737.126 4764984.782
gibberellin A12 174469.0583 156799.2902 125522.3059 146750.2653 3178010.176 5754006.335 176024.9963 104387.7251 151140.8362 214058.6198 5334537.958 5841449.792 161219.7334 116588.7859 152424.3869 202599.2587 5269725.415 7828227.249 95784.3879 144631.2704 97088.67289 123463.5191 5494568.608 7156886.565 172992.1481 208238.7211 165075.7427 103045.2261 3954816.551 6326190.576 219933.3494 121835.7334 315386.4479 177417.8626 2368412.511 5978455.114 149030.2463 150868.9565 209001.3708 96441.78979 165653.9228 138479.6967 181108.3791 236371.3478 128273.4158 152009.466 203034.3572 116682.1698 145369.8641 119597.2944 142994.7969 98882.18552 113603.2002 167154.2507 149644.1039 423989.6011 111320.9774 112818.8102 102387.9864 90216.81302 95899.70006 274339.3633 111911.2774 266750.1651 120956.1337 177123.5111 689606.1783 785998.2291 286542.8039 799274.273 298230.2357 658027.1881 739716.6329 221548.9167 974825.6074 388024.8805 726037.0401 737203.6531 261027.6466 331151.0242 369789.5165 667176.2475 737253.2982 204871.0219 880612.7381 183568.0067 1139018.904 690274.1813 73887.98099 617354.0161 406934.373 822447.5236 186516.5306 309196.7756 737084.1954 397362.0467
glaucarubolone 150823629.8 211281136.7 12534935.9 6662125.159 37542777.17 28601283.63 49901545.91 2754686.476 231117.121 16396562.32 77974180.66 1518546.094 811141.1305 3770391.706 26947985.04 69365792.93 154275194.7 3293063.542 44975715.69 6695797.208 201282.9727 60760898.9 4885013.751 2006855.3 705759.033 5768682.848 90198952.81 5960352.897 4205709.269 5371549.413 627722.1404 5991847.41 183556.7294 4700221.344 69888643.61 2775025.814 112435932.5 996358.9677 189276564 131729551.4 98317631.13 19362987.75 2595483.078 121574022.1 47396881.36 69822403.7 10552342.21 155353757 139872565.7 94401492.12 109735316.9 89901064.02 82129216.73 8620287.84 1528600.523 2333453.35 7775520.967 5832680.185 851139.7053 45471588.7 2070575.104 858640.7334 1030220.947 780184.0221 1140979.236 59763694.12 234549.6074 52554755.56 272532856.3 4214687.357 66820454.62 167860803.9 87986385.89 44189791.4 111867.8478 2547230.258 46202107.65 59969500.36 208933032.3 57514.28387 45146.42463 55160.20672 166656.4157 6838136.201 420282.7828 21205190.47 52594541.6 35460198.78 759685.1792 133217.1773 8224268.384 251481.824 3959998.69 4850758.027 23119999.52 11939992.38
Glu-Met 2503150.214 9548749.145 10936207.88 3421413.915 1961277.741 1919086.263 948923.2627 1859735.556 713195.8128 940474.8483 2047600.385 1720029.222 652271.4583 1013803.732 426347.4587 943710.4152 463789.3846 699967.7561 560239.8973 645928.5458 814087.3021 746063.4215 525815.7792 762022.231 645058.938 577311.9417 634489.7504 661471.9508 542764.5588 633753.9846 668177.5464 728078.7524 680483.7409 605831.2084 637423.6865 829511.2168 14482541.18 7254414.294 1935511.494 20082892.48 12588730.46 9975288.441 1062488.971 400785.3301 1158051.765 503393.1456 1387655.879 518362.414 524505.2809 1078082.606 699442.6676 516901.6555 596843.5669 589587.3251 681887.0428 662136.0436 583532.5999 1007552.119 583866.0794 2540512.97 742622.5633 553454.4468 620093.3598 907991.1269 1129550.049 699077.0555 325053.9219 366989.9248 399374.7826 640184.6989 618419.224 931784.885 402641.7462 387181.5165 366737.328 430028.6502 583807.4141 636190.4745 611973.4187 433977.4327 523976.317 600089.4636 575766.4727 652306.1459 534994.6447 601794.1586 571236.0156 620408.8759 298301.3569 594037.2186 552461.7447 631222.516 544463.0289 628875.9177 640327.7585 661269.0581
glyceraldehyde 3-phosphate 94436369.48 85918700.89 91254941.3 107500794.6 94244618.3 99704374.64 48693198.71 71196647.45 89015463.48 44352977.09 41923829.25 31333067.99 85728323.02 55854320.58 93947919.48 43949861.91 39167691.81 47461969.01 24882790.64 31015216.65 37453946.95 20029276.43 16607093.46 32739806.37 29472500.61 74485362.07 23109027.98 23220476.12 23272456.68 18471576.72 11460844.41 72636748.33 19553898.92 12580999.99 15110343.82 11068392.54 124923547.7 104780880.7 110986083.8 66779740.33 95303505.08 19005490.76 25560875.43 98939502.95 62109012.35 104996665.5 38233364.45 48250310.55 104636437.3 51438859.22 100091510.8 28092851.11 19362696 66195275.01 35392907.63 44684891.97 101189450.9 33635493.53 36274746.24 85928127.62 79763734.94 89749392.99 27441284.71 26173039.64 23344433.32 20568684.06 206634891.1 181365089.1 238594356.1 120875086.3 99558841.2 116957087.7 117989240.9 218520652.4 307966538.5 176769620.9 8264377.093 8877579.314 120760191.5 5236745.257 7004158.143 19114600.57 27085918.97 17353726.12 10102761.27 8660350.188 8698415.526 10083847.04 2094783.251 6459316.456 8090596.314 8326139.125 5118391.867 6756390.786 7408018.157 8370745.918
glycerin 1795296.259 4193707.792 2731480.365 804538.2146 2872930.429 2403610.825 1580242.396 3215874.624 3953836.347 2168365.887 3265914.217 1819605.154 2924634.489 4120806.623 3513361.329 3905677.573 3005142.073 1539558.739 2334126.618 2638035.776 4668100.94 3896538.733 2491269.431 1934850.782 2945523.029 2984166.618 2579996.332 2381525.292 2367691.306 1253225.688 2644727.934 3279527.127 1549615.4 1139028.114 1922331.358 1128503.997 4138508.663 1721818.179 2044369.589 3233629.213 2986191.246 3199098.97 1001451.784 2451385.623 1385589.34 2277412.623 3832175.579 2310337.523 953884.3009 2703774.246 4725236.089 2261663.414 1606506.204 1830919.437 4220699.367 2049416.319 3093966.267 2044340.679 1849839.411 3268049.38 2106497.834 2631067.652 1677817.212 2041060.467 2640470.859 2656642.742 1029981.186 1675110.217 978180.02 1518106.75 1495575.819 1022908.028 1211872.274 1089030.877 1899615.246 1680922.264 1267518.368 1628610.225 1133925.284 1242970.519 1291392.818 1190831.128 2350136.92 1338214.1 1363953.347 1207680.233 2450439.057 2219429.202 293177.9607 1278558.559 1155481.767 1834015.435 989777.8343 1446963.469 1014232.126 1128575.075
Glycerol 3-phosphate 17542970.98 48191117.42 40030579.09 58742930.84 37512975.88 43863082.61 58871009.79 59029578.59 41543810.76 65842286.61 53703284.82 49701765.64 45316809.15 62973028.94 57677582.56 59887246.01 54396367.28 50912767.51 50353479.57 57860125.59 49500413.56 76498529.46 40796089.53 47752187.01 86753724.73 114358853 64171377.19 76364583.96 45250626.89 31704828.17 44152293.87 71417704.62 45597037.22 45989614.05 19808259.29 25571432.64 35160837.71 32743769.36 42351024.4 28699351.59 30242097.03 75977969.47 69400658.17 78201788.57 31384211.71 56544345.82 80975397.71 90527007.65 111090925.7 69345101.02 56008377.04 84346326.93 95794604.65 110354889.5 72839668.2 78390134.78 189108747 116997614.8 103817289 157577984.1 121744681.2 113788030.6 74025543.92 88699194.86 69914927.03 83460599.46 103864680 131891812.4 131556894.6 116081330.2 141275892.1 38378497.27 53186178.83 34043127.89 69049956.59 95951600.15 25546534.27 38368194.61 40145395.88 59896995.69 36539699.53 43406033.32 44119517.28 40186529.66 37684808.61 47906972.07 50105790.18 44591349.43 16686324.05 31882600.99 53386234.85 25798924.17 28342401.59 20450454.06 29938037.7 25301203.85
Glycocholic acid 11021477.98 2511166.075 1190088.551 7165292.85 2445003.218 9184862.157 12467203.63 5857307.616 21573053.27 3853287.161 2182590.616 8431064.927 10556443.73 5682900.172 7374422.086 4465183.681 8227086.203 1792570.181 19109234.25 7064983.268 3223603.705 6981099.93 24411237.09 6615489.696 17942521.07 12181887.98 10309262.64 6624298.045 3091474.131 5748548.184 799802.6217 1045559.332 861757.0793 811528.1275 3017293.739 1220295.27 10856610.09 2340963.033 12332854.83 5692771.435 3030276.485 22805396.49 1664171.845 4074022.566 2372770.238 2553817.94 4089006.593 3905258.619 2843497.176 7415691.54 1770650.212 21272673.49 6341995.675 3573160.703 8080581.179 7827538.492 7688232.863 17649348.64 7037437.178 1488610.154 5989381.584 2502363.237 1334358.541 2521570.863 1238837.406 1110255.128 1321303.376 8416854.718 5276889.052 5827430.249 3475223.907 13184239.19 13221685.97 5328133.309 1240427.871 4697949.413 14438378.46 20699823.98 16986445.71 12355851.06 5315349.983 23921718.48 4174581.618 3217155.964 5439821.497 3020866.853 7919332.565 8205712.832 853486.4997 9034372.859 9366032.265 1962306.26 754855.5697 1810803.389 1903195.63 2710691.47
Glycyl-4-hydroxyproline 1083502.245 1938800.614 4319989.419 2292513.372 1012025.476 1813299.148 1638777.711 2405798.163 4116887.913 3873595.655 2094538.483 2097976.885 1088338.556 3416071.916 4200576.155 2040091.48 945640.1354 1727383.241 1215292.255 2144058.013 2841100.441 2898978.177 1047866.059 1263365.85 1334340.483 2181234.363 3022902.869 1902932.363 1075945.791 2206492.818 1196938.404 2317226.791 2857469.083 2091871.533 878098.097 1253973.934 2869499.639 3066761.341 1396427.205 2995472.837 4144028.424 3045141.559 5811710.086 2469966.645 940104.3496 5154961.603 2279321.879 6942071.835 2462632.308 3831541.714 5074897.801 1972104.504 4227314.489 1504730.076 2889141.61 5387872.387 1919324.278 5590342.803 1613373.11 2969964.602 4510768.79 974946.5087 2507257.99 1987192.68 2307407.691 7205637.881 815002.1949 1590525.384 1907967.339 1770125 1319527.774 728147.5032 1316209.992 1563531.851 1734760.488 681661.7483 2564948.414 1658039.028 2467782.518 3062841.516 1201355.511 787904.9755 871505.3101 2201387.203 2384289.464 657374.7739 862437.4352 751607.7408 694547.9412 938169.4205 1079663.572 947602.167 518063.7748 833764.8076 2291870.486 1057601.279
Glycylglycylglycine 219057.7353 911072.5973 1061257.687 562994.8621 226655.2884 637268.9848 1732203.64 2487413.239 2667876.155 2494301.616 1791275.052 3025304.143 5058564.298 3873160.828 4507687.39 3415095.219 3548688.952 4098389.945 5750386.399 5917685.378 6030024.831 7160679.777 6736423.417 6921620.648 5249135.483 5316935.452 6112695.117 5030873.012 5078944.513 5422385.525 4875486.644 5626305.347 5498384.777 5400436.36 4864870.003 5158712.797 374024.2452 481745.8158 305051.0969 708628.9343 565256.3416 2637759.725 2322701.808 1977704.707 508424.4389 2294628.08 4701030.589 3413980.011 3663912.729 5055102.503 4672340.279 6000410.842 5131810.82 5130733.89 5743286.174 5677651.199 6258667.911 4874306.186 4653398.341 5216424.938 6192260.571 6043315.232 4396014.736 5307392.248 5884603.19 7185899.95 2373158.257 2512747.609 2176400.842 1320520.216 2046237.389 7091659.571 7229179.169 5997086.953 9147638.36 7688616.883 7515390.259 9357002.728 7629653.02 7728612.84 8716363.006 7048545.208 8909632.666 8488018.942 10956085.7 8841101.214 7939620.322 8968221.615 945482.7906 8696522.065 10052876.41 8584551.403 5095843.008 7817482.203 12156839.49 11754235.59
Gly-Leu 771837.0903 520908.6053 691073.3485 989445.8903 878214.1584 621500.9286 394579.6381 804341.1055 349016.3311 627005.7442 869571.7407 918312.0997 539158.5875 946768.4586 564780.8606 1208612.285 1210961.398 1183720.706 1420791.513 1041194.536 840186.5699 1067526.633 2128418.124 1555094.188 2563571.869 2248580.36 1277516.949 3548400.206 4070168.739 4353046.507 9644531.204 3329290.123 7349534.539 9796547.17 8992516.463 16903304.49 753979.1779 232982.7105 418484.6038 504141.1112 424233.0533 1877783.641 409715.6575 481260.5802 946835.2007 1259725.441 2345487.174 818487.1012 1114071.755 1771926.352 1688687.897 2031793.035 687475.4163 1388456.777 1578689.888 1151945.178 1861401.83 2124561.97 3069349.276 1734716.45 1280270.769 1365739.838 4618550.128 8044229.012 3838010.431 1113340.952 1075010.825 1025346.042 1884787.999 1150330.603 648869.8908 945127.4993 494960.7602 427874.8206 457148.0768 247142.7773 1415403.471 1744505.575 1758366.47 1436872.066 1561624.87 3829715.745 4288723.738 3871383.593 2300180.519 1960194.94 1875449.027 8871601.585 295194.0412 4626715.542 2783349.677 3374622.505 2478423.434 5613454.288 11994609.25 5839686.205
Gly-l-pro 2389536.636 2596197.102 3399466.169 2227211.223 1842960.644 1774316.744 3848891.819 3402792.345 2255679.078 1946785.087 2352221.757 2430531.365 3036365.519 3096434.499 1465422.053 2831676.897 2134624.671 2366130.773 2634956.111 2865883.329 2908400.102 3156877.647 1894810.407 2523240.207 1904213.277 2966443.029 2533278.324 2025757.454 1762601.042 2322705.98 3405255.835 3224589.284 1082185.557 2739588.238 1327459.566 2524447.841 2180311.732 1598740.148 1309254.239 2520530.34 2087541.281 2597996.69 3253837.103 1743022.783 2221240.643 3073952.512 3847812.963 2465952.691 1651330.836 3802376.143 1947088.978 2255141.43 1891614.661 1253234.252 2465103.025 4004727.481 2555926.649 1304364.116 1156836.946 3842592.85 2240044.841 2932812.977 1981600.808 1710252.087 4116683.154 4632606.286 2979116.863 3191125.038 2675936.848 3479549.074 2421204.475 1909342.466 1787792.998 1866113.243 1685448.299 1585481.942 2054523.916 2808821.572 1429966.431 2446851.567 2172198.211 1436864.359 1991516.91 2180042.024 1553941.743 1922425.18 1477731.4 1206579.416 842683.9004 1155681.378 1872412.47 2346829.049 1226220.371 1420472.613 1452278.115 2193026.633
Gly-Phe 3238312.051 3078710.356 1231417.558 4477739.133 3773105.174 4471905.026 2601409.359 2057891.133 1942396.167 2398904.678 1523021 3386748.043 2144878.533 2440414.923 1552271.627 2296048.181 1173195.002 2110137.901 1666673.135 2983612.81 1974300.381 3646439.256 2130785.906 2567829.659 1451558.058 1361898.682 1371748.764 2210962.026 3062825.314 2446652.273 1076818.683 1149709.525 716089.3263 1711543.194 2569990.595 3193983.18 3007080.724 1011749.661 1908327.324 1776195.467 1853528.132 522085.4927 1100490.391 2115816.958 1782132.375 3450167.938 2348710.261 1179423.707 2173404.286 4814445.77 3633204.809 1902974.142 745557.7289 1210079.41 2162281.622 3289925.177 2735821.359 835355.1858 1231217.558 1571100.2 1755911.936 1089316.017 535246.836 711836.7651 1577736.563 1522348.244 4221135.632 4485876.976 6844078.026 4864559.717 6993879.476 4074617.654 5257209.934 4464176.098 5357587.857 5967424.95 4334364.383 4981608.395 3291507.67 4735000.479 4739742.476 1807032.699 2718699.039 2348857.082 3835302.25 1825003.218 1623579.622 2753935.099 199579.8317 3000563.458 1833041.146 2380858.531 327814.1006 1133736.839 1563198.167 904612.7583
Guaifenesin 747229.8559 856416.5881 1187745.001 1304442.364 2143461.121 2480235.355 971285.9536 762148.8456 752623.4937 1845777.861 7053717.85 3007428.699 1136746.617 845031.1258 807228.8456 1626265.509 5097074.559 3668679.322 883683.3943 725411.5213 745484.2042 2111070.765 4536790.823 2844276.607 1385981.708 1020026.146 836148.0642 1305389.073 4361340.603 2770644.3 1192821.236 699849.8534 681397.7233 1178755.02 1768613.964 2439419.812 727205.4848 561423.1637 1120370.909 705165.6348 676052.6856 1331428.464 1166661.712 1039808.353 505227.3471 749929.9076 1344012.586 1129435.875 680395.6795 872389.2789 758011.7687 1168592.748 682736.3056 623998.7683 757575.0343 665787.7653 1604997.753 1133241.24 776179.4275 800843.9149 697664.7882 1053799.124 618418.1014 1189955.978 576923.8513 770942.9425 694573.4728 626043.4055 648971.3061 563348.8842 637416.7329 799504.4428 573072.4175 750996.0765 817396.9691 492314.6023 653079.8597 568030.6096 464848.5576 377107.6619 592871.2449 636781.7344 564623.4907 675836.9276 1108963.55 447103.7897 669510.4649 570751.6337 308060.0559 587844.6841 750439.4686 969513.3811 264681.0457 434066.7916 710598.0233 803642.3864
Guanosine monophosphate 2750147.202 1112440.488 2048078.248 2207545.814 2516407.272 5216635.194 742733.5797 1505119.823 1156974.425 829609.0323 767581.5715 771134.6359 1022737.823 2017285.429 1152892.407 869452.5241 884598.2329 3190303.429 1176816.79 1410062.579 1838246.936 4407830.482 1224829.785 8028452.27 8067081.21 1802637.433 15890500.45 25517061.4 17644700.17 28950458.99 14189046.47 1376356.897 22593850.55 22051159.85 16936982.95 42597836.79 8237493.38 2130083.752 4221474.786 7366438.951 4359929.597 845761.8527 789832.4787 1721056.311 422327.8004 1101091.773 1310253.621 1088239.861 1493627.858 1298070.443 1289750.335 1057644.596 1001956.59 1461679.782 1415555.077 1227458.948 1289517.586 12059169.33 13582179.81 1867836.797 3243890.884 2901914.31 15900581.91 29407339.06 2296123.467 1162737.798 3446755.291 3440753.27 4837183.047 7132302.608 8377249.699 1192277.111 1179791.643 1020454.852 1320256.047 1242401.475 118678804.1 145251577.5 1027756.191 15949888.46 92639989.94 25125513.43 57433934.31 9254652.102 52229785.21 63417623.35 48751297.51 90376106.94 934153.1261 49544491.45 60948729.45 137113928.3 46934973.34 60347920.86 33600087.42 87577356.68
Hexadecanedioic acid 5279916.441 7272350.837 2002065.904 13496905.17 25148220.59 35684852.9 7892126.881 7334881.504 2192558.705 17661739.88 56662625.71 49048450.01 9557000.526 10202723.33 2851910.95 12919948.28 55918760.1 57418270.89 7881261.638 8818566.752 2893323.721 21693971.19 51606118.86 61319753.72 7159398.979 8581911.688 2544572.46 12000546.41 35378509.01 43949684.57 5927847.703 6774116.707 2758922.273 9639953.304 22146750.65 39512124.17 5341172.336 3763528.813 16293561.08 2452472.145 5862809.257 9689286.559 8613242.639 14558836.67 1332714.25 6540743.205 10140302.67 8709607.407 16335796.78 5259948.666 8897913.938 8856721.077 8553322.813 14505671.28 6238330.81 8328926.356 8984328.502 7579188.683 13291973.71 4815483.094 7513344.705 5191641.339 3938798.568 12824584.07 2972387.84 7396431.019 2912872.049 2434590.332 2237605.892 1321499.719 1664491.966 3558452.306 2766381.766 2193901.078 2276619.9 1568628.089 3024136.801 2701218.156 1973507.725 3077661.858 1447524.419 2687554.513 2429824.893 2280453.682 1657803.6 1014943.491 2395234.598 2015904.071 589049.1388 1301337.763 1716996.565 2668093.988 736380.8711 2094158.211 1531704.151 1573705.611
Hexanal 23167013.58 18337872.64 15506208.16 19398853.75 25036019.02 20309897.55 23293066.55 23104150.41 28272943.51 30724500.37 24728860.11 21384319.88 16862070.13 27899851.67 27560693.72 19746365.89 12208240.38 14037297.5 15319474.5 17480004.55 17200649.52 19918401.18 14326558.56 13067854.97 20656959.05 28421492.63 19681743.87 20258715.88 15198576.56 17920387.16 97801214.5 152305611.2 66445477.39 88848348.56 255133428.6 89934779.71 21173586.2 21218381.31 20041773.64 20989188.34 22359801.03 23656809.29 31329746.68 23201775.69 18268829.98 32501384.15 32397009.86 23860820.6 19050186.5 22588926.09 23120774.56 16440303.52 22911566.78 18682000.64 16641849.97 17433958.86 24582974.34 31053075.77 29389189.43 24178932.43 29913557.01 226265616.5 126201194.1 247730567.1 130613963.5 128484110.3 23239792.58 21528164.86 31421065.48 18851048.5 25809361.93 23158400.29 22458801.35 23968085.05 26266872.26 21266441.33 17759990.55 19073040.83 34202354.63 15559013.58 17879266.82 18052976.54 18527518.53 22917034.1 17652644.63 17151865.13 27999293.34 20744922.44 11013184.24 16708724.94 29167788.44 217644190.2 63623143.61 141515227.6 121286592 192738885.4
Hexanoylglycine 31068864.33 86854399.74 31061478.44 56683083.2 11290636.21 28109624.96 29967974.25 74176541.66 30238069.37 60800481.39 16622984.22 27178708.67 43519415.78 80796475.72 33882146.2 48047910.44 15065997.92 32493250.41 37200206.47 90406554.62 39371186.59 78562535.61 15928919.05 30703633.32 35649751.63 68166837.99 29040376.12 50319430.79 12820697.83 26722828.01 31540199.75 75729572.92 30673278.88 50001191 11413647.1 30664518.96 22979752.25 12139168.79 15703970.55 14321800.87 22591819.62 21258789.4 21600456.88 11893124.54 4410998.291 20280076.06 25079235.8 23336888.89 14385820.59 14715286.61 24018260.4 20578184.64 18869524.06 13388137.85 15483572.38 19340802.6 22613755.96 18654081.47 11227560.85 12672455.76 19614939.28 18781264.62 11684754.91 11798409.85 12519511.72 19135630.06 4884767.247 4495209.477 6271021.846 6889386.17 6099453.074 4995261.647 4655991.451 5230088.197 9046873.565 5338288.994 4915215.506 5323542.629 5749444.547 4728217.638 6021100.798 4965076.28 4814548.993 5568247.589 8435598.752 4326817.221 4102709.598 4580505.399 1635941.383 5236742.134 5489841.152 4780738.472 2219246.103 3218228.976 7991507.87 5266240.176
Hexaric acid 12821282.69 64223670.1 54279968.88 58510612.45 55894537.61 201052434.7 35006875.16 58934995.11 44846443.76 118271933.2 257067805.4 254576714.8 69018405.91 104995942.3 72915499.3 96672110.33 146035334.7 251450659.1 50414599.02 77503116.13 58557240.75 207256053.3 158860543.5 181324417.2 48389418.94 60700078.84 74579444.94 63706518.26 145851634.8 246137835.3 40501850.64 50025830.54 109452188.1 48831077.76 63920093.69 166362600.2 84484325.22 7942460.978 13201935.49 54206870.39 42744291.87 102238324.2 161424012.7 38836978.54 10402720.21 64082400.47 201990801.7 214971127 61096723.81 90241779.06 122388946.7 82779952.59 144221562.8 45222554.27 89881134.9 74495022.81 103715199.3 132922504.8 49447959.58 64092065.67 100359948.4 53678395.38 61685077.9 53808649.89 92747216.01 80969488.37 17371749.82 27105182.02 57386939.92 35499454.41 36596864.02 22629415.74 22954952.56 16451685.4 26439469.82 14845870.03 19990302.54 26301427.38 18699765.67 7927565.125 13968533.06 38523117.31 44291227.56 45161668.25 40982023.56 25418232.08 26819870.38 34327252.5 3820966.374 27532887 21871610.82 46763100.07 10638341.81 14464250.91 22325488.17 20545600.87
hexobarbital 246942.9129 251770.3477 265594.4434 231081.1406 378995.2825 322614.0971 196902.6761 255361.6978 233345.294 211451.3475 240740.4182 266594.8932 224329.1652 250022.9062 237631.5553 222211.3343 288102.8704 345892.1321 274566.3954 351633.7849 314899.4315 342347.88 366509.3762 444767.7655 1769263.163 286862.9592 4433500.263 2149006.52 4681158.098 3180676.397 2413439.47 318457.1343 347137.5231 970807.1323 607829.3225 3124551.335 251152.0935 241761.2723 261542.8641 384736.8733 298053.9456 221088.3234 231738.623 202909.2411 164793.3959 238944.5096 261208.2213 506833.9947 293251.1674 260120.0897 337383.1347 331164.8021 290773.1533 273926.6637 405608.2408 347660.824 287779.4008 2257109.672 2713957.587 452544.6506 372847.6916 324144.6219 1041401.101 738491.7057 789450.9301 379353.7964 332686.0994 291524.7106 430273.2006 348248.6663 373083.1717 332203.9946 362677.176 266752.4563 286528.9489 327908.6923 392529.3166 398001.9468 423252.5104 540504.1388 399933.3853 351183.474 505537.4347 546636.883 383576.2586 406460.0513 395725.1387 16457910.25 154006.8607 17892677.49 501363.621 812518.4754 1968627.634 6062854.62 15850465.89 8991168.751
Hexose 6238444510 5206752690 3828266185 3503991643 4266560553 2031318896 6442683378 4585503393 2729874194 2863173541 3887114944 1427379795 5742144935 3717856403 1911871527 1709140218 3164907655 867480405 5069314005 2721541459 795036133.5 1022348237 2093220236 268010336.7 4010974620 2526206498 455665776.6 383859649.7 1544645022 170359690.3 3687674208 1840504527 357694958.7 80817537.77 407190917.7 97493774.71 4587583640 4645005171 4407000166 4334555108 4060608282 4881891078 5579873443 3537372476 1667903835 2849072770 4577193634 4475918882 3275992987 3568811617 2344091962 2572784533 3178688418 1652547038 2989338617 1797933235 2186905708 2933167771 1577163069 2291127958 1134894982 1157229250 1376259174 1003146301 1685835723 133758679.4 2785493868 3076985579 3571907671 4073136974 3438115153 88424564.42 78902936.94 157292554 69200349.68 58220381.73 103315800.7 86547536.98 131574262.5 46875759.95 103999815.1 120999938.6 130007165.3 154081704.4 114161482.2 105497763.6 106062900.7 144861255.1 20427505.46 93934988.03 129447722 118028885.3 42389458.45 146351101.2 141432069.9 154941011.3
Hexylresorcinol 3077200.368 1859608.947 3089957.42 1549786.373 2162070.838 3636574.44 2199787.739 2273869.476 3058817.075 3195086.36 2476002.041 2810427.939 2022658.034 2105822.486 2134104.966 2566293.072 1996038.875 2708506.854 2884398.398 2738558.378 3017660.137 2718530.181 1699632.089 1155693.101 4324464.319 2654877.57 3187742.85 4111991.164 2893286.369 2479370.308 8287880.954 4573354.471 4094659.023 4660294.347 4141313.484 4193897.694 1772407.221 886257.6414 2002230.352 1793036.482 2792503.031 1756664.745 4213979.781 1592778.906 824899.4402 2317086.954 1387679.628 2459321.983 2346385.81 1868614.719 2024314.48 2375202.75 2608414.643 1890687.815 3588965.291 2983161.574 3593318.939 2681676.231 3197849.498 2814397.379 2730141.621 7742299.454 3371379.338 6588383.603 4039060.953 2518426.59 2841252.761 2401432.755 2466035.466 1669766.619 2008586.085 1271600.846 2310898.869 1968664.161 2562539.228 1830913.028 3236562.375 1391710.108 3494128.149 1843821.942 2124368.646 3259479.428 2960670.777 4743466.664 3799836.555 3465757.596 3319964.894 3074260.685 950943.1573 2289245.825 3689485.595 3069570.004 1197280.258 3830937.207 4042882.066 3933544.854
HIAA 6103212.98 15387343.26 8316962.312 9074276.877 20737388.4 37546158.65 6029371.496 15331891.08 6717937.023 9457924.871 29225901.67 36267218.65 9736018.552 15062652.03 8439761.251 10254774.3 29979746.63 54174948.15 8145496.448 14096848.45 9035850.563 15521598.58 33090525.01 42106391.28 10810450.72 11680884.92 6938533.856 12225008.4 24160847.1 38581346.54 9192854.754 16089665.44 8440900.891 15208737.39 19436174.87 63748437.99 10714871.48 13016775.66 10359548.77 16027052.96 21703845.16 11037811.68 18700924.73 10948517.21 6039317.738 18163953.27 12182949.81 17806141.62 11007207.56 18036035.06 23816870.64 9852004.609 14385464.81 8898052.722 19223046.63 19735462.88 14922361.41 20669904.41 8767827.14 18887000.15 24729706.43 9742335.809 13222291.85 11260647.9 19710790.25 17730239.27 16649692.94 19869140.87 19290897.73 21207856.13 20744230.92 21053070.26 21064027.2 17043516.88 21005815.18 12831821.45 20366529.6 27194531.18 19843466.51 15674258.59 12878597.94 27382082.96 21535191.65 17278832.67 21969694.15 11122815.13 18176831.38 23137149.96 1337981.68 24392887.06 13804621.11 21331473.11 8478215.509 14770129.81 20162291.42 17880228.83
Hippuric acid 30993878.8 186312253.9 198699307.7 89468207.75 52766231.2 80693470.18 29773357.58 159708047.7 180934740.7 94187591.95 83420190.82 90451738.13 42941014.59 186013621.5 190617147.4 72942668.87 80670948.34 111493782.9 36947027.8 176924450.5 215474359.7 127902827.1 78398863.89 100265945.2 36350343.04 144689796.3 174932914.6 84261321.32 62360340.32 86540212.1 33171986.08 151417979.7 184939888.4 89943397.29 48789214.43 103506394.9 373612760.5 107535192.9 137169886.8 327130801.6 311762598.2 375781378.8 224646827.7 129321939.3 60703182.04 264241858.1 441174548.2 236340044.7 150266388.4 388482809.7 321036791.9 326091366.7 189284795.3 122898104.5 383028094.6 271762937.9 366300802.5 185008908.1 124246763.1 313242561.2 280144250.9 288144162.7 101278810.4 127627559.4 312435658.7 275987298.8 197683659.7 166092747.5 185233193.9 549861894.7 275044961 212542609.9 174464468.9 136425980.9 705604973.9 243866231.3 191988829.4 209190481.1 158050606.5 271342070.2 255663374.2 173605437.3 170678405.1 158185491.7 623116036.2 181454411.4 179226661.3 153917380.4 6404974.321 356233735.3 252257166.4 177754633.5 31017735.1 124566964.4 573968488.1 309657750.2
Homovanillic acid sulfate 2626507.723 11040698.04 5758594.86 6662820.077 714773.2606 306328.5973 5731094.892 16405719.66 4801135.414 9168962.775 1259804.598 2057227.756 7678312.2 16104594.58 5143716.744 7128369.641 1425424.183 7929250.236 7489259.028 13999661.75 6470437.231 14912081.71 1490487.624 9581874.836 5829414.333 7576963.857 3115698.825 6518999.078 1378059.342 3188634.771 4714331.079 9313735.602 4804932.694 3952322.235 1016198.618 2147814.933 11312852.01 9796088.256 3944148.859 14810082.87 15901004.1 24645717.5 26595623.79 5752684.075 3141470.508 17040515.96 22393227.36 18366055.61 8805531.756 17900273.84 20950111.4 10596161.07 19333120.05 4499467.102 20739563.39 14300862.02 14073135.17 17911990.4 5877068.619 14739352.34 18831846.3 9571915.342 7652632.937 5627556.757 15530946.34 13040377.89 8534782.959 5559024.047 9169336.885 44158195.39 14703255.14 8599952.881 6477407.963 7258015.904 73004990.3 12753101.35 7269810.368 8432113.242 7367176.575 23299371.24 13769289.01 7999802.823 8050731.985 9319237.671 50507832.12 7015075.529 7276230.269 5404113.842 365580.0504 38650005.59 14643475.8 8818312.562 1118543.258 5821755.085 46551449.64 14056342.97
Hydrolyzed fumonisin B1 1273781107 703884361.5 719838679 813649654.5 738570583.7 986431811.1 1268833349 892945878.7 1532936919 909661212.6 721711056.2 1128290781 1005905348 824925143.3 1080634046 552248256.5 919099625 765565705.8 1020083651 874050265.7 1035150658 845076367.5 1372536992 976154080.1 1344660283 1127136915 1365787155 1143997856 776768888.9 954604198.9 176266731.3 279876099.6 158992756 112494626 462096370.4 145199488.1 925645714.4 498475460.7 1172617128 852818300.1 912076407.1 1496128766 880248320.4 884118145 233034854.4 1003907017 951729352.6 798203458 848734851.1 1038459194 891258273.4 1085657200 793880870.4 800232482.8 756357496.8 790915661.5 1154972213 1690788653 1245276037 867720537.3 1062181400 259447249 155630464.7 291993142.1 128974563.5 152036739.9 891418081.7 1208173161 851888102.1 775495720.5 951301608 1350097102 1284715121 929631360.9 779280620.3 938279878.1 1286905775 1443002780 1283304900 634506906.3 1112579530 1242068539 873057851.4 1043881643 886359252.3 721903952.4 1330582378 1002757331 60404948.85 695413986.1 1251387141 309997546.8 56576157.93 280042142.8 247276171.1 296338874.7
hydroxyacetone phosphate 12809855.81 12926217.95 12889470.88 12743002.04 8564620.093 7152321.709 14577020.51 13781493.05 7036013.924 12915616.03 10157083.5 9286123.838 17109273.76 17461970.4 16874374.91 12143397.1 15932732.12 13828163.55 19401352.16 16228763.86 17188105.06 19873578.73 16303844.35 16116438.67 20942391.32 7251598.252 11811305.37 9649677.834 7727089.238 9994142.861 11631821.35 5152838.017 9030355.835 6711754.774 4802349.742 7133351.952 10430600.75 12529133.02 11854032.31 7286974.356 11140853 18933303.53 17072174.21 17331099.57 12752244.6 17253597.73 30330927.48 19826440.16 21140804.01 30273913.29 6429913.067 39557797.19 31697449.19 26340866.98 35769854.02 22139540.63 21164237.14 21509666.23 14668147.36 22605232 10072159.1 7669944.891 8162040.408 8585619.658 7890610.273 6393472.746 7196434.38 8811843.324 9217725.06 18214732.7 15928777.69 4353541.376 3359810.6 2917413.925 1074476.139 2432512.619 11532748.53 11019397.1 7116883.843 11594751.51 10632928.73 26248483.32 27033588.88 23633343.6 18517817.14 20561942.08 13940687.66 21448473.26 3256209.681 11813023.94 9621680.212 5292029.152 7514606.971 5673684.39 8242618.87 8545899.073
Hydroxyacetylaminofluorene 1970627.714 3850577.428 4404729.338 3165924.034 3866837.488 5140718.317 2827980.274 3086733.581 3417681.688 2384492.112 3710755.574 4113810.169 4236028.35 4128385.319 6126419.006 3556276.394 6901912.903 5647321.001 3283023.929 3731315.025 3667153.158 4342970.156 3216651.512 3553075.102 2773405.897 2871021.947 4225008.241 2989671.211 3405452.218 4395885.354 2775128.809 3756828.156 2636872.148 2687402.755 2329200.764 8517442.879 4914274.955 2859839.639 3213087.368 6052826.132 3708254.292 5555325.534 4548429.113 5522610.207 1582558.514 3662393.907 7766114.499 5245517.261 5405518.342 5986014.641 5039423.78 5419502.2 3024210.934 3403284.509 8618796.843 2996460.078 4782912.165 4363476.64 3411435.694 4977252.687 3816789.658 3880265.566 3213823.014 3449534.924 6079910.408 3605288.855 4040316.779 4328670.122 6510974.097 4210320.677 4780240.051 5422122.367 4985340.146 6683139.946 4757585.178 5972329.497 3738819.934 5190481.138 3905377.504 2181937.523 3174658.353 3585271.252 4179707.373 3989793.574 6060384.102 3018086.891 5250716.604 5933330.498 280690.5564 3028842.303 4025647.088 7521525.171 1544867.092 3844906.726 4289062.966 4094380.952
hydroxycitric acid 51139192.75 64164513.61 62939420.05 61885577.45 48086421.28 66958407.36 59533123.05 48496943.66 57762789.85 89740798.61 59058313.47 78882762.59 48343982.36 50442845.44 56621062.95 41670836.72 36904984.9 66122364.96 38811102.7 31783022.31 42881895.35 39786569.36 32025623.41 51625008.51 25858381.34 23620069.08 31587480.24 24845286.57 26492628.02 31036428.94 14095892.91 35621445.77 11061013.36 7690770.931 10941118.08 10462751.95 56025747.87 22916149.81 39413925.9 25344048.88 45199499.24 68022111.08 58225714.17 29970715.27 3844183.206 32776095.93 58950453.54 43007764.32 33062441.27 42845566.37 43074653.67 33749031.72 36219324.59 28877826.55 25025366.46 22425732.3 40209043.62 38483107.43 19693091.59 20478596.06 21332179.26 19014719.69 6379759.654 16938568.27 21563004.05 19590205.73 41093172.24 42346921.03 45346593.77 35125582.65 36322714.8 33556720.02 34878267.68 34658819.67 39232200.2 31847155.14 19328120.45 23534503.5 21110205.95 10154518.88 21468557.33 5523941.494 3896997.986 10943776.01 8024406.78 4438004.262 6209179.304 3488905.54 477016.2026 3755902.539 7366160.047 11430704.1 1047973.746 5399797.265 9630335.15 10400264.79
Hydroxyhexanoycarnitine 2331637.225 4607538.468 2969036.678 6622110.744 3085967.563 5939363.415 2293067.546 3870870.414 4710956.81 3066624.187 3345305.58 3336726.369 6498875.556 5977628.696 6901639.013 5526169.263 4375392.338 6827529.993 5793975.797 11893768.89 10594352.51 10751186.61 6600889.831 10150485.89 6909273.974 5636185.773 7025624.243 6266776.405 6081683.982 12225447.45 7017493.07 6205027.834 8434389.511 7864637.426 4787623.918 18195320.21 7765313.902 1854835.973 6194383.861 5922962.677 4186556.191 3569333.169 2070543.325 5081950.011 605269.0055 5288156.705 11139401.54 4668440.114 7304132.344 7207941.849 7072398.949 9337220.405 3958962.064 7701719.511 8447879.437 8775650.07 12156598.81 6316051.813 8083499.125 8337032.421 7780567.112 12389873.33 4577781.824 8188225.019 10980371.31 9414459.292 2295157.8 2295756.197 4859232.92 2466020.044 2860244.247 2586387.61 2456236.624 2009898.905 3649860.654 2211782.393 2131781.587 3754595.782 2658859.258 895901.5168 2185375.096 2375630.875 3081155.832 3457836.832 1723874.198 1464939.107 2214495.391 2571276.556 121601.4652 1235836.517 1623742.023 3158307.678 366071.4217 2731599.3 3005108.921 2719659.618
Hypoxanthine 40554242.43 841433475.7 322790873.7 198070229.5 69069036.9 87809907.55 3062565.788 672617516 258057981.1 105575400.4 729250436.5 29815110.58 148483711.8 483389725.2 54626997.24 121166059.7 462721281.3 48002135.26 65887860.58 205062961 29440227.91 259538488.6 293477361.6 272346104.8 926760042 345607583.6 1106869153 1634073008 1838549732 2104883605 920201712.6 903918582.9 1402127524 2257611232 2697548197 4175071254 621421670.1 223082143 514908651.3 384533268.3 541156488.6 59781396.63 2216656.763 123972610.3 73603357.11 178786769.3 11807665.98 5134668.759 29502587.17 4441641.001 8252065.525 11418841.68 3169462.622 4371506.528 4179103.184 13804618.39 7973038.537 483353194.1 533955636.5 12538960.65 10255897.88 274935856.1 541181601.9 540702793.3 191777595 68334959.52 513559296.9 520293102 874421715.4 35542646.73 80913621.29 4930529380 4468802897 4824730306 3032977788 3480269100 4493679620 5070744450 5824321587 2640928493 2994780766 4177176029 3634576942 4553154972 3352470348 1758622460 3484685476 3370171838 486977392.3 2516463682 1114341716 2850898543 999827459.7 2538663589 2037321178 180164641.9
icomucret 106657.3354 114264.5568 74854.78334 108680.5025 120024.5947 142579.8561 107342.412 117023.4458 106421.6451 117684.0557 139784.7423 140832.5927 1079294.938 492730.2269 575368.5749 387497.8584 215128.7532 824457.2073 1268360.799 958314.4846 985842.9676 2524838.643 1873177.927 816528.5974 1456191.831 922288.4283 722770.813 1060205.355 1075104.281 1325423.592 799914.8119 553781.1611 566062.1847 697798.5704 588129.6739 1518548.002 178119.1396 87062.69464 102575.3694 81436.48194 112121.0314 153715.3419 120017.1436 125379.8436 46792.43438 80781.86108 468815.8165 133875.8064 333611.2394 839912.3365 316437.8278 451326.498 608235.0298 250954.5649 962373.1838 483629.8378 950089.6766 794847.4182 561671.201 3864972.765 552962.2713 155856.8831 301031.1366 460814.4239 517305.3058 1109729.569 126911.3493 132208.9438 179744.5404 85440.06218 89418.89118 1279161.626 689418.3677 568527.847 548300.4545 515644.3577 1542074.339 763390.3373 913084.1235 420750.4313 625409.124 1771929.456 1563500.714 2188373.719 1798046.757 621766.9571 2626623.089 1318117.082 37139.97685 942116.885 2802769.904 1489142.253 123853.5942 1292435.48 1194780.152 1535104.589
Icotidine 6398119.39 5769701.923 4485099.359 3824775.065 6072115.69 5608517.749 4650162.108 5461407.673 5761988.564 4175335.794 5518016.212 3438144.179 3436678.648 3546766.816 4161141.895 2696822.465 4727659.965 4230621.611 3675770.731 4760508.96 4617123.529 5351051.52 4504749.121 3723609.01 4336071.03 4543142.193 4753521.737 4286962.521 4283732.901 6706536.916 5875608.827 1811579.246 3871549.885 5522552.614 5577407.286 9749061.278 3760834.893 1983231.699 2704918.726 4726151.691 5530134.736 5381347.744 5070614.946 4492707.427 802504.6607 4739452.399 4313745.21 4753914.416 5113574.677 4726703.018 4439314.616 3833816.141 4338379.889 3477272.111 4345279.967 2338574.372 3348071.163 5201165.408 3153327.943 4069894.432 2230579.794 2058169.276 3464771.049 5427385.09 4513401.586 4460476.479 5101060.779 8305487.178 4218128.184 4453998.867 5668419.01 5870065.4 5181888.867 4447166.709 3681979.757 3353029.195 5660952.091 6476141.809 5742173.482 2164703.487 4597809.956 3428672.484 3619036.152 5802192.505 4737153.782 5014257.279 4170750.249 6465719.704 199186.2659 2197900.518 4217692.609 3495819.64 836743.747 4464244.899 6719286.051 5493152.595
ilomastat 655381.1109 10396134.21 3122286.268 1367058.218 332965.8838 494438.2158 1238033.231 9907616.471 2470727.83 1480779.065 408639.4581 371619.1538 1004844.775 12073011.45 2857568.587 1469265.722 483158.6394 409109.2742 797664.4476 10542583.18 2896386.85 2419645.061 466796.7465 550805.4295 755633.3846 9084135.24 2363144.476 1255594.124 372196.4169 376602.496 642248.9339 8535268.03 2531780.561 1240702.762 288217.2006 511899.6026 4877389.031 3862720.889 6575792.38 12740609.74 5681825.406 6299841.55 8603990.371 6107251.039 2722837.397 4752380.541 7258314.303 8900699.49 6692003.633 17759710.33 5810715.839 5031838.698 6989020.324 5668570.835 17144579.75 5461720.776 5319351.404 6615956.077 5991584.651 12872517.34 5351319.207 3358304.084 3419651.384 6131109.55 11682748.07 5222851.591 884708.765 1327003.971 1151060.136 3793948.212 1830402.2 961611.0133 1332469.196 881480.0018 4822676.39 1496067.684 992426.3929 1639259.478 1090549.669 1878103.401 1839793.863 871111.0503 1344936.407 1064408.711 4366848.525 1213679.34 832930.2761 1061316.768 30310.4729 2306368.499 1537298.393 886325.2538 242552.0426 887055.6049 3870068.907 1964424.676
Iloprost 3080466.203 2441764.046 1902003.495 2647662.639 3305350.969 2142162.268 2059939.389 2186964.146 2446264.792 1757127.894 2730331.346 2209625.498 2489096.511 1644429.459 2877159.053 3396126.821 2979931.239 4278976.625 6272140.665 3317739.949 6623886.855 10368739.3 5446031.564 5570049.664 6362487.941 3456347.667 4924884.1 6501252.459 5175186.598 2750586.68 6397450.636 3730977.153 5274484.011 5417508.005 6957756.754 7000621.519 2119862.217 2439019.785 1544359.984 2230894.158 2650850.718 1762807.065 2154444.515 1925157.757 705831.2597 2233744.497 2786406.647 2661476.491 2579992.045 3250721.474 2466998.307 4382123.218 2697690.315 3045215.45 4471054.074 4788941.486 4245798.931 3160647.727 2935514.425 4999758.898 3615595.855 4491768.256 4486607.671 4493988.056 5526723.212 5576743.293 1596613.361 2635330.485 2506124.34 1853687.021 1537684.764 2173345.685 2572502.316 4975064.767 4367714.682 1948932.698 4330304.944 3183989.736 5332816.653 2388810.787 7077650.335 27088768.68 30275261.99 24830379.58 28835764.22 25866513.14 24301651.16 28885583.97 1383866.694 15373006.73 28688570.04 30100695.47 6215935.423 23641131.9 28541255.48 43053508.54
Indole 13026611.41 24549041.65 23130345.16 17663195.07 19381935.89 33601892.24 15921715.16 23498128.41 18348826.8 20745160.3 28505491.99 32516954.16 22078169.96 24273055.18 28201008.06 16131606.37 27285821.56 38368291.96 19990994.94 26563107.24 28541016.8 29434432.54 24821386.34 35666313.84 20721156.62 20751919.9 20692276.32 19964341.32 27907431.07 31969223.28 22260920.38 25507290.04 22648380.44 21268560.97 19925101.4 48200207.59 26363074.73 14175699.53 27721767.88 32117371.69 34106810.46 25247854.39 30511157.63 26880536.84 5510515.779 32577037.99 27426490.34 26564056.35 26646326.1 33907882.62 38379448.32 19519130.7 22000333.41 22103238.42 35444691.79 34751351.37 27058680.89 26852727.05 24832968.15 26164778.83 38057836.67 21928301.97 15889657.32 32011302.24 33546980.55 31863905.83 41690166.04 39056185.08 50595372.7 39489272.24 51398320.87 42290975.66 44226133.9 46691889.73 48928072.66 50545403.28 34971131.38 50185427.26 54270828.17 20356044.97 39674849.84 31287785.74 55628753.02 49106483.54 46022665.41 29707552.84 44117003.52 39819424.12 2110844.753 26052245.99 49016540.4 40397329.29 8177213.673 38016680.68 46398237.65 50287116.27
Indole-3-acrylic acid 1023780263 1630082325 1641623050 1316792444 1362656722 2363441202 1161395394 1578769809 1573443802 1340456666 1890530475 2577821221 1708566373 1985542967 1797760578 1099959161 1933522746 3032770042 1350254860 1956380921 2142748740 2271985729 1973989328 2765713303 1706542015 1469899633 1812366092 1621096303 1879718395 2654743423 1842528474 1907519937 377541090 1843115588 1765157313 3468842500 1876631549 990975984 1868379790 2086226107 2252723295 1681570143 2156087211 1971704987 370913169.2 2370424557 2003958590 2282410495 2263605778 2443752211 2656231348 1669702842 1740948711 1842536982 585966032.6 2517239834 1938924952 1866949651 515330110.2 2320064310 2465109533 1963160130 1160295064 2227964530 2407515324 2585758140 2562384198 2766271021 3676370687 2559145154 3160214657 3284554117 3256605582 2964296320 3550498952 3534973188 3576540217 3694792857 3749614900 1467417373 3232611614 722261136.2 3026933778 3809015451 848217336.7 2271386260 3177390904 3014773876 148032954.7 1869605053 3296123518 2827448064 618298505.9 2698349021 3239037973 3624520925
Indole-3-lactic acid 41748902.44 33494081.75 43117727.61 59541655.07 46300097.42 86460228.17 67247047.69 33180429.42 42495576.8 90389648.58 102143095.2 135181570.5 95325859.13 47784231.18 57065567.71 73888402.45 104618439.2 146345410.7 72811143.61 47034304.94 65075962.76 107096944 112539562.3 146345782.1 57420017.85 41505096.37 58288781.13 55236574.41 96423314.6 120860255.9 48611508.73 42231931.87 57819473.52 44144773 59368774.43 112308532.7 25543646.61 19693044.64 24415086.4 38296169.66 32656850.19 45654474.44 56676895.91 25777496.22 9527666.553 33686249.7 49828796.74 57264978.94 29194314.47 62002820.21 45231970.21 45527681.7 53536219.16 30122893.8 73189285.11 50244270.02 58413082.92 48483644.02 34281447.15 76392256 71782784.21 45200803.39 27352791.14 34597825.3 70217254.17 80563156.78 19958976.73 19860153.34 22984930.25 23941878.26 28661748.97 35299526.97 39895443.35 25118964.11 57279593.51 46514542.17 37001546.66 51663193.94 33536935.66 40349284.64 54411382.06 37791408.97 45829674.78 39587420.62 91261818.76 38497098.55 42000971.5 46071774.79 1976122.698 57866418.87 62464895.74 44423598.92 10693734.99 36692671.96 89546745.16 73512942.68
Indole-3-pyrubate 3421109.295 3091700.878 7436237.412 4226947.675 11301316.38 16130978.57 8104684.051 2884527.157 6577342.356 8660017.639 35972151.06 39698058.54 1639338.625 1433325.975 5027546.403 2945668.467 27818675.27 34363312.25 353973.0104 379022.7331 1677619.53 1649454.291 20372585.36 26293495.09 405252.849 367295.5987 564766.0894 406792.4764 8872632.78 11249912.92 475183.6196 380936.49 405312.7707 385141.9849 818850.361 1634602.649 2368193.031 2290381.972 2195565.424 6549375.15 4445646.279 8186374.028 12075282.33 2472656.683 1751699.453 4818375.7 6529269.269 8167771.974 2108448.388 10624436.11 5059558.825 3741140.466 6828263.192 1719277.693 9741678.579 6373821.696 1694789.686 3877005.489 1059041.773 4383481.583 817662.1565 434756.3839 354455.741 437843.0585 940094.7113 951652.0333 7578794.207 7864593.393 5847275.596 11592065.37 10824117.54 6383722.287 5298776.663 6134171.446 10432473.14 5238299.377 10021862.46 7072969.532 9070793.524 4073362.481 12095732.77 12844755.05 7304468.707 12377041.16 15257160.01 11476790.99 6191976.182 2978993.505 648918.8181 2535867.807 12369235.44 2449349.284 291565.7481 2881005.04 2720653.28 3442490.609
Inosine-5'-monophosphate (IMP) 14209328.37 5228713.674 3731298.13 4852272.673 3336119.628 3800169.701 8873536.769 5027571.455 3669042.323 2721797.699 2535635.738 2540840.714 10528288.51 4224076.793 3218921.927 2926154.979 3737205.069 3363996.957 11788833 6305561.246 5001760.146 5149810.776 3503946.368 4433609.015 150503265.5 65219149.59 105862635.3 285513780.9 82321301.25 211019880.1 201422774 200004618.9 257561692 338075909.1 135682935.8 479491162.1 5009904.349 2727767.19 4365822.601 5596131.136 5209950.675 2913012.049 3279819.22 2988455.205 1599573.295 3883227.489 2851476.721 3174557.939 2958987.559 3231362.774 3465072.7 3770515.777 4099732.775 4778338.93 3820304.888 5280250.211 4175502.278 88064244.14 128547741.6 6384637.06 8697165.969 180165937.6 172321789.1 235232487.3 200277838 67402754.8 128336458.7 113006727.5 150990784.1 24390911.57 65904224 80636642.26 63259330.57 60426455.79 9346616.605 15827132.56 69019721.31 62030565.63 38327651.4 4061897.532 42684451.24 37215088.37 42324893.62 43369066.74 13870563.08 10990064.56 27928685.74 29763778.78 800048.1463 4685223.565 22420584.74 35317123.9 1161290.661 23000683.02 6741965.389 13717832.33
IpA 7733938.798 5853122.996 7949427.069 6666741.444 6140456.888 8387904.376 10081143.61 11372286.34 7328922.183 9789956.861 13175174.23 13927225.67 17425275.75 5228914.896 8812944.417 6673183.612 14863722.85 10539509.41 9925517.332 6631378.234 9362457.383 12385366.1 9484223.407 13465226.08 10605868.35 6201719.737 6850087.538 7130676.325 8634337.194 10772731.13 7553708.474 4683610.965 7707243.069 4895462.431 5348573.064 8981802.464 17954361.69 4768431.076 7913460.392 10895352.52 7865953.601 23732230.25 12359896.14 8569932.956 2604296.161 7123915.531 27033729.84 11999703.14 8034024.88 15839541.39 8715096.831 16961136.25 8598118.564 5885665.696 12247065.65 9352885.004 20186578.66 9409442.901 7611442.921 10873764.72 8962150.622 14490932.55 4279894.455 5622127.928 7679416.699 8264840.94 9155417.218 9233155.47 20002889.95 10307568.38 11959459.51 13445660.3 7211865.605 15022124.15 11874725.95 11078825.79 14532152.76 11951650.65 11691502.68 5468720.704 8738298.837 10059780.34 8203621.939 17191598.3 11605500.02 6111259.621 9917219.207 8212193.595 744851.9237 7638341.262 13255863.82 9397903.498 1659014.574 11978810.71 10754186.55 11657325.8
isopropylmalic acid 435535.1814 2057074.825 1862174.527 827483.2294 94701.23099 684301.742 576728.0888 2130600.306 1579842.076 1155963.066 430026.6692 762835.5886 537587.7152 2564598.324 1701007.216 668797.0377 328732.4742 860523.366 410963.2637 2085248.905 1719395.505 1461455.701 517246.5682 748680.4408 377650.1504 1875286.682 1332354.603 927540.8583 289327.3322 660282.9761 420336.6311 1655700.269 1118711.157 786547.2173 135843.3716 777531.5623 1061186.394 475943.2698 552876.0115 2810460.059 1335728.679 1282115.459 839516.1577 601429.8795 396616.062 974848.5935 1520014.725 1233309.706 699390.7119 3457094.927 1168907.413 996412.5891 870716.6421 486637.9615 3761990.023 998164.1098 1189904.938 1045919.998 503162.5711 2455799.4 1024897.236 708901.3734 428794.1999 650388.9317 2162303.618 985921.9013 962135.8477 910026.5613 1278542.44 4608601.796 2204581.508 1249714.856 926905.7556 892993.0587 5778985.531 2196902.816 889754.0566 1123116.122 1142798.174 2138302.197 1897108.429 816225.062 855054.0489 1181245.15 6384511.638 2016536.614 742961.0372 1128568.341 55467.47157 3405613.23 1787078.032 1308772.887 197639.6385 1034432.753 4826785.84 2124152.782
Isovitexin 319744.3579 1903058.313 2051323.857 1326811.446 161160.0821 714892.446 645882.9922 1652222.431 1985594.41 2084942.03 552645.3388 1033800.474 785880.4301 2055226.734 1750998.052 1665104.834 424937.6524 1085847.805 616312.7232 1615209.587 1959859.353 2346349.743 272504.2734 949708.0475 467852.269 1358914.485 1514676.979 1221237.722 329090.6774 817895.6118 402811.2188 1282130.992 1460701.1 939137.7648 172402.5147 659448.2557 3093555.859 1562057.86 3270470.205 5104093.363 1914304.389 5161719.039 5132457.822 3256581.636 1273662.067 1667365.594 4723789.178 4423937.667 3584170.804 8571091.436 2022460.068 3022070.058 3372035.747 2640651.682 7390231.798 1431409.517 2969493.961 3127047.532 2846487.748 5540512.896 1655757.697 1679037.951 1115917.973 2659627.57 3934737.697 1818657.442 883911.0137 992234.9195 1232278.604 3838747.543 2767891.614 954122.3894 937304.6203 1000761.912 4469242.877 1942213.243 848240.636 1224849.229 1143281.613 1639326.849 2060500.196 777185.7948 804915.9613 979367.8699 3722804.558 1380250.893 747032.7295 860881.7182 33726.10441 2326357.868 2009264.98 743991.7426 239997.0517 989828.8016 3431719.845 2232086.361
Kinoprene 4006969.572 4001554.169 1890417.301 3841210.146 1991345.439 2675870.184 5190414.557 6983163.704 4526129.31 5962280.798 6898409.465 4871436.259 26952948.6 27910565.49 12190095.57 14454435.96 11216645.47 9841630.506 53859400.01 41706177.16 27834020.55 51948842.55 33767237.88 15719735.43 48885765.79 36682650.51 27274015.04 33302311.72 36350544.47 14931076.4 58748765.6 60155342.34 31817822.33 32564946.82 31210185.16 20612744.94 3674387.155 1287016.322 2770716.601 1584377.342 1845415.702 6813467.633 2510142.272 2608423.045 2102141.835 6072293.62 13781975.53 5618050.209 4884178.312 18310241.28 13358903.3 23250385.38 10678549.63 10617197.04 35084244.35 26373922.31 20479025.09 11457262.39 11199875 31361393.48 32531671.1 22466855.47 8558007.496 12558392.22 23936593.23 29097494.94 1903393.916 1217745.231 2175016.693 1359745.791 1487963.831 7359849.425 8053061.669 5668480.361 3446218.783 4031436.183 12130756.97 7204266.347 7101354.013 3752545.532 8596181.884 13107821.75 17401000.21 17575129.57 11525272.69 7946440.187 11478692.13 10614228.85 1200693.286 8350420.465 11552510.06 12600121.44 3311505.933 10044482.68 13536487.13 12861759.21
Kynurenine 5434671.819 18788323.6 10079202.34 11176947.98 24338143.5 42860247.05 7763854.83 16470908.9 9807275.595 10442278.24 32920372.99 56740239.47 10992673.05 15343220.27 10588955.79 5352783.374 27963671.55 23329728.94 7509597.626 14466212.47 6601731.785 15881793.33 18691440.58 42051039.81 8938779.946 2709461.776 5889293.67 11900822.26 26084345.83 41526111.98 8734243.017 11183710.31 8409965.77 6970917.598 19512903.34 32331106.86 15642654.48 5952557.305 14832750.51 20622696.19 34791497.14 13913325.14 22935680.8 10676321.47 399035.322 28499395.35 13868788.84 23476031.86 11945528.13 21078535.19 10774367.44 11238194.76 12492487.66 13234164.26 21168205.09 28731883.08 7780091.022 9175948.971 9223151.341 11171625.07 13142285.96 10271275.9 5136160.067 11667128.25 15374777.36 19414059.89 24546335.41 23890025.79 15650702.71 17511819.13 18415361.41 26866817.61 20567635.04 19996751.22 27894667.06 18884969.7 23239159.18 25302498.54 16995468.62 4938725.247 20538703.99 17174785.56 20290347.45 24538486.39 18226409.48 8032545.27 21638391.52 16325382.08 430952.0409 1127036.561 14961897.58 14371702.07 423966.5202 11027671.66 16900306.26 11052663.1
Kyotorphin 52962729.76 14038991.63 35824960.95 24813960.17 33601859.78 29470203.93 16264513.25 28333712.45 25766449.78 27274616.38 39203653.03 12674450.86 27365685.73 14945931.39 30370940.82 13681657.36 38334064.36 30758807.14 35659551.73 13125280.33 27920515.49 45813862.34 40400535.31 42325963.28 36474628.1 45036819.85 43086708.64 34350057.09 40292703.9 36992616.36 20592416.08 32685950.89 49586423.16 30256170.74 32068461.09 35711717.32 25025891.88 7847443.602 17535932.78 13275024.46 40144728.46 11691089.56 11236461.98 15979218.58 6909885.307 44238892.75 32039077.22 17541620.23 48129049.04 33854463.03 35190191.51 23696577.58 34645301.13 32190393.81 16868246.78 15560845.91 15884274.29 37832440.87 21424059.23 30202577.55 34611947.02 24531793.69 32385704.09 31577798.51 37352330.89 41916457.95 26805651.53 29959967.13 31643227.55 31508766.93 21975658.92 40370947.91 25357556.95 44439543.57 17335738.57 34521533.58 26138721.25 27863923.98 36276708.54 14404383.95 29899649.44 28748711.2 17176157.81 26348380.03 59855613.12 30793126.03 19801632.94 50429560.73 2095683.81 23373500.08 40632264.88 46324274.58 10057490.53 29591967.39 30531279.21 41908906.02
L-(-)-Asparagine 88036061.94 84139171.12 64466548.43 45330621.1 70745534.05 45059286.37 55108829.3 49810385.87 37019529.85 45369100.97 54081263.1 25015887.54 6941574.91 47351991.28 31163784.18 21655497.86 25031137.13 26842523.88 33525894.15 28877879.28 26273975.62 23721802.36 16936362.1 19118343.18 25041736.63 36045128.51 23198864.63 18161599.92 19345230.63 16976118.77 31588310.64 35265839.54 21392548.72 19060857.78 12990715.79 16462405.13 58583909.54 73042519.99 53381564.83 70658382.7 52515905.79 41168143.25 9173681.22 34111670.5 49931416.44 42572942.96 32209040.45 6812436.205 30343707.72 10212447.94 29559012.06 27613257.5 35999541.53 21706162.05 32344925.26 24811005.1 28087776.88 26593376.47 17792430.67 24148708.83 27034009.77 25153314.34 10990160.82 14895009.66 17087566.84 25630915.14 34433441.3 11009628.44 11635865.71 30658097.81 41834117.95 11525948.67 6795967.993 21403825.62 16179620.75 13410895.86 12013501.87 17323986.62 22871619.32 10404351.37 15625328.29 11122266.51 17076204.81 9189604.931 9216625.477 9449083.492 19411451.95 8552815.312 34574483.42 6045895.202 9509184.722 11285947.63 22557952.88 13739711.72 16683584.46 12832595.09
L-(-)-Methionine 610039129.5 750536901.5 808249389.2 600842286 271595837.4 371495875.9 181796259.4 743043712.8 813698076.8 658929353 461870032.4 418875656.4 939150510.7 885186727.9 232077990.9 688574242.7 585968862.9 590331608.6 260570794.6 1143537285 1104532343 1142077430 649535206.1 693391902 255397951.3 910341961.7 1064864335 850621528.2 601032818.8 707130849.4 1023179090 992004387.6 1064203670 999934510 624849507.2 1060054525 629290683.9 1045061582 678249374.9 1204208504 1308921557 702740452.1 1463209997 731596002 439904713.9 1641515893 959890101.4 1922250518 942276407.6 1583275546 1836577377 798666402.5 1446551714 918369810.1 1814428206 1663175279 952704241.5 1602295978 784137729.6 1540743327 1732443175 800588678.3 1237357436 1080651265 1712609128 1947572521 661750740.9 832027683.6 1203489123 605196885.3 990081478.4 954555136.8 1083519918 966350179.8 883697932.6 922602682.9 181348557.8 1167745379 1301742003 422459400.3 1013435843 980308250.8 1273515829 1434142568 875489024.6 1026192708 251319111.5 1315049650 150937568.7 768287229.8 401117845.1 1071831080 471959243.6 1102729320 997448138.3 1284316743
L-(-)-Serine 133422815.5 188859128.3 167349479.7 122253806 114175521.7 157827123.7 135513846.8 182210362.3 138294789.7 132550100.6 139581619.4 122352860.6 105602397.6 138490270.6 104058271.2 73235427.64 83921854.89 90394637.08 77547086.89 114396481.1 90173402.53 58754991.04 59528116.92 50907964.24 77689641.04 106367769.4 80057527.59 64082164.93 72311474.5 51035144.73 73807375.05 109340055.2 111369352.2 71587093.6 75921062.63 80268370.28 171106333.4 181545756.9 176114766.1 175587405.6 181459092.1 158157715 243983764.8 153072165.6 366795775.1 165133179.9 126150572 220824871.3 147792823.8 129171629.6 162293397.6 60754942.24 169108819.7 107240039.9 105561487.2 131488686.9 68208683.91 179367070.6 117872355.7 93916159.17 122576591.5 54023270.35 154329424.6 129940430.2 79501451.44 128818055.6 152942440 164391838.7 194834261.5 159086927.8 156161797.3 69122451.6 89251993.15 79955643.99 44283583.71 48846936.88 62369932.45 97665156.29 73189136.72 59969304.97 50556793.7 60908071.16 72789282.53 76705675.83 44945927.87 47466345.09 57676239.42 88903038.2 112318833.4 52102713.74 42212950.6 52706445.16 194349229.2 64725858.34 42810489.74 47826577.53
L-(-)-Threonine 30010158.5 44694642.28 41859530.73 22631881.31 26131551.56 16113957.19 29171766.5 40575228.38 51019601.69 31440825.98 38412446.65 36211874.39 37724052.73 54633283.94 56071992.04 31426916.94 39540754.25 39584250.18 38334512.81 56524501.11 58758532.68 41074711.69 48751004.51 48043979.63 46908291.91 56310192.21 58733777.94 45980017.67 48414927.83 47361263.69 46810345.75 60045151.47 61611079.61 53804890.34 51004348.78 61911316.8 32667314.17 63724377.55 37618622.73 49546819.21 66703097.9 37480246.25 78687224.68 46238480.15 117684823.8 70590146.04 48142269.96 83633742.42 50433947.68 62613362.39 76931317.77 42147860.48 74460965.34 51839787.58 62500028.75 91129139.79 47170637.16 81834915.01 50667612.56 66167880.33 91759792.82 60691475.86 71399566.79 64004151 75888683.33 94409205.57 46334874.62 49429392.99 74622115.46 42105447.97 54140028.39 71288108.88 55505552.36 81389631.85 51628808.45 56791886.99 59428384.57 66915626.26 75565453.4 84450836.86 66773692.61 70003044.75 78602756.01 88244239.9 56921693.67 73477844.73 64774479.11 72429629.81 86171179.01 75861134.57 78798718.32 59998226.92 146038883.2 81419695.97 68685393.17 84455280.3
L-(+)-ERGOTHIONEINE 119961562.4 154256331.1 112810596.4 100339458.6 110408564.3 122087005.9 81293570.68 158977628.5 142756785.7 65653155.09 38251853.72 63656462.9 122107763.8 141231329.8 168888495.6 94344468.81 67985759.47 96180306.7 133871088.2 177798963.3 222481591.2 139776783.2 94334318.87 133667621.1 155197759.9 178885795.5 189642741.3 160571578.4 180553413.9 199902647.1 188259488.6 161401349.5 194979135.7 163143166.8 183043173.8 284279240.6 91944884.87 74307875.33 106332439.9 136578810.3 70332407.23 15220855.17 66123467.06 73589533.41 37261717.02 91225438.22 73255381.56 110319598.6 86404232.2 76768947.51 126783706.4 67010165.95 104005961.1 79281789.2 79531958.14 141232542.8 76032861.83 126086473.5 83488524.12 90425545.85 110268050.3 113066652.3 140733394.2 92762907.97 136538604.9 139386796.2 68407943.86 61861964.52 64169099.3 68033162.76 59983463.12 56499326.26 65934101.71 47399640.8 63851181.53 71739747.95 67865994.91 79970618.51 64336872.77 40479077.73 93816710.52 97153136.62 129037515.1 85208033.69 130942945.5 110823125.2 98850772.87 94569478.71 629107.3425 112161863 141159508.6 129438670.5 80135396.02 110405768.7 114700588.2 193434402.5
L-(+)-Lactic acid 246664684.6 391981407.6 452495120.9 280651811.7 358626790.9 420402020.2 419216408.6 565590606.7 614477129.7 605989237.4 549069151.9 508419784.8 784732000.1 810805933.3 776245916.1 637426006.9 879073504.6 851042408.1 1069972743 1154565481 1313690564 1458421427 1067775424 859216755 1142973492 889195417.7 994050007.7 845109651.8 1062942147 770538967 1171700112 1166043628 1206221573 895364089 797164805 1147358922 900635011.8 253211729.5 237694826 711298282.8 484443837.3 938601738.4 564618416.2 323958436.5 308710837.8 565023722.3 1144106270 601355255.7 574052007.4 1075807632 801884662.7 1300819974 859500123.9 706330722.5 1371066144 1060851353 1246508999 886666726.3 797761082.8 1224685941 1185560625 1312925659 646731410.2 722776952.3 1644896689 1219007349 642345333.9 663744727.4 597157565 281769961.7 557847240.1 1253675028 1293331320 754059267.7 808532889.2 762116984.3 1207572706 1885923755 1198194963 252984773.3 1138235995 1093459209 1564483107 1196705043 1043780198 812662061.1 1045448563 1366958018 173295803.5 162588715.4 993463312.7 1528307901 197013074.5 1076033060 1089161136 1344157373
L-(+)-Valine 130201665.3 710470910.6 878898103.9 778271633.3 153743417 736313192.5 117378022.5 741974296.8 809247259.6 675032551.9 697325466.7 604545171.2 735814937.5 709408195.1 901598688.6 717875288.6 639754506.4 626189839.4 678710529.9 755932826.1 999889006 875347358.3 700814119.4 761145617.9 783168148.5 694022272.5 897201737.5 808344003.3 791441166.4 811544539.5 832539723.3 772097493.2 898580218.5 845900152.2 751902666 1120959909 169992475.6 262290631.6 891494063.7 951663719.3 1248163854 707434270.2 1214146831 839471592.4 317890404.2 1004684614 836774827.9 1269376823 947602725.5 937193620 1070138220 670429209.6 1063913829 734615080.6 1007914861 1119243842 786197736.8 1138940842 776482296.3 970669259.3 1073444624 823644121.2 1043671750 827087850.5 1165242725 1084091626 704829223.1 700268980.7 902687127.5 551847052.9 805812253.1 794973254.1 873595179.6 862500319.9 710269374.5 779254608.6 772981481.5 862534174.1 909113138.6 606210040.6 770892313.4 797165239.3 853621239.1 905595241.4 641779703.4 660467096.2 782482761 799001796.8 172602994.6 570361076.3 773749110.2 772239733.7 311478672.3 846664840.2 657644133.3 871229499.1
Labdanolic acid 68945.36866 183365.3176 118653.3992 141111.8636 118486.5699 140337.2216 599013.3736 720876.0331 874650.0559 1040096.298 895601.8539 703496.4334 4390916.439 3443733.51 2849395.54 3878799.452 3528000.092 2983763.161 7892154.031 6908924.77 5874598.735 10994502.86 7331231.521 5666961.574 15787955.38 6569007.902 7223054.517 9267507.537 7705697.706 5658458.782 23271787.32 10017050.12 10117080.06 14559288.07 8416914.352 9867784.263 389327.4892 54696.92293 64404.23259 155809.8262 112201.4254 808010.2044 270477.5509 316369.6776 163759.4717 620419.8249 2389912.504 746740.7883 1016177.109 3488737.637 2311853.382 4920699.097 1695237.122 2030192.7 5835177.134 3618652.227 5647884.892 2894844.936 5110351.466 5604706.781 5005333.42 10885940.26 4660745.137 9223068.659 5205546.512 4856680.74 266026.1544 318868.1754 359457.7123 187073.6393 122381.6375 1257687.469 997373.0152 1226733.345 822760.3013 873770.3685 2213511.823 2348236.676 2794560.971 1091298.454 1856715.578 3003398.629 3075569.581 4112239.093 2717437.989 1935966.138 2596390.759 2625599.74 148548.6194 1940563.925 2911851.874 3092012.353 792242.8587 3632313.736 2997833.02 3548962.276
Lactamide 24013767.79 34632694.52 41791324.69 18908649.44 15783012.48 21224408.85 25852007.61 49906807.48 29837511.41 16715977.3 17352612.87 23263678.72 33374743.27 34478422.19 55831574.43 26603704.36 17344594.95 22885857.71 25141765.06 50292004 45376028.11 37240494.4 23152365.51 60588774.65 31198672.83 54944983.82 59379249.18 52868803.77 40000596.77 65295179.63 51689907.5 82089560.63 87589847.55 67075879.1 85582694.63 99565357.65 27941006.41 47419532.83 40491976.16 35822453.24 50167857.93 39943530.37 33380895.96 40002046.4 86046264.19 71802239.95 38998940.34 67107428.08 45449602.14 61535333.52 89088851.78 47751150.28 67321405.48 16847968.6 57546333.37 56636235.86 68032504.34 51164881.77 54108057.09 59342092.71 89169647.14 84950090.47 61317898.3 70186762.8 74245744.06 158201937.2 28863879.68 41493038.8 55752683.7 36430631.86 39843428.69 52494153.53 69656486.14 74748946.84 43244625.07 33864357.57 52613458.3 51382654.18 78647435.03 54495206.54 48499346.55 80090003.09 68440729.59 90488656.53 84899030.15 83123799.69 114261393.2 85452254.76 107908521.4 71246916.43 108335417.8 129627732.9 234824523.4 141568219.5 80054051.52 131611217.1
L-Alanyl-L-glutamine 11540381.81 20500102.24 8989489.984 26864320.14 2000305.026 4524560.932 12284113.54 16248679.42 6371013.219 21436075.91 4858738.937 4793873.252 21053557.97 18554308.74 8150820.983 22796122.65 4594687.084 7634789.411 19106820.03 21776568.89 10660615.18 47410543.31 4312716.451 7803802.217 16823206.56 15780386.94 8250589.558 21207135.22 4422883.511 6303530.809 14958483.54 16468050.63 8830817.028 19356057.68 3010806.753 6000120.628 24808562.73 8510217.075 4796437.528 14255032.83 20601901.52 23807530.14 16127576.85 4601045.053 3712882.123 15452254.53 31886103.03 17839051.3 5982061.785 19812535.43 20558188.37 21475152.96 16642566.01 4441148.079 18546357.84 15458553.6 28637799.48 17487188.32 3979623.072 16446888.18 17624404.77 18485701.23 9426106.449 5549082.329 18805945.42 17845863.93 5911996.126 6368171.45 6824157.859 17950243.73 10256775.88 4706511.521 4965215.885 2912534.481 25890775.38 7428736.95 3937455.992 6122876.705 4103636.929 9202904.382 7116509.699 4327715.331 5568204.15 5513649.645 20378953 7134273.128 4168038.93 6591869.125 760522.7205 18080222.82 9467353.27 7412956.706 1654631.145 4139728.929 24682947.73 9825806.572
L-alpha-Glycerylphosphorylcholine 53066340.14 64090124.08 37963269.46 56995916.45 58597337.55 36207766.45 50038736.18 39919747.08 38244118.15 48154008.68 42281334.38 23533562 60804167.28 33369911.63 26994183.32 47527755.83 60816493.74 30474947.39 43526329.36 32932498.49 24986219.53 34327260.6 36199281.46 30008890.88 8372522.05 4520055.749 11327777.77 9709651.054 9611801.568 6301202.997 4009567.439 1290075.603 2153120.733 1460274.164 2267488.543 3567951.207 65765024.11 39126565.95 48007260.24 74337495.32 32638504.11 73751844.88 55737509.83 40160245.83 160143378.9 41467805.07 86664205.95 59731831.83 34587492.31 50847649.45 43048074.9 75827222.82 56639013.53 38495772.82 73245090.63 32959824.16 15877089.46 13991105.91 9516530.645 13062562.19 5415106.508 2436527.085 2706816.618 2350006.619 2290909.411 4432651.417 16944579.2 22728695.92 23389830.55 33355961.45 27071452.64 6471731.526 8748069.907 5714575.605 10523714.1 8571406.914 4935762.448 6166739.979 4441856.754 6497846.264 4986993.332 3733725.903 7280032.648 5428267.39 3592706.388 4454753.45 2102976.473 2412296.715 2541861.157 5376848.145 2432274.085 2325006.404 6524034.824 2378624.55 1586108.792 1755689.706
L-Azaserine 1477653.54 6692638.787 3703806.89 3562894.173 1387084.686 3837592.962 2316735.548 8527844.38 8394028.564 3149960.575 1301403.903 2583811.027 4515307.405 10403164.62 11803114.33 3482463.405 1992144.818 3533378.03 8897707.714 18784516.27 18934095.36 7776243.707 8282240.901 6840683.612 18355898.25 18972193.95 22027262.22 14763258.89 16251326.25 15676510.78 25763950.65 27252044.52 25824510.73 25750300.32 23869539.74 27644876.77 5806848.957 2053067.031 2339761.183 1065012.05 2533808.967 1335346.592 1692463.963 5431921.838 2335739.612 11386920.63 5291041.664 2417221.33 9621669.786 8540108.619 13095505.66 13526924.23 4940045.312 12768681.65 7882418.418 17814432.82 18830430.08 12689987.92 15763743.87 11401505.44 23604117.09 21372230.69 22242494.38 27122312.72 17671414.09 23985461.57 2167021.32 2559059.752 1286548.432 922115.3852 1146455.011 2845960.597 3368802.802 1989470.773 3124428.09 3487804.776 7148892.858 7635283.48 2511602.934 3823543.595 7376601.414 15300213.55 18659376.98 9501404.948 12735692.28 20975519.34 17897841.41 28520011.63 1773373.547 14629382.77 25403660.11 18250639.98 14970400.18 18008056.29 27269503.69 37381091.37
leu-asp 9536357.435 32272322.96 59990710.88 19601674.75 11740708.84 16609498.97 12692182.72 27707381.49 35581816.93 20918020.32 16972719.25 20823844.49 19755358.18 36086693.53 37254840.27 19633059.5 17585503.34 19587805.91 14069540.12 32447894.22 38340012.93 27548412.64 15895624.22 17718508.48 10529569.56 22202217.39 30475071.52 15221149.52 11728706.92 14080037.15 8449089.72 29844902.11 43445004.75 12143660.7 6533150.263 17887920.1 30721009.2 19392300.41 12628603.59 27792856.56 32551321.93 43270500.74 25344900.46 13103862.77 9543408.75 21733344.98 42031646.99 26150468.22 15956548.84 38413471.58 34749412.07 25898734.24 30079213.54 8954079.819 45041288.6 21661718.09 29700444.98 20874868.22 10617733.62 29711079.5 24130365.55 34893705.77 19094191.65 11156135.58 35009893.87 69358140.98 16319809.41 20913171.61 28485311.4 16198938.32 22698965.2 21743340.68 37152775.29 19986234.8 18778945.22 21847757.92 32576081.54 29327234.56 44108023.76 30614945.77 23108828.03 34977428.98 29525165.12 63458493.04 33496014.19 18339168.36 31341049.48 23351242.11 3274985.938 36742091.51 26884449.75 25104897.82 6378549.939 37201261.46 29815632.36 19977915.18
Leu-Glu 7597562.325 24225153.47 30610328.19 15305190.03 9476760.787 15407520.12 8848463.455 21002798.58 32022933.36 16969248.89 17688398.85 18360913.71 11903360.67 26643050.19 36187048.7 13145656.39 17454121.71 24050696.87 9289508.017 22507032.22 35326111.77 26145561.62 16841863.93 20898613.19 9071505.219 19134845.31 29794184.34 15125458.92 13350366.75 18065624.32 7639212.666 23814931.99 27690526.69 12855332.24 7515597.717 16316172.97 25561645.93 13975541.26 9851801.644 25666847.92 27463733.34 30392576.89 30857337.49 8494664.653 4981412.945 23848911.41 35415012.75 33019420.9 10985447.14 33272575.57 27304823.53 25205028.44 28568363.84 8091852.235 31455301.33 23518536.08 27105746.06 25543977.24 8908874.523 24443294.39 24501134.35 21798033.08 12283566.38 8061086.825 26681233.49 38164313.37 13818735.28 16714032.21 21588538.95 10946411.58 18193861.43 16743985.28 17896715.61 16382072.05 15523597.34 16558224.84 15609901.62 23156574.68 18873916.45 6532343.584 15537187.55 14196705.31 16336971.21 19395216.31 15085947.12 9898917.86 13886033.62 13616722.88 986359.5226 7857690.152 13402584.41 13907744.88 2731074.745 16087148.21 12520379 14332748.37
Leu-pro 6088907.023 12466242.07 20499819.2 10098253.29 6809302.547 8839270.877 4255937.818 9964493.113 12457480.32 4578175.692 4199960.044 4595544.325 13805267.84 11549444.35 17356623.78 7987964.251 8881668.922 12851243.75 11495498.88 11152784.26 12546366.1 11216433.94 10170596.33 12260222.83 32773160.61 38578718.43 22980838.57 25607992.65 23533832.71 17606846.84 58206243.55 75794741.15 42938849.03 44895013.61 35516866.48 46713942.24 6704316.973 4786620.304 8016885.879 14599111.5 12208006 12461381.91 5986806.538 6979014.049 4540392.818 18401236.39 23651003.35 20834379.28 20159262.67 24517257.56 20772490.63 13399945.78 6097018.686 8320867.22 18208659.94 14871281.34 46796958.5 22295886.2 24950826.84 60014777.43 31883587.12 73229183.8 35134900.15 58096625.18 109580978.3 58766654.52 31425112.82 27992982.53 42343093.23 21579485.25 24754249.58 20677749.46 20046056.83 21568638.33 19714246.14 13731273.63 14127693.34 20071741.99 18346188.21 6194346.65 10420950.76 2552562.22 11230920.47 12106873.19 6921358.693 5784493.172 14000869.59 20309344.28 555810.7604 11972855.44 11024538.51 26403105.75 8327273.134 24009520.41 30594928.82 32235917.43
Levulinic acid 32711230.43 54968016.1 69744620.39 46234912 62448330.35 26024839.52 16813335.3 31983138.23 21784898.21 23559046.62 43426013.68 14531242.24 14431556.07 30110642.09 20855077.49 16541058.83 29396315.33 13381086.25 11824508.68 20217604.89 28448557.55 17784787.16 14215515.27 20409352.42 6009043.092 21088348.17 9733868.432 15337208.11 10919117 8431048.742 9892348.143 21242594 28050977.06 23199160.05 13092592.57 64733238.96 21687036 11520029.09 8877207.215 12472472.94 28009994.89 17633603.5 7389288.3 4810519.876 670570.222 7533989.506 8649851.1 12627163.27 7400010.385 11404023.4 8650115.823 3883177.938 7033366.495 3975260.328 4011457.758 4312425.28 4877591.045 5578521.76 4385162.255 3708125.051 4391950.504 5444950.959 10125615.81 6814187.136 4910540.758 9385464.101 45587347.18 41917371.51 73585821.58 43502910.07 71993482.26 34781746.46 52711050.11 26170552.41 76287424.4 42820929.79 34223906.39 43216388.58 25463381.75 42483411.25 58129905.63 53131171.09 88474237.37 47741031.72 120317328.5 80100677.27 59733828.32 59424240.49 1068068.572 111608216.8 112819056.9 73563939.58 19275976.47 84506575.79 175299771.6 299133657.8
L-gamma-glutamyl phosphate 81061942.87 70664272.63 77239663.57 89688121.08 78387174.45 82491782.63 40654758.15 59771612.07 71916555.68 38022123.45 29318491.14 24299032.92 53406164.44 45133567.93 81998672.47 32746696.74 28922795.08 42695513.79 19336901.61 23689390.67 31557956.37 16278369.06 12675225.45 26796239.52 21920234.75 64093547.63 22054168.19 22190662.62 17567733.37 17969324.45 9279951.087 66159167.77 19313420.03 14287036.83 15377487.77 14219282.51 109048244.3 96209081.28 89069220.49 52527795.86 82875219.2 14005151.06 21325537.4 82931156.66 54735581.94 90915201.22 30969590.76 40544193.6 90778369.78 41677167.88 83052215.7 19479241.57 13339539.95 54444191.13 27131883.94 34550811 85720660.4 28937653.7 32803377.66 76386453.14 67770264.89 81913737.47 27188593.41 23697849.96 22279514.36 19048144.85 151735179.2 145436786.9 164820319.7 104326232.4 83830903.4 38237256.93 45416455.95 62904816.32 128878493 69337647.91 11964328.02 15853887.06 17383128.2 3318970.908 12184119.02 21318419.61 18470907.82 16282238.54 22884479.32 14049012.94 15922293.96 23839609.08 1510524.829 5217628.366 15990654.07 20743835.63 3552242.396 21607228.17 26187848.22 17913265.61
L-gamma-Glutamyl-L-leucine 33515620.96 95145107.1 188978487.3 62180612.42 47996318.29 54720131.17 33390501.51 85979984.97 160861400.8 57756730.17 63967038.68 48438653.56 48433322.62 100402181.6 178274221.2 51129391.35 68572831.44 65359291.79 43300226.42 93082130.06 196250076.5 98117302.32 70441547.53 67061296.86 42341199.38 75098282.44 165705525 64423213.29 65576816.94 62837254.73 38628745.14 83486746.78 149466270.6 61259863.86 46205506.72 73770401.34 109415476.4 43585873.84 37341670.92 95524762.7 90925047.29 113426265.7 84684774.49 33362851.24 17726125.6 79016306.93 129270400.1 93555306.49 40439238.13 112460832.8 95056679.95 76018205.53 77288553 34739132.59 101629762.9 81452329.35 101559696.3 75380255.38 34208387.27 76478990.11 84029871.76 80632239.38 40816231.91 36648770.33 79897599.39 113505541 73214369.48 81655773.82 109377572.9 56531350.03 82756519.89 83333142.48 86690779.29 90159800.98 70150187.1 72242951.9 83638626.73 112419236.3 106297830.3 34766162.02 91296885.67 78859257.15 88869323.19 115969072.5 81453636.83 55165900.88 73030229.54 78369173.04 4885609.806 48992461.8 72347378.74 72170503.51 14842351.23 86583784.55 78425210.62 75543005.16
L-Glutamic acid 107539998.3 155085454.9 147340020.8 171750609.2 87115971.1 139546089.7 100651448.5 199297442.6 191409717.1 170320007.7 93010268.21 175283680 185278965 235609232.9 284635715.9 163721747 132459212.8 160560224 225348806.6 298850827.7 314649133.4 321686196.3 228456288.3 318948369.1 243885345.5 273536944.6 334003975.9 315689768.3 222931693.8 364468570.3 235267592.4 302414336.3 328121963.1 322582457.1 293389753.9 395052720.6 143316388.1 154116737.4 194217626.1 178344001.6 129535762.2 131063280.5 122172496.4 169553658.1 299573061 197291896.9 211789579.5 267405682.9 228581880.1 229037639.5 291830971.1 228387593.3 243709663.1 263922230.4 252816417.8 282061870.9 284821930.7 174248399.8 248232236.9 270802550.6 364906585.2 300643736.7 180358889.3 271159802.7 383791503.6 407413415.6 335673648.5 258394987.5 350194973.5 176358109.4 179723935.2 785986722.2 629466598.5 790157692.4 672923345.5 453621595.9 599230393.7 673688659.3 821694602.1 384702632.8 699117896.4 657868162.8 671178731.9 880458039.9 666061276.9 397631092.5 482238139.1 629465931.5 261268406.1 357689614 508749982.1 380847352.4 325602449.7 503418924.2 626611358.5 620788904.5
L-Glutamine 246502673.4 377640350.3 336831570.7 281612170.8 217910699.8 301815604.7 215818177.6 392481520 287100418.7 268326336.3 213839506.2 277728577.9 209818072.3 308724389.1 266132499.5 145580486.4 148465093.1 178529342.1 196353412.9 315440979.8 281901972.4 241232528.7 150201523.1 202837962.6 211980578.5 282709461.1 269128362.7 249370219.6 167482956.5 233467753.3 177660048.6 271044256.8 268359612.7 247395452.5 231116908.9 311470754.9 346280170 354217674.7 395355969.6 343877451.7 367999587.6 289643274 416080931.7 330279276.1 590519496.4 349521924.6 290983881.4 491048072.3 349533216 317439885.3 400655598.4 195307537.8 401521096.4 298612064 261710373.7 344136145.3 207606031.4 300736494.1 274586285.3 226036256.6 336243393 144278858.2 281616984.7 295010608.5 266985806.6 366559289.1 316945501.8 335400775.8 415853228.7 291200534.4 328225159.2 329018123.2 389830322.6 326208688.2 262572340 86201381.74 278386047.6 505028160.1 398571820.4 81623660.89 361806750.8 354484450.5 463954882.6 395210878.6 373615497.2 72129068.51 316064609.6 474920555.2 126886847.1 62170861.11 298881518.5 277008135.2 236869672.3 330020585 365152100 356743054.8
L-Glutathione (reduced) 386102563.7 181798902.9 297054747 218466225.4 176379262.9 156442101 210763132.8 320632382.7 416153943.9 221126102.4 22413455.06 75712671.62 117694759.1 189121986.8 324880775.3 113899273.3 46791730.63 63602330.24 136728444.7 187446451.3 210708621.9 113616323.4 96292213.98 77242650.78 80352494.19 394997620.7 174960430.7 114549750.6 41854868.15 69084600.11 51683598.77 189313575.4 80854441.2 60627371.32 51387936.82 127563306.2 191268336 125872277.1 479342010.5 445786618 120834268.9 35838107.58 54924266.07 368211111.4 2816993.831 210781401.1 110255819.7 73673707.53 181848373.4 308266610.8 156426592.7 248049592.6 99480350.79 282240580 179276315.7 194621560.6 102817636.6 76846391.82 178652353 275810983.6 112001610.3 161129005.2 96379151.66 71513582.51 106551317.2 157284872.6 163780469 178374482 95842631.94 110738903.9 87631150.69 38906771.06 65060977.61 66717570.74 83042240.91 92993660.88 52422702.33 25881001.34 33599987.5 14145378.96 47312435.95 53150769.86 49035892.74 46335382.07 25701069.65 33055918.65 61287362.11 49753776.27 811644.5917 33591306.09 37465851.96 91321831.35 1270059.706 30559254.8 30436800.05 66753298.49
L-Glutathione oxidized 342331943.7 913840872.9 423335289.8 573945312.7 536533721 844248265.6 86746577.97 634066064.4 377798575.2 122186154.3 79623020.31 225618365.4 296792351.1 613305392.8 446421260.9 231991154 117475981.8 381511050.7 280266132.4 633599028.4 607831450.8 361665854.4 160146775.4 457026280.7 215809148.8 458438529 271051317.6 185268601.4 196726349.4 676964652.9 16695172.84 477017520.4 148512996.7 34759673.55 98801629.56 859069536.9 716875574 442123386.9 531156534.1 454904820.4 849547483.9 81649673.09 249450116.7 462531636 1605591.555 617053159.3 252559111.8 415924423.1 654409730.1 191801620.4 713875237.6 243014017.4 392640698.7 352015515.7 245273111.6 617951024.5 527078907.7 574759487.8 243491538.8 247870256.1 523674220.5 278080565 442122325.5 78838288.77 207803684.4 498686375.7 496768952.7 480409657.8 735933386.8 461636021.1 472285794.9 192398665.8 301494192.3 205974387.1 478134787.2 202941839.4 8770806.335 27225244.14 11786613.04 69918883.9 8723664.955 4321107.136 11693279.8 6090032.642 113271331.1 4214183.064 4786651.619 7165862.996 968607.0697 41836824.83 4912476.346 13727683.59 1356526.632 5113505.296 51994112.2 8350508.522
L-Hexanoylcarnitine 9917364.543 12409170.5 12727402.56 10642180.06 11143109.48 21226409.82 6709225.999 6062557.638 9631656.069 3835066.709 11993705.45 8229200.895 4991032.631 4979928.955 10292062.29 3028151.355 9792636.355 3506686.315 5405263.075 7950234.885 15210824.48 8050457.656 8881439.39 8299326.268 4151525.839 2606688.004 7753001.071 5197151.314 6469685.606 7096583.453 3796866.459 2025388.747 5092210.121 2492501.275 2506049.918 3762887.518 44131001.23 7450594.505 17495718.13 15958466.86 14933205.84 51946998.55 16806125.79 13807052.55 1812567.082 9625996.824 47542521.08 15752400.88 12488406.64 7435399.017 8750064.999 37318875.73 10478718.57 14951352.26 7006074.221 10667175.81 33741024.15 9972163.268 9899307.727 4253452.743 7542321.693 23007040.09 4683056.061 4109327.299 4134328.2 3520915.265 15596201.46 12765360.85 13164076.53 14015038.38 13786020.55 5882423.541 5360986.335 3742585.843 6608659.327 6564277.366 2184287.96 3573823.146 963287.9414 1375445.23 2770367.896 618507.367 1065088.312 230102.8924 647709.4348 527864.5947 231345.4214 646129.9843 69339.34659 438382.8211 633366.3392 302536.1388 94864.66138 129451.4343 247098.8642 274244.1008
Linoleyl carnitine 137130274.7 292010145.9 165626260 202401653.9 326412628.5 491096455.6 139946833.2 247433024.1 220347427.1 124524620.3 390302947.6 146463914.9 298026290.8 241986329.6 360872209.3 175385278.6 386375408 239249842.7 308420354.6 362058728 432996813 350355316.3 343680865.9 211583047.3 378223004.5 253801983.2 404671952.5 252459190.5 497530670.2 227034480.4 391638893 317302552.3 323599178.8 269071336.9 412541443.6 243010641.6 193560649.9 216487163.5 314797563.2 149071135.8 189621113 111748784.7 238023363.2 273821750.1 50220843.79 279234795.6 224818176.9 406704303.1 352425058.2 227818947 405303130.1 215296996.6 410271700.3 329403397.8 241865245.3 421642518.7 332423871.5 459811399.3 324933116 232515608 355856258.8 429689103.3 409693151.6 294474159.6 297059036 389619578.1 173794322.9 112586682.6 204018197.1 130914164.9 181016984.3 164963021.6 142229369.1 124735423.2 136009528.8 234586507.9 94236036.89 135485027.7 65954616.97 74484351.79 194355709.8 82456949.38 67841506.03 38097297.14 82377759.48 95712223.24 74095237.97 57875651.32 2565401.23 55686145.19 115726279.5 55692337.15 16992134.96 26079855.57 64644700.67 129627801.2
L-Lysine 233918003.2 229448941.2 329925423.4 226334631 249260998.3 395608175.1 242929404.4 243025212.5 310992912 206089076.5 302286943 343307868.7 322363244.4 311861784.2 327891725.2 218728060.3 275260696.3 453206297.3 334773414 327904583.7 389962906.3 325833334.6 362724941.5 462239220.1 372170821 310011948.6 341892166.7 350738345.6 410217814.8 558306827.6 434478109.5 383627987.7 463157452.9 401538400.4 398932179.5 631965128.3 309900090.1 333838660.8 252582469.9 388365491.8 417825511.7 277199932.1 464223815.8 311283662.9 228590785.5 376167659.1 357123613.1 517041256 294939881.5 430799353.7 498883076.3 334365758 456867819.1 327250837.1 516095046.1 510848743.2 640576703.7 486929182.2 347515585.5 491531899 571811637.2 385054980 433147226.2 653660579 544369085.5 561972612.4 297083629.3 308298923 669053014.6 249591504.9 353632159 362773729.1 352131462.9 363769896 443544324.5 383544993.3 373814750.9 452940013.7 428603907.7 237748901.1 393423510.8 403141884.8 422916774.4 470711859.5 388132355.5 362773505.7 359678667.3 395768027.9 120955605.8 256763649.9 423874786 435323000.5 177236776.3 318011922 410672958.2 484477066.4
L-Norleucine 6218838057 7248919934 10684700240 9349463928 5393227478 7907074393 6427810057 6373961378 10446592513 8704500576 8569888533 7544655826 9309249213 7208017803 12094229067 8669652948 8382107079 8841560697 9405237644 9431286933 12911451834 13626924456 10112648259 10658802408 10439587837 8116359445 12521389717 10074576559 10217689941 11603195419 11313715981 10468761030 13304812838 12894690652 10138308339 14642602510 7602668832 9216092253 8952243787 9340049610 11013489949 6981334113 14018347798 7582640603 1891450292 12106100923 9027722764 15948072179 9545443356 12506934759 15268654697 8371751763 12826536304 9808843317 12389704858 13195251806 9961364238 14309637095 10360192658 11525513088 12970770469 9822923430 9609579877 10376146165 14286234143 14143743019 7595450026 8392053223 10077400022 4733820376 8098100963 10244635439 9903995764 10362468092 8121743125 8283838435 10467438170 12312342893 11233940879 3877487614 9065909242 9916886104 10472764174 12411901687 7626151672 6461300508 10214371284 11063525808 556273923.3 4888444643 8768722153 10579167678 2355283375 9916744056 7897588625 9973138544
Lotaustralin 33346188.72 43250350.65 37374518.63 51132471.24 36347883.89 59198882.37 16605391.54 40483544.46 37317392.74 19252009.78 11287396.9 16595279.73 42487858.77 38818817.75 48351425.03 29379653.48 20282774.01 36646643.24 35744452.6 46744639.17 57755985.04 55839207.53 21166710.76 39370121.12 50046339.4 31418881.14 43473378.92 49805265.97 42986296.13 61704236.17 40640689.17 30334416.08 47636604.48 54328675.64 42465576.83 73993778.49 60877102.32 46462563.58 36667752.4 36770490.37 62718729.17 5772621.729 15426638.76 33736430.73 4198129.051 51948733.13 39937931.21 37518032.32 45497061.48 31525837.05 67366814.25 36324472.76 32955116.51 34273541.45 29982514.69 50844960.8 53238308.02 51848476.03 35838252.01 26173607.35 40527635.42 46170357.59 55097339.25 42862986.48 34207781.4 32344749.86 41679340.7 45506573.61 64927588.17 51693655.46 63775582.49 43970107.21 44435274.33 36296482.74 49626951.61 40292827.64 32452873.48 44314169.02 38519427.64 21195593.29 33650773.95 28447956.79 44045728.84 36682367 36805686.93 34102280.97 25138399.57 36518682.25 2314723.994 34292122.34 29862537.45 28286111.68 13095792.3 20868495.65 39056235.48 29484059.33
L-Phenylalanine 1048534009 1445395251 888604232.8 1430843104 984630202.1 1538503967 1085927087 1415594025 1648527267 1401572172 1149895540 1401079935 1661538157 1901517517 2023705089 122276130.4 1320622752 1740349038 1911191868 2011376370 2230092545 1954829334 1436248304 2387463464 1962708012 1756569344 2174062734 2117845559 1580193125 2589285308 2526688562 2180372660 2571432321 2666004867 1673018737 2850508718 1560317891 7396978.883 1676198472 1591755265 2312653154 1407445282 2148616438 1622534709 6962970.168 2570405181 1765292505 2585145568 2105286400 2256457059 2053557168 1824632845 2409486358 2089023449 2326185201 2884542925 2001025813 2436014516 2416122016 2460384308 2706860246 1997390016 420354043.2 2410396070 2408592564 2915367120 1417154945 1660114423 1772959079 606387530.6 1462476979 1785813899 1769979963 1798389717 1528532939 1829795859 383676428.9 2278404096 2209766189 37044469.16 2058025090 2107486054 1719850425 2755344821 2251884232 89126037.16 2100243774 1015460570 7155701.305 80153272.74 2048497943 1363463212 6786234.71 1550429355 1584591182 2450526141
L-Proline 31962812.98 45406684.72 40183353.27 45573159.85 23186665.48 36735817.57 44706347.76 45820046.11 46570453.29 53678909.3 51407979.94 38694793.73 67419001.25 59748312.5 51699620.35 69422542.88 53504861.09 52595369.32 96519673.93 70128004.26 94407894.38 108018855.7 69909508.25 66693893.73 97537619.51 78590483.65 87407393.51 96125316.65 74504438.17 97097778.08 158505581.9 70229695.41 157417820.3 165225073.3 87739840.34 135648292.1 77494347.62 54829465.5 40985876.48 68726988.62 81524121.44 63976986.54 69684971.21 47833846.28 26284867.39 82004630.8 77823490.43 84534878.88 61980643.62 64749635.85 89909677.54 79806530.57 82651775.63 68989594.94 89948040.57 74791868.68 52390608.59 85303620.21 78789758.11 75331072.11 80629814.59 83598592.56 74888148.58 102329680.3 90950087.02 87387285.42 36543093.52 47007559.7 58366308.67 33664939.57 45403680.64 54094193.74 56573046.87 57217160.95 45758374.37 44622175.42 50990592.64 67414296.33 61758807.93 23207538.9 43011612.08 56202224.03 64350485.03 76527262.81 54446217.02 54935506.69 59808969.21 67487709.39 17183079.64 35633827.55 65436163.74 79371078.65 37557504.8 68913792.13 78426882.9 88610277.83
L-Pyroglutamic acid 155403380.5 229376596.7 207414113.6 180399945.4 146243112.6 196668034.4 153195508.9 301230281.3 232427244.5 203764655.2 182959356.9 206332718.6 186205571.5 261227381.1 236868179.1 156568094.8 179007339 203346060.3 237886439.1 319552270.2 342458279 321448206.7 267674748.3 273735622.5 212272530 264634428.4 284300582.3 308590060.5 308912931.8 333731708.6 248351725.7 338917584.1 349305486.8 354033511.7 277790440.4 503941332.7 217680101.4 228388191 242234926.1 247767972.4 218125326.8 214595217.1 240918560 227414686.5 415493286.6 249939646.8 279200956.2 341494746.1 285096089.1 276197416 317789702.1 243511965.6 309095892.7 270823170.8 291088014.7 325515741.2 281019521.4 330731901.2 300220655.9 252162854.3 303714783.4 298322309.6 296211908.3 319657819.3 372445458 390029622.2 263765722.6 235549096.7 321172711.9 232143108.7 193708611 526499968.9 568954425.4 472303407.4 488227447.2 479806018.9 515969042.2 824399877.1 609230377.7 275680892 578931957.6 508191830 764960189.9 645403862.1 731916401.7 575202676.8 526284982.2 750310692.4 105356556.6 59102107.2 545868779.5 566044011.1 176876149.2 562319346.5 737303068.1 699957146.2
LQ1825000 319629434.8 691889373.3 470315168.1 453631286.1 806147040 914637982.5 244100490.9 533555190.4 462527147.9 356747741.3 645131107.1 385530811.5 288844318.2 530628691.9 478267211.5 335055303 436873137.4 495268535.8 198667328.1 402135209.3 408106651 298171667.4 414456655.8 505312373.2 237814883.4 440785585.3 439261419 341980881.9 529073337.5 679542815.4 311665709.2 384808335.4 383688560.3 338011446.7 545217559.8 961985355.3 585141936.2 533378120.7 688587805 712727188.4 398833783.2 682153516.2 658902020.2 724367945.1 197502633.3 410467300.8 756383321.9 781195974.9 657456000.8 653377348.3 428936953.4 441091939.1 457891019.1 498591592.4 484686481.9 349809887.7 543727352.8 499733346.2 535509762.4 570811679.4 324757289.3 452831433.4 539486460.4 582198755.4 639748511.3 365027936.2 531557751.9 713671978.8 1033270845 797174820.1 855617289.9 735365037.2 630095515.9 794688771.2 848629579.7 679703116.5 397517409.5 493031955.3 611756641 433520932.4 530475243.6 388017740.8 548380763.5 601344283.4 551201894.1 515444053.7 449337016.8 526662724.6 113834569.7 626156012 492361318.5 636059461.7 287484807.6 902433678.2 603803795.7 645965180.3
LT9970000 9475407.951 9734638.003 5494798.628 13514379.24 13595821.9 19842483.83 13436357.63 7512014.342 5303342.624 12982523.62 24715154.75 21795552.79 16425468.58 9496726.076 6588871.23 10446303.88 22600338.64 25631510.17 11917496.74 7296014.565 6612103.223 19701376.16 19265769.63 22146124.86 9239811.685 5328308.649 4550418.059 10057445.49 13952393.74 17005014.38 9503320.099 7752051.679 4815547.76 9077549.17 9464701.898 19420120.42 7242050.691 7369534.16 7393909.033 3977009.002 6176607.044 8529939.414 14668430.88 5486969.714 1035928.528 5665490.024 10296435.15 15574231.27 7100071.519 4785652.767 6921547.411 5602308.269 11886050.78 4869252.466 5101064.815 5438857.829 6955714.213 10981922.19 4394743.416 3887667.604 4324727.317 4974305.303 5545544.118 4838756.218 2931219.065 5537428.54 5045172.031 3969678.222 5556489.597 5561873.697 5530889.258 5378440.56 3597022.375 3114249.21 7924710.966 4326943.216 3745539.31 5091840.201 3783652.277 2532640.957 4453943.392 3997947.666 3966512.637 3428230.045 5831007.431 2597426.28 3816491.642 2994620.298 344732.798 2914182.686 3184995.791 3512993.404 878852.7484 2319033.213 4999669.787 4502946.534
L-Threonic acid 297276167.6 666398128.8 449457840.2 407901455.1 131501169.1 508664989.2 296053575.6 626895822.7 420882229.7 368117309.8 178635636 538456771.5 455638016.5 650059446.8 437512241.6 460655959 161650759.8 523088657.1 228714220.6 499136856.6 561949469.2 454498795.3 148002300.6 440776064.6 218051802 412745437.4 329027607 287765755.7 179816014.5 414481694.6 206529983.3 410604498.5 321043446.1 266384925.6 138660965.8 441359397.5 529226538.2 234116978.7 211328967.5 320548678.4 291848101.2 532042391.6 326235832.9 187198443.4 102351175.5 208908850.8 627795469.5 351840884.3 221707978.6 315341550.9 291946278.1 492310716.7 262116658.2 200839176.9 248741866 172085859 454439928.4 265589949.8 176328880.3 199511635.1 164383973.7 360696951.5 242365788.8 174113280.6 235323688.9 188157688.5 154315454.7 208903935.4 211929197.4 136521824.7 132519161.7 182629786 152873424.8 142398896.4 174168186.6 143326278.6 99896455.55 219930620.7 113091788.5 101231206.4 102097876.8 62537155.59 102958243.8 70524543.29 104924968.8 113608735.4 83920345.54 100082654.9 5388354.005 114242163.3 101702306.5 170384367.4 36716946.01 97647310.76 127145549.2 125408099.8
L-Tyrosine 518976326.3 999890973.7 1371792138 982464612.4 848956198.2 1318102041 531564840.3 1047543742 1295837233 842946916.3 1158415514 1155414484 926142443.4 1145550033 1473267238 975539459.8 832185749.8 1488312747 823332707.4 1315841235 1721287063 1053038370 1348951609 1637825386 945055901.9 1118591563 1654075158 1165853169 1356205177 1668195229 771413227.9 1254659582 1384296650 939959966.6 1294169610 1746231300 1270412623 1202659911 1160407961 1229906937 2129038108 1036038614 1409841294 970745526.3 398940432.3 2006925519 1503897169 1158759984 1258924580 1391158216 2282993343 1214903573 1398771156 1147455492 1425514630 2021439665 1069251624 1557633018 1250582203 1351112332 1451968783 956619593.7 1340297608 1417905911 1682210100 2255710716 920855016.6 1189272295 1412027910 660638624.4 727817017.4 1176988439 1256421220 1196765591 852269467.5 971678339.9 1135323726 1585238062 975470320.8 555263488.1 737087788.2 747151421.9 1141403148 1044357265 616318291 669496901.5 878695281.2 1131066881 121252805.1 884004956.3 766952384.9 1014460662 551220605.8 1005012679 845049402.3 964065459.7
L-Valine 947814152.4 861456211.4 994029145 851083421.5 890929686.1 810266328 927391099.3 818415853.6 846867369.2 704810705.6 853811391.4 626692179.8 870653523.5 780807449.4 911448966 736411252.8 695732762.5 641625806.3 733896025.5 790546114.1 1007770296 890977054.3 713140698.4 770471313.1 821419296.9 731887429.7 905957650.8 817807395.9 805774529.5 828877333 859659896.7 789306130.4 910997778.9 859253694.7 764709409.4 1135697050 978264767.9 1599876669 986260694.2 1079094517 1334729719 782033541.1 1397861945 902498212.8 648959134.9 1048970452 858523739.9 1384740002 987482276.7 960194606.7 1101882188 685798607.2 1122437300 755208730.9 1028432392 1139192699 806056554.1 1174118220 793293600.7 989312052.5 1085881189 839377453.5 1058465563 842768011.4 1181113856 1100145839 752733772 759039090.5 961912693.5 604415867.6 883305499.3 806521203.2 881689469.8 866046760.6 717483250.3 788740999.4 785211362.7 880264431.7 913344009.1 611825186.9 780428727.8 800514404.8 856644603.8 908859009.7 651462462.2 664011984.7 790252143.9 804567749.2 225113603.8 578689412.8 783521437.3 780612227.3 337813014.6 853099575.5 663905632.8 884239946.5
L-Xylonic acid 17868547.61 9529728.45 14624469.83 14023311.49 14550607.27 21095669.11 16077791.31 9511834.67 15718752.53 18293960.03 13029024.14 21699268.25 19310203.02 11263575.78 17462648.52 18800138.01 13092362.91 27787310.32 20724629.06 15838040.42 26409484.22 30504972.79 18998596.71 35060195.37 25884318.11 17404550.05 24208311.5 37777055.77 24551181.24 43354838.86 36742422.3 32120489.83 41988260.82 55207566.64 37153242.07 54808161.85 11342783.34 11483636.83 9504231.925 13200202.55 11198613 10379272.29 13413894.1 8676125.314 16652802.75 10616301.87 8802372.032 13052392.91 9081330.987 15020012.73 15032032.55 9759998.15 13820603.72 11061139.61 13484352.29 16636396.35 19781288.58 17156377.99 13809638.85 20878828.54 18922514.95 22945546.18 22916406.27 18861076.45 22634775.13 50408095.31 16074210.07 14535366.48 14892714.43 19475239.18 15356242.31 31241257.16 24689540.27 20380639.58 25676699.04 22913953.62 36069548.74 32777914.12 25224841.07 17171673.47 29149548.08 52277274.03 52006470.63 49135905.99 41108472.43 33485426.65 65737026.54 69293697.38 6799806.59 40778735.96 56266986.83 99839256.28 46256834.76 67609377.73 52331971.27 88395991.39
Ly-290411 86842.08253 123498.6658 84900.13636 81716.52081 100651.3429 229544.4346 75244.56459 91736.83844 192134.7706 77863.95396 94392.32951 82010.84152 81817.01531 78943.54149 81325.74204 74842.27194 108998.6062 130438.6025 111563.8445 110527.1185 120473.8941 110289.5542 115797.3211 120920.9156 121479.5425 116515.1821 117267.5007 122488.6974 121105.3007 136727.4898 129066.8838 124736.3427 135715.0913 137142.5322 138200.575 477839.6579 84460.8549 73690.19135 78840.09527 75666.24132 78992.48948 70861.55441 72380.79577 72235.57591 62883.26638 79014.28746 73910.59353 75142.49061 78091.92144 76049.15618 73727.23026 109987.0657 110788.7831 110498.6547 107900.9016 388478.8964 110207.6234 119089.5551 109798.1437 120424.575 118484.2171 126057.5153 121963.7564 138823.9361 130201.831 132551.4168 989091.7937 845500.1634 1214235.898 533087.739 4877845.074 1010882.893 908481.0082 831651.2249 760412.6495 3510660.756 498461.7084 1003148.638 797441.0318 2018728.052 2943161.976 345422.133 517557.9091 731482.6957 387728.3883 1407062.64 328431.2837 507884.9363 101562.2304 261356.6505 1192833.66 268898.369 123025.2922 185668.6697 484772.6821 1103432.464
LysoPC(18:3(9Z,12Z,15Z)) 71798763.01 97282543.38 70998030.2 104471692.5 42703031.49 56141671.46 134512144.2 113390987 88194149.04 106735773.2 79849539.52 72397829.96 167549798 171334614.3 95993495.82 114287192.2 143357916.6 104585317.9 139825549.9 136491158.5 88777677.4 159773052.9 88726577.28 64575589.25 141944687.7 130005548.9 81434370.58 100820278.4 57773109.17 56260520.65 168276572.9 155613976.5 132478788.7 153149184.5 62900271.13 94904860.35 213833487 116195144.7 139668506.1 169397165.1 171225413.1 240171481.5 279586364.3 144640577.8 34171957.89 131012401 231049335.2 286799476.2 143471431.9 159431086.8 154761444.8 126809886.1 176177757.4 90415814.86 153131283.2 108286646.8 151959360 153955849.5 100382990.1 121507396.1 124636420.3 155329363.7 109869409.5 137384136.5 139541847.5 134087128.2 96900057.13 96928221.59 118827358.7 112450749.1 122299408.5 141363124.2 150586294.2 133345038.6 168323501.6 127956726.4 160345898.2 259613296.9 188342475.2 74192418.31 153412719.3 219500439.7 241872645.5 251594742.7 195698115.4 121996082.6 213333461.8 227928505.3 12705361.52 136443208.7 182567733.6 197657844.4 64294967.97 214856140.4 253679915.2 212438696
LysoPC(20:5(5Z,8Z,11Z,14Z,17Z)) 25349696.8 30284744.44 14412877.76 30854576.16 15046886.82 7106885.103 39798001.1 34412507.38 14820172.12 39038442.03 44279858.28 15361322.15 37596839.26 42971420.56 17617353.52 26631843.08 34353715.85 14709871.72 28541539.86 30955155.79 14340405.66 33198958.24 18820433.91 11595579.49 21749416.54 23792382.38 13791254.93 19439481.29 23607795.45 12690409.4 42324530.15 34612094.38 36287500.18 43458962.74 32789682.5 24275796.73 83901361.89 40088106.63 71387355.34 97893164.35 73199934.73 100053746.4 111735276.4 49234606.78 11482931.26 56209115.58 74691720.53 89487239.21 46446206.29 53531859.56 50114820.52 33466095.86 37107082.41 19546661.73 35217165.08 25306875.78 47439719.46 38742281.78 22682452.11 27013646.5 25690810.25 40674226.02 35225201.58 49586504.56 38863971.62 44681359.57 56348799.88 64535515.49 55141314.62 55118479.99 67581919.7 84239941.79 88552135.78 69143365.12 85089790.1 68211988.01 82305230.02 129023141.9 100143937.9 37622612.55 53421903.73 124432458.6 135912206.7 110868497.6 89210326.83 41776972.79 118933140.7 137325474.1 6147662.812 64685571.76 66843885.27 104320035.3 34036264.53 81759539.82 92713560.91 87971341.16
LysoPC(22:4(7Z,10Z,13Z,16Z)) 1065356.101 2166570.985 2119669.987 2714179.594 1672443.21 2133774.701 1316958.086 1548116.377 883319.282 1944700.943 1270100.781 1112275.607 688945.2958 1318303.394 869074.6281 913952.0167 1306418.907 1622062.627 1061247.254 602679.2455 804958.2889 795611.4011 1258681.317 1181470.674 343034.4126 2767651.498 1640472.214 2175420.074 1133344.82 2546527.186 2706253.958 5086534.841 3784283.327 3751314.279 4423840.859 6134983.748 16843905.67 6668761.497 8771654.649 12560447.46 7255452.64 5989166.067 3721470.695 4204329.54 1038761.638 3861797.973 7066459.672 2138258.723 2177425.849 2045907.769 3189481.005 3508933.082 1192767.121 2018561.819 883665.6041 1126552.844 6938542.304 1567710.682 1978003.103 5624525.238 4802435.167 6804586.872 1768668.784 5047727.375 3656125.1 4302358.092 2856339.787 2353734.734 2216925.494 1717663.097 1693181.519 2415730.579 3364943.103 2466227.576 1275661.47 2599687.692 4577646.03 5039357.511 1558212.306 1587290.779 1979829.903 8585378.331 7090024.191 5460217.083 3333527.313 3038246.907 5390779.972 6687119.128 158021.2783 2782182.538 4160768.719 4636859.355 1374410.357 5022593.964 4312509.432 5216448.787
LysoPC(P-18:0) 26022968.36 23340594.94 27309128.3 36778279.52 31326807.49 33988343.25 57663016.48 50766439.66 66971520.12 85598367.11 69778500.29 91037341.66 158301030.1 93530485.85 111320318.1 139300806.8 117092752.8 173444915.4 179323565.7 120525270.3 161588556.5 295466804.7 157488428.3 258690048.6 255759245.2 123802130.9 169409273.2 214723598.6 161816407 225111348.4 259676898.4 179242135.8 210168024.1 262848800.7 167362561.2 340510495 46929179.11 29956109.2 48338891.63 46526029.15 40592831.55 84231520.29 82189678.08 63290917.47 20650819.7 53715789.8 130514667.9 132456773.9 80486354.84 154356168.3 142356955.8 132951379.8 152993781.2 105033736.7 201739520.1 151618206.8 162299303.5 173996498.9 122901448.5 184612070.1 148458623.2 123926782.3 93986056.64 120124361.7 103724551.3 138928092.2 57383826.5 43428757.59 74615581.89 29125074.84 51140606.46 105413464.2 120217912.3 107233156.4 114117416.2 129617645.3 154824022.5 150245670.1 176979685 76749952.34 184700008.4 183237988.7 167669928.2 275624586.4 147413882.3 129829669 144851746.3 125495902.8 11004333.2 122583445.6 219407656.5 138507556.2 42338962.51 178308218.8 159687754.8 231981876.1
lysophosphatidylethanolamine (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) 230350662.8 256225017.4 242131616.9 365350955.5 238811645.2 220087255.9 456326556.3 324142159.5 274043450.6 579260635.1 516891500.2 207589897.9 620868833.8 443198264.2 285081635.3 522061329.5 535642146.9 336011907.7 331272396.4 264167500.3 229588034.2 462284966.8 353355149.1 207508950.7 294582810.2 285377661.4 182957718.9 286502891.3 259916077.9 224741648.5 367747282.4 362126693.7 327903673.7 370307755.4 289491348.7 479459398.2 298114977.7 155922754.7 228788564.9 320701301.6 238363053.9 407529706.8 409212904.3 300964971.4 58403353.56 255542222.6 517919944.1 504954214.1 373330123.4 321138581.6 338207952.5 334838294.5 311893914.2 274459491.6 266886542.5 209698974.7 398353331.5 286716027.3 262375349 239084620.4 316179626.4 338310112.5 230835224.6 305366155.6 255573042.2 330969219.5 288152834.3 266915545.8 382093200.1 233447855.3 316228550.2 382451828.9 380129867.1 375376999.2 398532653.4 381943980.2 441909653.9 578345086.5 479798772.7 214599177 379217206 562236382.5 650746803.1 643780925.8 459253536.6 333941521.9 623292916 620408275.7 42952447.56 371612505.6 496033678.5 479600296.7 200461793.4 530601742.9 467369727.4 489602601.5
MA4000000 220774.8912 311474.9201 467787.115 206118.0593 181915.4824 202536.5689 242980.5989 264325.5145 309346.8769 263596.6965 265224.8248 691650.6237 344857.874 345547.7239 1202251.337 783165.0225 321359.1784 1534861.647 366191.4294 555460.9671 744847.2505 1817173.51 1477387.866 5979664.862 1296008.296 12074213.13 3384375.022 3919753.829 2672124.838 9806748.898 2160076.747 26855881.35 5751884.31 7993124.169 5908704.924 14681629.95 476343.1655 248384.3368 252485.7805 407516.2163 287072.4906 323380.9857 1260329.202 312596.3064 187184.4287 597472.831 773846.0405 1376831.376 539453.1211 379700.6384 369177.4344 548228.507 754618.3554 551005.3944 664891.9085 689810.0987 18690206.79 2741992.621 1525836.041 15902974.67 21738536.55 11836739.84 11025661.73 3239198.727 20569570.27 34563302.58 377089.6807 295798.9538 414367.5617 414388.9871 288056.7495 338850.4603 738346.0969 1039702.617 1292853.328 886752.7763 746344.5884 1438808.317 1497245.842 1111225.596 875115.2914 1570581.163 1732490.336 1494121.307 1793094.979 904564.9784 1287324.132 1280843.729 85043.74478 1250950.231 1239588.686 1310867.166 502312.9134 1864063.613 1488257.766 916842.3912
Maleic acid 1852255.598 5096709.232 1508594.882 1493638.66 1742318.138 1727328.847 1379295.89 2493146.184 4564950.781 2051223.433 1082479.269 2179319.788 5781574.864 3831869.512 5434208.817 4510620.026 1203732.651 5913150.531 3070352.628 9802817.19 8917548.849 11017619.04 5055099.063 7277473.775 7180241.218 9169399.697 8546132.472 7617194.778 6008850.969 11008229.72 7401142.205 12173319.61 10639145.36 9544596.673 5864699.093 12304105.37 5998005 1400897.686 1213054.891 1197648.888 3677481.073 3594733.841 945281.3176 2944395.561 1355576.275 2411385.39 6031238.141 2048103.006 4573151.808 6081591.247 7050793.561 9559109.118 4483686.15 4106429.168 9761539.039 7549162.9 7652884.537 5663571.118 4122772.832 7478406.09 8193139.035 12785641.55 4291930.955 5767503.408 13287378.29 11051222.97 4928663.996 4892491.614 8095040.336 1755141.867 2380974.16 5472392.709 5338434.086 4430117.67 6817817.565 7996443.917 9283637.114 12338243.23 13729734.23 4808680.624 8815154.89 13767740.82 14601728.14 19300423.06 11090864.11 6703808.84 15185812.64 15875501.3 2428256.998 10147717.67 12788738.64 22615777.75 6327766.77 16581202.22 11347765.62 15388380.1
Megestrol 2691690.256 2222802.501 2351931.185 2307991.153 2464069.968 2498229.311 2323051.29 2402266.028 2854483.382 2515065.646 2360766.423 2610640.3 3975552.071 2721594.416 2418792.348 2458701.534 2937272.778 2819279.12 4193756.669 3383309.558 3073355.66 12149645.64 3760629.41 11148053.49 3526328.591 3398822.147 4501214.761 11170003.59 3245238.895 11086222.7 5924750.135 3825130.651 4499881.466 17001356.82 5547994.707 14848882.52 2226658.328 1857264.829 2310484.227 2175886.749 2449210.478 2426389.879 2399231.747 2185628.082 972548.9221 2523189.677 2973599.243 2733994.951 2939118.05 3137406.532 2415995.959 3065510.36 2665274.213 2492912.366 2516488.272 2941488.507 3359038.142 2754300.459 3087482.418 3616407.43 3115888.554 4660040.304 3614920.895 5183754.262 2994981.308 3512802.256 2522347.048 2629385.97 2429385.684 2157494.843 2487940.2 3117522.197 2900355.784 3021527.381 3546913.228 2950040.865 7626367.343 3809501.917 7201246.378 3980146.787 19728495.54 40618090.31 34045050.2 60259766.42 42202626.5 31156696.73 19167489.59 16837756.13 1307194.974 31180824.44 35047983.96 4594822.798 2445780.173 8170638.131 38496353.66 15471854.97
meprobamate 242265.6827 718029.5609 274061.2096 1219894.279 299740.7673 520214.6978 212289.8201 569996.3806 284429.7816 550200.7003 229719.1615 1375898.38 253536.9339 759438.2838 515771.515 753167.9056 263068.1505 1406328.628 318313.4275 377708.8634 456656.1012 1486876.365 311094.8163 844275.0105 896793.5011 784695.2957 924316.7864 688442.6911 770241.7742 2111548.784 2469227.718 1458610.966 1899556.536 1397229.005 810447.7638 8322431.624 305591.8183 257717.426 269504.9868 275077.6111 364984.5023 753181.482 518847.4552 250843.2463 180882.0583 423160.2004 1898669.571 1432448.286 318939.4803 684452.5731 633633.4838 435930.8661 356976.7994 300446.2866 952200.9364 399223.273 1400661.541 410591.6162 357526.3893 1205315.111 948045.4331 1138836.804 1746718.722 618219.0728 2528187.855 1365732.496 284614.0271 284570.251 322772.2828 233939.7932 376000.9659 391542.5694 340565.841 379394.5238 720372.9451 327765.4972 366399.289 946022.8328 907298.1465 1134249.879 561484.034 375314.105 608808.5807 449887.7645 456984.0948 777814.624 1164546.535 3720517.083 235948.4457 4638798.152 663092.1446 3596094.398 1715971.94 4517639.468 7128991.399 4282555.276
Mesalazine 1876207.481 1961895.964 1334265.752 1443402.199 1190790.665 1379902.411 1554881.193 1414008.19 2299168.371 1198573.142 1502453.454 1426624.766 1883780.893 1219735.671 954730.7496 1115024.11 1578223.993 1381021.424 1242219.878 1093514.078 1486005.402 1559754.314 2207504.12 1160851.899 3176889.511 1738813.133 2103508.425 1786591.016 1489940.538 1399844.807 1023359.584 924084.5806 867792.6125 461478.3613 1230532.007 870383.5954 1438569.073 1006189.462 1487584.993 1413722.847 1282645.377 2096808.833 1263340.411 1322440.557 574976.9431 1495915.293 1631841.821 1572256.521 1528727.01 2063939.286 1414888.677 1551085.809 1311581.782 1160240.362 1074511.503 1208060.408 1641623.854 2614929.344 2481760.323 1675606.75 1492531.901 1445957.263 1440597.348 1089287.949 671768.8724 915166.5912 1228252.355 1480225.999 1332357.018 1189020.525 1523424.836 1826425.703 1836230.427 1236802.169 1567687.695 1448684.627 1641775.423 2072335.361 1634959.555 4988513.692 1467636.241 2013376.632 1387087.998 1827438.366 1393264.041 1030792.583 2273082.551 1584277.732 610830.783 1281391.204 2134285.033 1515464.468 683781.9794 949524.0646 868293.198 1106322.708
methadone-d9 240970811.1 195372529.5 215169947.4 183530769.6 215712319.4 173039322.5 356909378.8 192780528.9 193797959.4 317271357.2 345704951 336425872.1 256138754.8 196104919.7 175430984 258579743.8 300022840.9 256205978.5 243286929 182562568.9 152528261.1 215809196.1 256492589.2 211648375 196381930.3 188105991 160804829.6 143462025.5 149957128 139161403 184324655.9 186458156.5 157467696.4 146664323.2 139082681.3 121845231.5 193554497.9 192290698.5 159423640.9 183193222.9 151804759.1 379071423.8 359357464.3 171581792.1 226036528 150654899.9 253301315.6 277297306.8 153847923.6 225539332 155821941.8 229942394.7 242912078.5 155770292.1 195792540.2 157149661.6 184591361.6 169033418 155236830 170503574.5 154490708.4 160969379.8 159950593.1 152348555.9 124615060.2 151306609 186690154.4 187329700.4 174587477 191336048.4 192402504.3 184662326.3 173385788 195399286.6 205411413.8 197935169.5 183982952 173552264.7 177422509.6 196985576.1 196380403.3 172051484.9 162830110.3 178896327.8 184850699.6 211227118.9 177631759.4 155167834.6 74857961.29 174520236.4 191623635.2 145203309.9 130019124.2 151927715.2 181396127.9 180763664.7
Methionine 579128973.3 706508585.7 756139838 548686410.3 252591676.4 343442744.7 624497724.7 671444756.8 733064546.5 590626284.6 408698546.5 370738745.2 809765513.6 767725465.3 858177481.1 577496529.6 501423337.1 512631184.5 844132605.8 966938284.5 924192488.2 960097805.9 544027193.8 585264335.2 118441502 760400669.9 877283739.3 710048099.7 498728547.1 583403951.4 885617488.4 857280078.9 934022511.9 878561511.8 537736384.5 876891902.9 591721306.7 222135630.7 635468913 1129250236 1201387451 637600199.6 1313386376 670042862.5 395843109.9 1474850193 855797266.9 1682219414 825709387 1377304121 1625231688 679507294.1 1213539515 787567268.3 1521768221 1405435563 797049359.9 1297343603 642683526.6 1280111785 1385446121 690002931.7 1076070828 936949398.3 1414685315 31427404.03 613241940.7 762755358.7 1090791232 525820469.6 891313288.5 16990745.64 958513483.5 843020566.3 13955623.34 809088188.8 77552311.71 1009896221 1114332188 386118799.2 824749116.3 806967916.1 1069713585 1200719395 732807399.6 701291740 112240333.6 1109021396 121117515.3 639380951.6 1090075482 939680120.7 101989696.5 945289892.5 887107017.5 1152514366
Methyl (3-hydroxy-2-oxo-2,3-dihydro-1H-indol-3-yl)acetate 771983.6371 773481.5866 846396.2492 1073552.082 928853.6631 2149578.357 598177.3173 751428.9049 847287.2147 742905.3616 567021.3136 946095.219 1110915.161 709981.8152 1095800.254 706933.579 627095.9499 1774638.907 894513.7739 811544.3062 1307625.617 1233619.195 867779.6752 1764941.637 1164656.512 503519.8772 958894.7665 1036068.947 1391658.846 2297026.843 922117.8419 948507.5559 1042045.558 980147.7924 1943044.633 3775942.115 711352.4446 574252.358 665710.3522 983259.7132 1263389.874 151795.3524 590756.0011 665485.176 162303.2301 1137365.386 434242.9609 812363.2724 835454.6981 933954.4475 1324907.201 476709.122 879234.055 872176.9266 1453139.414 1331254.365 1245456.626 985665.0062 924070.9581 1501714.972 2328997.956 1367612.68 985359.1665 816667.9862 2314472.322 2378067.179 674529.4559 679473.9016 630342.3544 607890.5288 707581.113 931719.4647 1365615.643 753253.52 1540660.04 1002082.196 1159662.535 1425153.104 819178.1599 786541.4221 917064.5392 841146.1118 1008253.836 987973.3515 1875467.444 751340.5786 1288631.323 1271884.968 121772.73 1149007.389 768240.0775 1116157.205 221784.931 648291.4387 1536786.826 809159.9868
Methyl 11-(6-oxabicyclo[3.1.0]hex-2-yl)undecanoate 119592.5493 138629.1069 113400.5072 117747.5176 131667.8369 112816.4749 153720.1194 155889.6502 120949.0005 174031.5678 140608.7555 203441.0845 376505.2924 329996.5697 199670.2059 368278.9416 180433.2863 288545.8678 1048568.739 276918.9565 294410.2627 711776.4752 362189.4447 626883.2211 2096460.858 495484.0654 554309.0599 812743.595 511897.7562 1009876.777 5271165.42 1317837.308 1084722.222 1686204.86 1360449.384 1816445.619 155480.0481 132026.1757 132163.2336 153857.5244 136905.7478 169922.9591 162919.4524 163365.633 90852.88936 182526.1463 191058.0564 169459.5551 176531.8401 196420.1681 261517.7451 230723.5007 166784.6243 153022.0008 180721.4373 158815.0201 295281.9417 470684.3312 869875.1981 519880.8667 184585.3945 2354737.598 1596156.784 3301696.028 384788.9236 318518.1869 171930.5514 129587.0836 187420.9606 123728.758 138076.7069 143576.6041 132574.2742 120034.4307 134330.2247 131958.7794 398628.2588 192344.5841 210414.4711 135881.3025 168720.8832 200782.8174 242954.3972 258163.6919 254901.1613 343890.5827 272655.0824 202091.6771 85019.98142 461291.7432 173258.2757 507640.1314 142374.3274 244900.0183 703816.9349 541639.0597
Methyl 14-acetoxy-5-hydroxy-5,9-dimethyltetracyclo[11.2.1.0~1,10~.0~4,9~]hexadecane-14-carboxylate 130079.3366 143098.9496 128094.9066 125992.9725 128321.2264 127488.3437 831856.2202 830278.351 1219114.162 1018191.122 932004.4134 1778213.261 6666322.029 4209339.687 5444807.759 3273375.164 5235389.827 8427063.435 27021068.22 14651254.73 19064461.02 26528406.15 17243513.92 22164566.81 26326104.45 13654483.95 19807280.08 20198132.66 20969027.26 21869581.65 18790628.87 23000895.23 24649815.57 24943700.24 20997609.26 31794825.7 135417.5772 116854.6282 138796.8521 129383.8305 137725.2266 389816.6707 207520.7954 264320.6262 251710.3241 956532.8951 1765966.374 1744418.755 1255002.799 4254361.327 4182125.548 6050166.961 3624588.668 4511065.274 11475134.06 11752254.21 10748330.55 3812307.914 8960234.621 11495521.18 15141304.88 3887660.279 2932388.304 2507208.386 12823714.47 21357633.64 339238.7776 172043.05 172974.5466 123282.3579 138363.0833 4772079.063 2902481.632 3118111.662 2113768.899 1987454.409 14620176.07 10191336.75 11701781.8 2244865.615 9937748.965 83259132.01 77342606.89 80119113.6 63168192.39 55261093.45 94052888.04 82694144.3 3164934.085 39491075.59 80005667.16 98205465.49 15467589.75 67548089.91 70676405.59 105278842
methyl 2-cyano-3-(3,5-dimethyl-1H-pyrrol-2-yl)acrylate 176455517.9 213103582.1 142131199.4 344178617.7 275065503.7 298069768.5 193729950.4 168652855.9 129935189.8 231599332 148298955 250548688.3 205422229.3 209263721.1 151700853.5 148637078.1 148095311.3 223823822.4 167391145.4 193000067.5 155457655.9 269524099.1 176221507.1 208070047.3 182719298.9 154743174.7 124224571.9 161487973.1 221954041.2 254032742.2 104726872.6 169988916.3 88737607.47 190522441.5 197943178.2 256799309.4 178679089.8 56763469.55 157023785.8 172568963 180190461.1 89791349.05 112838034.4 98789024.65 46091024.09 245985159.7 155999214.4 111151009.5 133317601.8 252006634.8 294822794.2 163326953.3 96908998.74 134604954 170734124.3 277544437.5 174275709.1 78299143.15 93384680.07 144360304.9 240541689.6 126720831.5 47391685.93 97758851.88 172038348.8 205504168.1 284585153.2 394097522.2 433134198 372451107.4 412060310.6 263404816.5 404547121.6 313096292.5 482227557.4 288752193.9 319439354.4 324075553.5 258990938.6 178188646.2 257220144.4 138776109 206977160.8 212552473.1 190264050.6 152926311.6 204254717.1 206384310.7 15718112.25 122816490.4 193590486.9 136817041.8 25170842.54 148880785.1 176554834.8 129730791.2
Methyl 5-{(3aS,5R,6R,6aS)-5-hydroxy-6-[(1E,3R)-3-hydroxy-1-octen-1-yl]-1,3a,4,5,6,6a-hexahydro-2-pentalenyl}pentanoate 232932.469 253227.6601 245798.5837 222241.0516 180162.5169 278608.0596 219267.354 241032.9532 305322.46 272177.8592 269609.9132 321729.9794 547633.4012 444585.1336 555684.9541 504441.442 401382.3601 505880.4673 823941.523 614849.6737 711253.4059 1305565.707 825434.0818 711180.5544 1098451.448 559352.8153 948538.4364 793783.4361 788823.1043 840128.6839 4584216.031 3306241.336 2339389.739 2638623.074 2551920.483 4379252.16 291198.3345 225711.8691 228523.8564 210253.7447 197343.584 323242.1071 272678.1246 302340.4575 170413.6511 222501.5453 411764.7527 313655.8915 273082.9765 838299.6531 402630.1755 526124.7889 408768.2723 310325.5079 1096468.593 472787.8428 612349.6342 464969.8476 437653.2161 1070850.955 854139.8206 4234409.042 3079939.354 2605152.979 3292401.964 1319038.023 273211.3821 274923.6831 633479.6512 184247.6472 244989.8248 792451.9456 419088.5022 380374.7303 793312.2882 347484.2974 1438148.233 568109.4737 2170263.708 410434.4756 3187096.265 3674408.917 3153033.062 6318124.455 4253725.984 5459324.444 4050967.242 4096708.695 198121.5293 5706106.464 6875514.13 7332012.469 1558551.508 7286591.58 9938988.588 4765539.229
Methyl bisulfate 2511794.581 10493377.5 9317900.362 7183571.294 9759209.931 9594233.332 1513106.151 11527627.23 7137384.009 4925153.433 3427477.665 5601331.888 2468073.18 8240906.001 8687927.887 4871184.031 4092229.325 7748343.529 1874430.744 9040884.04 8203944.621 5695872.497 4597042.605 7102788.155 2066630.78 7066043.618 6565359.073 5498162.996 7313884.013 9175927.563 1871231.889 8361552.39 6898732.215 6123828.104 7743248.399 11207267.46 8876458.788 10310840.31 9545728.387 6670889.779 14302277.08 1959645.051 7634149.383 10536082.27 3505834.832 14570789.25 5613683.896 12053382.58 10211364.45 9045981.028 12688097.17 5497197.93 9871601.282 8116063.148 8178918.268 11144058.74 7437028.112 9702685.773 7954847.879 8282178.783 12361315.51 6677858.575 7562614.513 7758671.572 6913551.19 9171385.3 15978675.59 12847774.3 5690625.829 18754929.15 14870282.1 15211668.29 13617383.98 5112787.477 17738916.23 12251124.27 14841678.16 15020290.63 4765349.215 13019428.19 11307497.33 12352002.05 11483387.71 3936925.704 12940093.13 9004660.685 12011686.22 10559594.72 296978.2646 12733783.36 8431867.362 11561666.33 3680577.309 4427989.486 10885438.28 6177566.222
Methyl Jasmonate 2959562.542 3225945.183 3478982.742 3291112.795 4134496.43 6373418.77 2921083.746 4090280.638 2522696.321 3157469.211 4894495.903 6716118.307 4154381.265 3969062.288 2476575.074 2610597.142 4963851.425 7469407.739 2795737.238 2990294.577 2191434.208 2815145.126 4593695.445 7842109.028 4318777.634 3125651.58 3180104.499 3620998.869 4552268.152 8364502.328 4128629.036 4059356.809 2576083.993 3601631.958 4504526.276 7020301.332 2993724.527 4283938.742 4127062.637 3514496.841 4579130.236 2761610.963 3557611.33 3371113.692 1864829.184 4262388.504 3460616.128 4852348.227 4298114.05 3450238.294 4685628.988 2216063.222 3289951.46 3830487.055 3012151.741 4258671.622 2683532.575 4211736.316 3646264.335 3336871.866 3852873.988 3779847.35 2620225.511 3239542.478 2879829.677 2493826.982 3453780.356 2778899.328 2461079.906 3023124.614 2761761.582 3411371.262 3388428.059 2940095.737 2853395.53 2887153.625 3741865.503 2625021.203 2155067.638 1486031.102 2820932.098 4168888.518 3467009.141 3726060.888 3659161.021 2712773.147 3096102.396 2819252.633 1107193.515 2275049.396 2456076.644 3345418.495 1366428.909 1774416.755 3091621.666 3519367.033
Methyldopa 7469463.355 12339463.28 11608214.94 12607609.01 10183512.37 11740938.77 5930230.77 10591624.98 11365874.38 6117798.278 4136527.273 4656139.736 8546806.218 9377572.215 11155540.93 5892033.098 4979613.935 8147026.485 5390893.63 7412006.707 9809607.714 10114219.46 4670445.621 6511098.518 8935872.267 7508059.15 9208632.56 8709356.487 7065144.803 7470638.154 9466954.208 8551178.175 8982792.232 11527714.49 9862991.613 12940749.26 11059190.27 6198184.74 12936121.1 7726175.061 12327022.1 3025623.767 4126412.768 10495164.05 1547440.011 11456800.59 7534979.811 7533131.68 11421079.2 9570795.489 11650215.9 5167054.1 4585858.127 6308273.679 6692427.163 6961038.298 6481146.579 5987877.298 7814836.632 6954810.075 9892675.207 8230360.075 5969625.394 8610569.127 9119540.402 8965957.968 13121070.5 13099385.08 14694625.39 10346377.43 13826919.44 12900513.82 12949849.6 11529912.71 14893828.98 10679062.36 10972892.05 12996213.5 8587717.086 3590126.065 6275411.91 8419309.415 8923424.85 9450453.314 7809565.86 4880171.51 9698321.841 8872883.347 292369.9158 5284574.59 6323303.893 9479871.578 1446605.693 7327609.2 8077524.537 8660000.973
Methylhippuric acid 9429600.005 13561806.73 12340806.29 11103597.27 11067796.48 13312641.85 8578656.313 9677364.578 12999113.07 7819446.488 2858888.417 4424956.962 10947354.31 9050895.581 13182627.99 7579469.778 6810403.682 5335661.259 5959889.949 7449593.827 13435188.89 10147933.69 6350569.275 6459343.354 7808263.861 11623422.43 12039280.21 10552782.63 3307848.69 4610263.396 11481211.08 12645203.88 8485488.685 13800384.94 13389219.68 17982142.02 18282947.13 7558326.799 16110436.79 13346040.96 15024294.45 2389777.773 6028560.168 15809774.68 1276024.425 13937668.51 7250492.579 7346758.202 15257032.26 12938196.52 11611286.27 3905546.062 7855156.982 12507153.42 10741724.98 11121003.47 8663719.702 4888407.183 7952000.866 7517555.755 11784175.77 3099792.938 9522071.784 14045966.58 10744956.85 9725907.25 10870188.39 10138946.49 12095645.04 11398760.3 12928878.11 15723506.21 17883469.48 17133536.74 15342978.02 13449602.84 14363988.06 17968354.39 14930187.53 4339576.154 13425832.92 14574821.92 12652070.48 12707508.6 9332728.088 4405255.036 14288379.75 4544712.761 562950.7952 7122596.659 9955860.638 12640030.73 2030965.611 11779454.52 9417867.13 11093796.81
Methylsuccinic acid 7505864.421 21516018.08 23067832.67 14350271.17 2282420.655 18189223.91 7271689.144 17876063.44 18469322.91 14095031.35 2711743.156 21689554.96 11082931.53 20104828.61 22312469.33 15563087.36 3142825.73 19972642.38 8875455.246 18912174.09 23134441.46 23283368 3220802.07 18706601.36 12178580.8 16118988.13 19679828.44 15851421.05 4029012.245 18772996.94 16106478.71 17818684.65 21963425.65 15653658.61 5980560.897 38602456.74 10005267.95 8558106.333 4571237.761 10604946.17 9178283.954 12041232.22 11333458.98 5054024.598 2801235.139 8373200.004 12609210.61 14448639.35 5885478.596 26158621.62 11599864.88 10274965.67 8225101.568 3674644.881 15871618.93 8419118.435 13868176.89 12575911.19 8041576.461 11325019.62 7388423.12 12718564.87 10724418.29 9734030.748 10421083.17 7055171.724 5077216.001 7151038.099 8146021.975 8173503.701 6116028.711 7948335.553 7745583.383 6576008.558 7796337.35 4635492.34 7221714.511 7927744.387 7030586.172 10417704.47 7811788.393 7050316.712 6975515.94 8427301.744 10394314.24 5893207.725 5779556.249 8552905.62 697776.2809 10171659.36 7282185.627 7836496.994 2611058.906 6155818.657 8488316.171 8045424.43
MFCD00025555 188339.9536 268379.389 237077.3529 246749.3456 250152.6247 291341.0053 164580.3343 170938.4413 180451.263 171161.2282 210543.2558 170207.8341 175658.7817 175470.7989 168940.156 169863.5863 169521.5914 269075.6355 172333.1973 258828.9401 245077.7451 180808.8525 198189.3541 175771.0142 603711.0758 248503.8893 1208894.492 573192.1974 1969873.015 1691327.808 2817682.965 207978.2761 2059620.744 2012524.407 2038875.371 9721114.794 209462.1386 244444.2122 191328.6611 335394.6618 266763.883 244929.065 175035.2598 174315.2461 164344.3453 193641.9331 171879.8571 276042.5707 217124.1207 173474.9584 232095.6387 218517.4895 175269.7829 201858.4663 178383.8039 192873.4935 250238.5105 201592.4538 202257.8893 165173.3504 171688.0035 234173.0669 2155891.532 632249.4639 939251.0091 165559.4553 215941.5023 179486.5483 194753.4674 204028.2338 190218.0808 173793.2069 170967.3515 188560.3978 204572.788 179522.2019 248288.9679 297251.8056 173064.0159 1122367.989 203801.2244 235671.5786 986317.788 1062834.938 966049.879 485298.0344 505795.0911 5628984.506 280710.2236 3661593.713 523449.0637 1029642.268 1544390.725 3766987.73 6432104.656 3434162.582
MFCD00045988 975637.5595 672515.4138 642334.0558 557927.2344 608494.6767 641866.6184 548684.0411 658075.9786 551354.4275 560672.001 613987.9257 527741.5445 862213.8953 792859.9623 480627.8429 473396.3739 933264.2119 683373.3608 730723.9088 918504.0085 535240.924 686372.0097 642756.7974 694278.9666 3417625.396 1419903.041 824804.3616 1294440.427 512103.2559 640402.3381 1314674.117 1829262.352 1486712.815 1888192.72 1608544.853 1146812.317 697405.9725 410702.4432 622890.3545 517210.1503 627290.629 740021.5539 559920.8465 562248.1326 154697.4123 483200.9243 949454.8042 636645.6933 761802.8948 613950.7806 659825.7562 798044.9646 588949.8468 538375.1265 503715.6355 629116.1391 932598.545 1143638.821 1714523.555 812267.5998 597261.1815 3223005.388 1528711.348 2977272.485 835810.2041 803328.7346 394587.517 772520.6404 502201.7657 483008.3998 502131.0078 374353.5792 374928.822 563472.6962 884790.4136 365019.6398 494973.0046 765199.4206 828733.647 1107700.487 834385.5408 557922.316 632095.1659 758451.4446 1045480.471 564605.2829 631832.3375 656056.0816 45849.01751 546314.0154 763363.6359 936446.3684 265778.0938 872792.3891 1024036.792 834362.3663
MFCD00059633 4601199.092 6438592.494 2159920.082 4199611.366 6277222.478 7043718.44 4779323.596 7301133.71 2921127.778 5053929.984 8510335.849 8057749.318 4496507.434 8588569.844 2989746.948 5027390.696 8676808.676 8403240.419 3654729.836 6847110.316 3209081.709 4829750.193 8008263.673 8028143.167 3256369.092 6690837.6 2379941.528 3510131.748 6050852.894 6270920.638 3381509.015 7186786.908 3171367.222 4736713.038 4194447.846 6047520.76 8017611.167 3148721.013 10151469.22 3734496.267 4013972.278 8042464.487 4856984.857 8588692.585 1668094.422 3451110.508 8520662.012 5312299.423 9999591.479 3309122.108 4740556.949 7496710.965 4273847.139 8620810.737 3445056.429 4169896.851 7340458.69 4348732.442 8039269.648 3262704.729 4463625.53 6058385.514 2693851.031 23682429.15 2753507.056 4209499.758 2011945.8 1875257.937 1528423.422 1505840.686 1397525.684 1749783.881 1238227.905 1152550.519 1263227.454 1177736.68 1764108.078 313369.1734 1310552.862 1731085.704 1134082.101 280605.3209 357872.2415 895661.2352 741315.9336 758332.3469 428569.8403 282058.9205 764692.774 937767.8118 940772.8659 1126802.794 743867.3517 285018.94 210136.0856 273671.2386
MFCD00191654 352421.5013 340203.6505 313398.8676 376137.1805 356605.3174 384129.7469 335028.9048 424991.1656 323518.8035 253035.1093 357242.5117 301425.689 221948.0413 240597.8553 297828.3943 237216.8455 300455.517 346487.5818 303053.2178 272222.6563 315698.791 93877.03941 296780.1895 275218.6254 319262.1306 332982.928 125058.2805 263914.7231 258756.6403 304815.7102 189676.4194 274986.1648 243541.8578 252555.3479 256136.1316 222006.7177 427432.2773 415012.8643 442024.6766 376814.6932 395795.8926 346581.7702 292585.5754 260728.3689 304869.7966 284239.4225 328912.5504 250823.6435 389892.3001 342807.5674 349042.5697 295142.0045 275321.3364 305651.6558 340181.4312 117514.148 337774.3012 353555.5291 259253.6427 265380.1747 234180.7546 70914.03997 66444.82595 230196.2424 286793.7968 278216.0627 240767.8805 365600.9449 360261.3121 81577.37964 308358.8676 317939.4448 369277.4971 312810.6851 303159.9687 284280.5617 275141.8419 353015.2494 320340.3126 195136.3068 353607.9717 336232.0137 293512.7681 434624.0085 279996.8187 315556.9836 1998453.773 580624.3678 301515.3369 441845.5175 1688695.396 5841777.087 578271.9587 8110093.27 809819.1694 2079850.609
MFCD01706957 16325114.42 15328530.56 29312765.91 19020940.9 21604483.83 32205215.1 58840126.17 12369393.34 37381525.84 49255719.31 62144274.85 80457432.56 73782334.74 17906270.23 71314641.89 44468884.16 109314274.5 126996987.7 124829265.9 31791313.92 113725474.9 89000609.92 245961464.1 226435454.8 115899979.9 37189624.8 158852174.2 88377714.93 171379212.4 131403398.4 128653195.6 39091390.58 138774941.6 97318023.91 124962954.1 145817193.2 1078910.069 645056.464 774883.3175 785524.2565 962985.4255 724007.0158 807396.1681 784340.7344 348871.0101 809670.5603 682941.4491 2357880.752 1004353.827 699555.476 682943.2819 611368.9024 784250.3372 651017.6626 531602.3256 538434.1216 540292.2246 735877.86 700255.3144 552778.9579 792752.9475 519016.9944 540080.8342 642923.0588 596429.7866 589259.1431 730737.2986 1094878.158 896237.3676 732555.425 808322.1566 771172.4223 606510.0722 833781.4363 778226.4827 564246.9058 930706.6294 613981.9881 776952.3152 450132.6255 629585.5372 554630.1195 597855.5331 542103.6457 670012.7189 687008.9558 583955.2036 680074.4119 214229.7524 390141.7208 543013.3661 513514.1303 253245.1691 542591.7342 504442.3246 566824.1748
MFCD08277028 1735205.64 4087429.609 4376550.456 10118474.5 16278524.54 11577365.48 2820922.848 3429102.193 3954103.632 13817946.35 34334710.08 16171225.57 2992410.32 4120589.319 3626551.885 10882007.87 29271297.59 16081716.64 2351213.732 3917573.188 4467633.133 17682606.8 24526221.75 12892978.34 2199709.53 3230200.199 3637235.578 9232286.613 18628779.33 11459127.64 2109577.746 3051739.236 3371409.035 7857335.139 10447808.12 10697068.79 20615185.86 1877633.652 4773019.327 4220533.864 10863571.95 29187196.33 4657350.242 4577927.745 892054.1576 9047863.44 27762508.02 4067075.073 5090854.827 5860378.106 10380836.89 19526781.06 3713736.394 3796150.037 5234561.797 8286887.519 20089143.6 3353751.048 4611493.925 4119583.238 8550485.136 13145445.74 1648078.533 4425377.224 3641456.145 9002536.098 2689438.1 4626609.13 5874834.007 5883307.912 7564879.403 3126579.549 4413407.904 4348454.986 6901735.443 6065113.447 2803219.08 5819718.793 5273003.739 2940445.683 5513404.324 2672500.738 4386765.183 5221666.759 6150577.303 4010997.033 2557353.874 3896193.851 151990.0675 3757765.947 6230758.115 3165405.115 702675.9341 4179157.851 5780131.475 6276087.215
MFCD22416941 202252254.2 444785541.7 198828577 310021076.6 449477630.3 638006006 214359890 277467731.3 302578946.4 166655171.9 504762095.5 306643833.5 343939066.6 323123569.3 372638976.1 217982915.4 407169513.5 362037242.4 327169163.7 325293655.9 429175126.5 349205382 548672687.6 282828686.2 351635268.6 245888367.3 344345025.7 262910397 560597519.1 323508275.8 359333745.9 417340818.2 343935561.8 301576673.5 509282101.7 454821510.2 246033849.4 302959539.4 439270215.2 207441089 249407837.4 110727742.3 313696064.6 453192672.7 53752952.32 358273311.9 302748228.9 457191409.2 451743812.6 238280378.9 386018207.2 253985360.2 369480240.6 375938530.3 250321198.2 385071733.1 319236427.3 453629918.6 328384881.5 217142104.2 303631308.9 514732891 447946321.6 332680035.4 273112938.3 404624230.9 288174743.5 211556831.9 352091416.7 227201493 245455752.6 352022018.6 350204078.4 280186100.1 291392979.1 328284261 227430067.5 278389688.2 170698492.3 156534294.6 373742629.3 241691265.2 171113243.5 100569528.4 216476460.9 207492839.8 211521446.3 139726104 8158850.477 180742440.5 288819058.2 164194402.6 50232537.85 94988062 188657156.2 260374911.7
Microcystin LR 71483224.49 60102148.02 40224034.75 67350996.46 75603371.04 63316083.02 53911231.84 67479403.62 73599894.47 68448945.53 66175221.4 67809795.57 47160735.23 60758361.14 48677684.09 40596187.5 62717812.75 63610680.6 47077242.31 68316289.56 59266213.04 61479281.64 47413921.44 67969918.86 70154004.55 65564435.72 60575978.8 90812001.84 71696279.45 80493721.34 104479194.6 62173585.88 84156828.35 75130392.33 87400368.32 106839423.4 56269497 41281027.16 44768447.34 69753571.18 69568261.94 62358252 61955402.54 58041833.64 18677137.43 55626903.79 89440885.46 47636047.55 70520949.11 116237396.5 54965330.94 54029184.72 55431916.85 59175802.31 52390647.97 50114540.67 52458506.84 76040451.69 79522434.09 54220058.4 75346906.75 72938135.12 59963938.77 87087507.05 86475545.49 64140736.93 63745752.9 95065360.89 51741906.1 54450797.05 60789143.82 67243701.66 54854186.1 54146643.99 80695319.33 40280462.51 80241856.8 105186742.1 66505468.27 34394651.47 53220116.73 55383225.8 59750820.54 67256053.33 52614974.04 65926584.99 70112197.32 87569249.02 5826443.86 35568003.16 53860059.77 76625361.64 19289973.51 72680965.09 78608171.14 71312660.9
Milbemycin A3 24781548.71 15525445.95 23351081.26 14893206.43 23478230.52 10671785.14 12055462.58 25788715.24 16500338.31 19599446.9 19453367.57 22248297.49 12370684.68 20002479.89 14077275.38 6808353.276 16420609.59 20813164.38 10382783.02 17876144.83 17266630.17 13911310.29 10824119.1 20821633.72 17887832.87 9764082.935 10524149.5 27024629.5 12851996.63 24884279.23 19986719.64 14372219.88 23269009.26 13820796.04 13818976.07 30540543.96 16884505.7 9924543.47 14014406.05 20721204.76 17638215.22 8105505.217 23864188.95 14673809.04 3953951.956 18206715.57 16262892.76 16559753.75 25710746.92 22790769.28 16547323.66 12966091.43 21341702.55 11736389.69 13595595.33 16713374.3 17313414.71 11687639.66 17105730.97 10890566.75 19899209.58 15604852.68 11755692.41 20371591.54 16663099.34 14811227.67 19449426.94 42223658.97 17308129.67 12433740.45 14457564.39 12253979.02 22656616.66 15163763.04 36657041.8 13670054.31 26516538.37 16834755.72 17355036.92 9399998.198 14147891.99 11211927.85 19350366.87 19681689.86 14212638.17 11698743.85 14494687.73 24511591.93 633026.6739 7485615.495 11577635.25 17575361.26 3091053.202 16506121.63 21878340.4 16276235.1
Misoprostol 95882.22478 104875.4451 94152.1878 98287.84649 97516.50613 106674.9698 110101.1458 108106.5986 110677.6957 100360.6535 99183.23839 97345.60159 709431.46 144977.9193 260841.3997 304239.7674 524175.2011 803697.6914 2132142.414 861766.7394 1656522.759 2139225.019 1863622.98 2652546.398 2704953.845 988566.498 1522301.415 2067718.027 2414715.046 3712685.382 4046580.147 1635000.263 1978564.327 2251343.365 2432436.348 6149681.817 95382.33573 75646.13783 108307.9716 97912.02037 103475.3371 108843.8558 94056.72501 86498.2609 70402.98547 90229.40278 255536.9018 107906.5901 114436.22 327406.0075 211659.1292 436491.7032 385279.3704 187060.8838 1060642.098 1020054.046 734970.2735 900372.3438 425995.8307 698297.4115 924969.7746 896147.7302 474728.3236 287529.4616 1130448.958 1783217.589 93183.5074 95818.09494 98781.68293 94031.1288 102690.4022 424332.8699 125571.2861 254954.5931 324435.9983 333068.8937 1109666.007 935539.3434 1154143.979 409439.2577 947657.0248 5687720.013 3697651.85 4590901.882 3415765.91 3882134.771 5440887.82 4863420.252 304687.636 2730088.82 6177758.314 7955994.572 999240.0186 5615814.867 5226935.448 7903232.96
molecular iodine 7928108.148 22913216.89 14424004 8997504.398 12421110.71 22991349.59 2368944.461 13617190.3 12919438.14 3571721.486 1547076.922 2101856.21 6794361.263 16721608.69 15836069.69 4421950.305 3219690.524 7989359.809 9877856.216 19159559.02 26210652.02 20681512.28 7990534.295 13194549.62 12332672.28 13218677.38 16113946.5 20214768.11 24865076.6 25060553.29 14613493.85 20012067.64 19790093.74 22140904.65 17424832.06 38561066.92 18824971.32 1732158.226 15718309.6 18955843.22 19804317.39 402289.9375 820172.103 12569329.79 255068.0118 14027843.22 5661734.533 5379593.109 16509325.4 7026547.566 20793910.54 8786233.18 7267311.983 12704290.34 13192593.3 20786157.23 16179392.65 15037396.82 13790578.03 14265868.78 19119700.29 15873630.17 2822002.731 13169157.47 21502142.59 21717834.66 15468203.2 13213797.36 19676273.37 7267610.082 16733666.39 25565401.64 22674525.76 14008778.04 20417979.33 13167851.81 17935167.49 32316154.94 17433803.49 412108.6337 15357820.6 15659060.53 16409320.77 17617159.47 17363079.27 4382461.258 13517289.89 12470795.79 122733.903 1947894.718 12412906.9 14195584.77 297133.8352 7976425.995 12712127.3 16952587.78
monomethyl phosphate 6226173.333 36659324.03 29632657.29 42562806.29 28894283.07 30406229.47 37336616.33 41522847.25 33248919.22 40253881.07 31502427.26 26143196.21 7935014.527 39277113.07 33177014.18 33286720.29 30221739.25 25373954 21681410.54 32794535.78 28965952.06 35550038.05 16257266.87 23271745.44 50485612.28 80817689.42 41595139.25 53032106.23 24128750.64 16927672.99 24725619.41 58533918.91 31021070.95 33188789.75 15406377.96 16781433.38 27410447.84 26307304.89 34450983.97 25207980.67 25814433.68 37994265.89 41943381.35 52294709.69 16318426.22 36960916.69 34380304.74 51164978.05 70680284.36 25555521.26 46516343.51 27347360.27 46163590.15 68309975.69 25699946.71 42066962.97 121205567.4 72336338.38 72784879.49 100323600.2 88666527.12 80111923.06 50871330.63 59385846.25 50452296.28 64231688.8 80206506.6 100750908.1 107600792.7 77530121.31 98757108.57 36163911.23 50882191.48 37653892.96 74133966.81 80718212.29 10303575.11 26309436.74 32464380.46 39863070.66 21537067.06 8689185.265 16182766.82 11890407.18 10488648.88 20705253.59 27193868.05 20562218.92 11717697.35 17691363.62 33642648.36 20882411.72 17631343.16 14817266.18 19511736.74 14689805.09
Muscimol 1984136.708 6947114.391 5216344.535 5563781.469 1986529.568 5821911.277 2304998.551 7190508.252 7085566.83 3850744.09 3439933.022 2955925.359 3753086.236 5312832.406 7226425.006 3650379.186 3055846.314 5877786.4 3379480.132 7197438.894 6635949.668 4750992.394 3516015.04 4804557.15 3571774.668 6652025.522 5301436.311 1989424.481 1711825.953 3808745.572 2810863.013 4818745.834 4924912.578 3274959.786 1442359.918 4541729.295 9096787.38 1521317.358 1516954.973 1845753.993 2125525.652 7023590.009 1510016.099 1133021.452 451829.2746 4481280.096 9438776.911 3323223.607 1300235.932 2409729.427 2671143.355 8850103.824 1335789.451 1015922.963 3907990.252 3111674.951 8576425.556 1982590.84 1794735.393 1053914.693 4067987.72 6315175.474 2414801.481 1058460.973 2989451.164 3956875.57 1350872.233 1233747.713 2194624.724 1691204.173 2043315.255 1516621.293 1197199.755 2338177.511 2827638.183 1264929.151 1859623.69 1430677.982 1617378.959 1069574.76 2765939.653 1382281.167 1454431.918 3160726.188 2039307.831 2800267.329 1449496.994 2636706.889 509528.513 1434515.795 1616627.714 1463482.718 691916.7841 1326987.542 1627221.603 1524233.059
Mycophenolic acid 34860099.82 16166058.68 32241102.13 21480306.44 28074041.11 28076289.91 24407776.68 30149684.07 31144824.21 22613168.21 19416880.18 13000323.2 18144797.77 13891973.91 21697422.21 14215242.55 22420988.92 20649690.67 16426871.66 16412738.6 23950762.94 15896727.7 13716946.55 20036576.77 29517802.55 27491678.96 20960842.69 26580665.46 20804211.06 23937362.81 13353589.33 10968917.93 22035200.3 22076950.2 23581609.05 36254751.17 27885090.58 9761092.679 24057181.5 20991938.57 30778672.59 15140291.02 17118043.74 14838729.62 6453179.851 37921564.73 30736497.51 34859133.61 32197812.53 27209183.14 25139326.51 24713890.5 23354193.28 26339218.51 28372583 16308570.35 21351599.71 28327436.6 20107075.85 32087891.51 26700201.67 18143738.21 14608441.74 32026355.72 26084791.06 23290724.39 41460902.01 37810302.97 30801269.2 26604083.64 29160746.89 29831092.8 30867413.6 22287486.05 17419785.43 20416337.42 27793056.37 28003644.26 24780802.2 17129535.41 23990396.89 25428616.69 14063039.61 32538573.77 25453193.12 25448641.34 12866806.65 30327537.47 1242996.323 11783949.7 20377095.75 20606192.13 5592833.419 17289660.71 32878375.94 26795822.34
Myristoleic acid 3501870.71 2410135.732 3173515.855 2931639.104 2591812.451 2986543.019 2955153.988 3253792.999 3485506.688 2283032.37 1950063.996 2533123.271 2974634.52 2340355.967 2917344.502 2639141.561 2194203.718 2644062.023 2235412.317 2050479.934 2342379.721 1982996.476 2093609.674 2530943.012 3368920.719 2687226.223 2757461.588 3327144.239 2591265.964 2760215.575 2311554.866 2365150.446 2086484.931 2625872.467 2647756.17 1789726.444 2305204.937 2239279.563 3388350.351 2018693.525 1923202.243 2868675.469 2429442.81 1965268.308 2487127.327 2295768.378 3032004.607 2138186.009 3217331.795 2170480.552 2296944.039 1978516.483 1286181.967 2493377.118 1750712.013 2557668.198 2603175.76 2941361.743 2307805.617 3759676.146 2784319.439 1618482.348 1395000.555 1948903.918 1533618.268 1212087.43 2187581.412 2133812.239 2919891.58 2151714.618 3209580.77 2358401.435 1965729.799 2487017.84 1834111.144 3055371.121 2064463.062 2085970.51 2149929.894 1089894929 2417584.505 2244784.271 1964505.233 1981008.927 1867644.663 2294851.384 2765300.647 2362077.397 1390003.33 2241759.446 2966010.454 1820563.422 1156208.162 1601406.326 1572555.309 1547580.839
myxochelin B 45890.9559 212980.0138 32796.19867 213374.045 65984.26508 227584.5704 561164.264 483671.1802 232001.9058 466626.3408 786472.1089 1168388.677 953860.1059 741424.1335 53637.43332 1353929.451 2155468.259 3638738.023 1142281.489 960831.0465 370685.707 2671643.477 2038951.834 4066289.98 2791818.14 1804959.001 772374.3919 2339106.784 2314248.28 3721638.042 3213124.829 2100540.927 1823825.062 4028173.665 2481020.133 6941370.19 70794.50363 42433.82006 93094.77906 63143.60218 88867.38418 368586.2814 715917.9929 442582.8958 21728.69339 140478.6226 151420.158 1740826.916 823944.8227 364725.8707 438786.1335 1427955.007 1322814.599 791684.8529 231587.4525 69272.60063 1858076.977 2803361.36 1086958.207 745162.5137 1513721.796 1292174.667 891421.7002 1874913.882 430348.251 1614226.658 560783.7635 892214.3367 939186.4275 42184.7536 167241.8366 1495542.088 778882.8569 194535.7194 2159990.977 104689.2766 1455313.64 3407128.852 1203644.819 712568.8237 705107.0443 5755669.712 5130712.038 4019719.958 2916193.71 333777.7145 5225780.333 4654128.808 23562.87002 2423991.55 3272168.096 4200882.982 1442516.799 3140130.421 5320294.545 4635860.236
Myxochromide S2 14465846.52 13920824.45 16754701.06 12984186.22 17692711.97 13332661.96 11312903.36 13223302.6 11416305.87 10629354.86 15102084.11 10433414 9183852.655 8647051.508 9129232.208 7903348.837 13061207.32 10500081.07 7012331.852 9098517.905 10774885.94 9325476.773 9334578.388 10674670.52 14588526.48 10396067.38 9643230.062 15062671.48 12831820.35 15296158.88 9312606.893 6376950.301 15439103.33 13326693.91 19248264.65 18773468.9 12482969.87 5120091.981 9692076.117 10043417.63 13419209.96 9161945.062 14157172.35 10453278.69 2234285.611 8660909.057 11700855.63 13771881.14 12849051.88 10394320.37 9229027.586 9252400.065 10309531.57 11874516.34 11528093.21 9564799.647 8487344.035 12803545.91 11516274.08 11684448.11 10751371.7 8646649.816 6444903.479 15933182.63 16104391.75 11166589.55 14489745.31 16169523.43 11274764.19 12011084.81 15370024.1 13189733.98 13603336.37 8763035.124 15771843.17 7494198.466 16120502.04 12525891 10637491.64 7789763.952 10211893.75 10540124.89 9347907.341 11614604.23 8929694.652 12940194.73 7842550.684 10441902.69 581015.7902 5535175.691 10576152.08 9638732.713 2166211.075 10614597.21 16222644.67 14505735.43
Myxochromide S3 9663339.937 8392500.917 2808283.106 4432050.549 2232888.763 2818856.028 4414403.729 6918322.557 3514907.242 2965785.171 7683973.382 8504983.293 3719278.782 7711134.782 4230746.323 3228762.201 5609707.648 6836207.494 2016815.357 1331127.939 5916819.859 4692945.407 5426867.086 7976928.856 6389991.452 3949136.421 5967347.548 1743406.697 7616714.289 6668760.549 11059776.11 4563820.227 6536313.991 2829514.199 3290949.579 5119050.908 3900691.354 4298118.766 1490450.328 7202970.079 7106780.439 3770609.817 5641034.317 3134714.033 1509288.203 6105384.135 7145671.348 6087310.729 6199781.409 6852850.839 4307680.354 6157398.237 4487691.213 6789464.185 839626.9842 4262199.966 5701151.202 8240971.264 8509147.201 5264944.651 8764074.783 6159673.688 3358995.616 7521187.392 7772528.196 2901005.662 6330484.592 8728516.337 2867906.196 3340364.874 3818036.744 4095773.493 1723384.964 6698236.306 4061527.903 4715035.994 6023168.582 7370685.44 9104106.447 3288253.017 6398034.927 3408842.259 4690306.934 4222539.091 6655745.418 7584401.311 6825222.979 9187375.087 342763.6749 3855628.751 3995528.452 3549961.821 853127.3031 8064641.526 3886357.911 6508055.226
N-({(2R,4S,5R)-5-[3-(4-Fluorophenyl)-1-methyl-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)-4-methoxybenzamide 17288668.13 12712045.24 17145184.89 11259413.78 26271565 12967554.39 14361325.12 17471751.63 24429656.01 24357168.33 7421495.448 19920104.73 12394141.43 14799828.32 19576371.3 9980785.36 14158431.44 16998439.37 13842721.42 9427794.554 14254731.15 19850368.64 14993818.05 12997787.65 18275106.09 16591018.38 26671147.43 21495678.72 18412847.33 21035666.45 5678161.337 8531450.722 6963160.686 5860935.933 7602616.372 7494132.407 24694887.04 8103916.906 29827853.85 18385606.07 17470008.45 15723066.1 10825600.12 23807228.23 3433252.154 18237580.07 21099076.83 15805757.55 16825688.96 27109650.74 20737008.08 14858277.3 18365062.08 10677390.1 19671320.76 13944020.3 17311149.12 17738049.18 21060072.07 24859570.26 19512296.55 6485309.937 4738540.184 7247457.722 5547089.409 4301594.671 18715553.99 26304714.88 13862984.63 10207187.81 16029547.58 20772215.13 16302510.55 20165877.72 17902441.17 24527548.79 25538915.48 27125192.31 16470606.68 9457659.002 20003337.99 15965181.05 13983096.65 17199740.3 14818601.08 18013070.38 24139012.99 18651486.19 911979.69 9031175.976 19910656.39 4668390.616 1030683.429 8986194.827 5803844.348 3863290.675
N(2')-acetylgentamycin C1a 8399051.173 11054088.64 10168743.48 7251833.175 7792431.537 10163656.24 7942490.848 7444080.094 11860710.94 5407750.354 6843566.862 4605789.995 4138075.372 5888656.911 3157063.254 5549300.543 4858872.188 6829670.773 2095799.716 6009733.441 7870524.09 4259616.211 2546251.407 4065266.762 7018230.318 4443056.176 3738386.626 6454140.904 5536166.8 7135402.203 11307693.09 9281300.144 13831083.26 8610997.889 15632934.29 16398568.18 2530667.901 5467251.371 11408964.8 9076310.744 6537333.47 6518385.837 8479368.635 7855302.746 1077335.688 3801007.573 1665817.628 11367360.95 6960932.778 5764410.303 3834140.883 5551635.038 3927531.156 5484250.914 8845994.434 5991006.088 4765787.85 5256042.12 6933315.398 7790449.435 5393317.321 10950386.74 6388751.767 12270840.72 6295919.991 9962747.977 7667655.368 11197194.33 6989805.833 6183636.379 8685715.89 5084025.127 10925997.23 3797054.124 8988295.316 2403231.896 7813155.747 2152685.869 5400480.876 3375026.91 3453505.374 4400418.92 5968139.052 7489851.551 3434027.812 5044655.293 6085404.264 5276461.836 205599.4672 1416489.672 6733431.282 8222750.631 2060587.757 7190313.202 14569761.06 11494072.75
N-(4-Hydroxy-3,5-dimethoxybenzoyl)glycine 5258127.523 7445094.115 7074848.753 8396884.152 6619881.806 6865312.327 3394755.529 6370713.203 5786223.698 3927354.305 1461498.423 1511103.013 4746420.544 5801571.722 6492671.596 3516152.722 2210274.49 2886881.005 4074632.899 5419014.024 7213052.671 5502834.097 2010282.883 3179526.075 6223776.781 4349612.092 5260287.768 6728932.354 4080570.572 4289619.349 5934110.291 5981336.441 5980883.415 7751586.548 6873037.355 9332144.173 6729992.483 4337139.696 8507046.19 5957425.067 8650157.312 883848.6083 1877228.787 8624689.644 1156767.397 7462320.43 3557450.631 3763359.774 8650099.166 6017835.034 6732017.529 3111462.987 3544830.726 6990205.175 4771898.49 5780134.939 4369467.066 4023254.967 6914109.009 5235958.549 6434748.559 5456300.477 3935581.821 6643184.868 7992062.637 5991091.812 8683961.631 8319190.951 9564517.811 5600041.159 9161687.845 9691690.536 9184327.651 8288101.388 7420708.64 7060367.52 8589690.597 9960155.174 7722915.82 2849038.613 6633342.711 6565529.567 6677193.586 3710411.528 5009621.471 4118828.993 7058850.463 6540019.834 320362.3891 3691069.2 5289877.643 7050179.951 1105847.302 6398390.976 5532668.433 5192708.517
N-(tert-Butoxycarbonyl)-L-leucine 25489530.66 72692115.87 36860434.48 28124357.06 38535399.96 66794210.92 23722958.13 52776088.87 35257163.59 31356597.36 21146756.98 46708799.49 28837498.08 68218762.84 37423226.21 16634769.73 21205994.14 48418145.37 29300384.82 48305316.93 36032585.97 36802865.71 23103093.72 59712057.48 21135436.63 40034751.81 29306910.39 22020741.3 25274315.64 38754293.64 20112502.05 19516406.78 23580671.7 16062535.39 14273383 34823913.63 206018717.4 25521046.67 72919501.9 110542439.7 99268477.1 248491643.7 121318403 72415277.78 7115251.125 81553478.6 271716767.5 112759505 78041850.28 98661301.75 83871408.13 193843234.5 109194749.3 60574312.86 103712359.6 81746444.68 111513620.7 104296752.4 53764787.12 66311528.47 34431690.22 52963951.03 33066615.14 40414079.23 23817007.8 18897668.56 95108604.22 110932831.9 100960439.2 54234197.13 78654038.87 72371975.56 72855398.45 66061088.58 72164446.21 73041303.94 57381944.39 79597469.85 55490374.47 10012264.15 54370486.92 40907782.01 35601501.87 26638035.22 39074686.8 29929090.75 17964749.39 39468353.55 987930.2523 15613699.81 17628304.89 13524593.86 6315656.441 10439648.8 18261361.98 19798909.31
N,N-Dihydroxy-L-tryptophan 214485.6723 156139.2136 148508.6231 319264.6777 293156.5697 328463.2549 170716.8701 200388.2146 144975.2809 144338.8421 145913.9365 225236.5112 143238.5406 218787.7167 170621.7557 213633.7786 176399.9585 183522.0961 175600.481 176351.57 177213.0588 236365.4887 178018.889 172002.3806 272761.6863 167975.0698 166315.4813 162574.0144 169998.7098 341240.537 162890.6691 153656.9172 157154.0551 155251.4054 151360.3259 165895.8158 168366.6038 153475.9166 155946.2044 156920.5005 156476.5755 146486.4212 141727.8555 153868.7364 130415.8261 443049.5407 153035.9077 146502.4151 144655.292 294111.6548 367575.099 175988.1531 173249.4117 171226.7064 177535.7326 175935.2863 177634.5061 165717.1185 163564.2302 163994.9279 322370.2453 154590.9771 146896.5837 156614.382 161779.5549 157481.9812 2093686.839 894295.1724 13016326.84 2498478.185 2763876.723 2523110.565 759136.4442 11375139.65 2689346.017 2864992.835 1360121.057 1552950.125 11540849.4 1345135.766 2110139.079 1610967.875 863343.7882 11900426.97 3152433.046 1264254.212 920114.1251 817679.127 491804.9623 1482890.887 2144184.303 1318403.364 163030.367 9381692.495 2354898.84 1818473.791
N-[(1-{[(3E,9E)-5-Isopropyl-2,7-dioxo-1,6-diazacyclododeca-3,9-dien-8-yl]amino}-3-methyl-1-oxo-2-butanyl)carbamoyl]valine 126741078.9 94462073.89 136134135.9 112087961.8 121429053.6 63987094.73 71804264.5 104948840.4 119053657.3 102526627.2 81823225.54 105662671.7 56497118.7 76535473 70757262.06 53747529.05 65448842.2 79106974.08 58383318.48 97370727.7 96996101.14 69268116.95 43041098.21 99513509.07 110694016 87812130.63 70029691 141826661.2 83645182.28 129001218 105905040 40192860.37 83644793.08 101241643.9 100772557.9 158765785.8 87239899.62 46415454.63 40504876.45 111108413.6 119147422 101760056.3 104893044.8 83264794.7 13384699.87 67151746.31 93787081.45 99285453.52 97396854.71 100610037.6 65862121.14 83278851.73 82419415.05 76286880 72976551.3 53539296.8 62599746.05 104709836.9 70274741.33 92040370.96 113332476.6 37874138.6 46617537.69 99398875.97 103117370.9 66944985.61 82979094.84 205901754.1 68151291.99 68571422.96 74739617.1 108615527.4 67969124.12 62159227.43 125378690 50368583.19 160476777.7 100288404.8 111352914.4 37783029.31 68310677.29 59435259.74 67290173.82 109974703.1 72778102.54 96844347.46 94808693.39 126718213.6 3538183.313 28007428.71 56536056.5 51535354.23 13822552.61 105902696.1 115122106.6 69331981.71
N-[(2S)-2-Hydroxypropanoyl]-L-tryptophan 459405.4579 1383703.707 798835.2418 537523.8789 625905.2379 1624303.52 586571.3273 1431931.706 1042561.329 831226.095 1213127.309 2116397.419 1171136.275 2158565.161 1783338.291 887310.9086 1107179.617 2859453.623 1747007.226 2784787.936 2753534.016 2347898.96 1808043.642 3043684.026 1944394.362 2328820.296 2561156.268 1986017.242 2090636.061 2720974.626 1943965.055 2929536.218 2620369.748 2589864.806 2016742.264 4578515.401 2239052.671 607578.6877 1124666.332 2835686.871 2332289.738 2327717.943 1257481.075 1256162.793 698754.5521 2409268.873 3257029.198 1759639.143 1719542.77 4648570.498 3480321.561 3228817.474 1872293.882 2088983.949 5039514.375 4600096.581 4436159.166 2089017.05 2316104.555 5397648.258 4684132.668 4440191.489 1631970.036 2691368.75 5692908.038 5082119.365 894878.2331 1215511.805 1193909.148 515838.2096 1232549.595 2585692.384 3005326.55 1790355.284 1485261.312 1725743.736 4386056.524 6202479.427 3541358.098 1141775.546 3478358.604 4192505.016 5534086.029 3910880.86 2483572.835 2646446.906 4516174.86 4869315.389 158777.5831 1518169.845 3317247.235 4699981.209 1088778.481 3203887.894 2400683.192 3701594.219
N-[(2S)-2-Hydroxypropanoyl]methionine 1597864.432 2135860.054 2192554.008 1394009.016 1091841.195 1430234.763 1493419.398 2320615.31 2794594.902 1692670.601 1234547.359 1236594.562 3262578.439 3742827.92 4747936.955 2065171.303 1570324.13 1709541.776 5199965.512 6732035.601 9702948.88 6320351.064 2502990.642 2375408.177 6002103.195 5294376.55 7559638.059 4122609.154 2626330.461 2473820.973 6079473.258 8566478.813 8713221.257 5433954.672 3655307.703 4529908.844 3332886.339 1322521.258 1299979.781 5872824.767 4772388.925 2402862.201 2210041.159 1632164.652 1049288.147 7140783.371 5846115.469 3651479.158 2622249.81 11016930.69 10124414.77 6721158.008 5611909.822 3873606.982 15803578.84 12888178.74 8729326.253 7648817.863 4169926.404 14844010.8 16128551.46 11007669.08 6502557.419 4979201.537 23049340.75 22968564.25 1753037.295 2412146.085 1918140.156 1021533.237 1930503.776 7880785.952 9288727.287 6486633.333 3742224.471 5806237.868 11256563.24 17917400.61 10888162.18 2276326.71 9609588.066 10977954.98 14751453.9 11593765.4 6138837.645 7069441.684 12151508.01 13761947.75 587912.0076 3754137.391 12939381.75 15254218.69 2716193.913 12754475.54 7051948.749 14452027.91
N-[(2S,3R,4E)-1-{[2-Acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxy-4-octadecen-2-yl]dodecanamide 3745946.054 2480943.122 4272288.405 2490709.381 2485834.928 1958414.636 2507908.375 3233015.988 4231596.109 5113877.004 3961620.71 3898273.847 3498108.532 3185293.421 3580876.857 4032432.743 4299398.618 3222226.925 2876201.376 2739035.035 2962591.245 3522261.998 2994642.08 2609293.443 1942454.704 751094.2572 2198907.189 3834000.824 3500873.804 3379726.653 2704190.654 1755716.009 3627855.893 4075676.978 2191369.485 4994606.622 2652287.622 1370166.836 1071330.132 3199387.803 3752628.209 11897476.39 5268701.49 4583389.548 4364268.416 6183550.371 13149715.66 4642294.792 4680377.33 16178622.52 6833498.121 3530530.377 2832414.609 3398928.072 9377211.663 3772413.799 5359908.917 4321658.44 2863596.189 9534470.563 5645460.028 2832201.348 434675.0346 3693675.637 5422744.044 4236286.285 3350477.09 5212586.972 3368824.48 2176458.638 2665229.818 6008499.594 5276407.139 5645686.745 5281490.42 2734325.419 6950898.099 5833555.854 8818255.143 2074806.725 5681866.592 3685119.904 4271726.442 6270591.489 4082678.032 3636322.351 4157411.296 5066441.57 620166.1446 1610910.869 3082563.389 3027479.512 1395568.273 4891328.784 3342449.774 2664900.133
N~1~-Isopropyl-2-methylpropan-1,2-diamin 93012065.65 129033701.9 102878480.9 92151514.89 58618175.54 160321084.8 84073394.52 111070723.1 106721599.8 74376943.16 45569304.32 121985537.5 87880120.52 108534046.8 113707362.6 71198090.46 47572940.59 111963767.4 87395815.62 115705573.9 101690127 86091939.87 54056813.33 119110251.2 95463471.64 100249856.4 99661877.84 87008166 61847401.82 139442379.3 88922672.64 107367980.5 100476096.3 97193853.32 61287934.82 142897625 388970.0329 366584.3896 339677.0321 378397.1746 387549.1294 354431.1343 395586.5915 312379.06 204185.9467 323032.548 336855.9178 378764.875 362285.5664 381636.8309 409374.894 373231.1969 402461.2328 362268.9237 396876.7471 421455.4824 421820.5766 384827.0582 402535.5861 355252.0183 394493.8066 368293.0476 345818.8703 394814.0364 481782.2305 387071.1902 329476.4993 359140.6669 382470.4973 262694.7992 364404.824 409055.775 363077.4462 333704.9695 375005.912 332158.2199 380462.0792 405729.99 344393.4171 362503.9837 369440.8541 337413.6012 355682.529 420965.0989 383302.0217 357344.8143 353173.0351 369693.6482 210625.3794 288783.0535 393847.3309 387674.3118 232085.629 304943.6416 351473.2818 398119.1866
N~2~-(1-Carboxyethyl)-N~5~-(diaminomethylene)ornithine 330667.6726 1259670.044 696663.2794 775307.1618 298611.8842 359767.0171 386131.8479 1608811.377 1917987.138 2064672.138 580585.8459 626407.572 1760767.639 3196466.056 3649976.879 2312025.905 1189596.021 2602187.154 2911889.306 4394887.251 8575139.364 3970848.615 2254936.796 3884151.717 3609285.21 5979187.954 8367581.542 3940018.177 3483719.876 3475291.908 3035980.549 7415293.78 8211178.943 4304597.039 2717837.147 4479104.783 2014824.714 337478.9183 384500.5911 970714.1799 1007808.579 3312574.713 622800.7247 1055473.497 1402932.717 3241739.22 6613707.908 2337822.508 1835530.638 5825311.965 4667009.797 7784769.096 3656395.559 3754402.311 8169944.085 7537863.986 11851265.44 3863178.701 4276818.862 9619336.227 11496222.12 13121948.01 5237230.859 4432698.627 16614178.14 12914946.15 403232.24 448993.7485 771923.0256 316309.2308 419572.6143 3485587.56 2706436.659 1642117.28 1724775.672 1498515.598 3983793.778 7652549.721 3566967.89 1980661.175 3464967.429 6642725.656 9943199.3 7590226.25 4571058.087 4553968.97 9812152.436 9333126.795 1821180.929 6796227.443 6504253.286 14374685.34 6390994.127 11137433.04 6924438.552 8428006.237
N~2~-Acetyl-L-ornithine 7772484.588 17072612.77 12238644.21 12287104.36 7285597.586 7908942.715 12520644.36 14521112.63 15335211.02 11116443.4 11918297.6 7564744.117 10645180.34 17777850.41 14059811.99 9561117.991 9573777.594 10431809.13 8698735.207 16042034.37 16312328.85 16733291.2 11779833.23 14011704.35 8300679.886 12330456.37 13407808.62 13732733.5 11160299.57 11322985.04 10823309.88 14499688.53 12724092.16 12429881.35 7882306.928 11037819.42 12660318.06 18307679.94 10059460.95 15457135.8 13259549.81 13663834.34 22711856.86 10137466.93 9480735.053 13870293.82 14028615.64 33292649.75 13583073.71 31258460.1 19656876.27 26407068.22 22985630.42 12934937.49 50553643.25 15981694.1 13740412.58 19239419.87 12980506.98 19659546.37 16148458.36 12651766.96 17223896.86 12283050.27 17904844.46 17186529.09 11889232.39 12625471 9742116.191 11434275.24 13920709.39 11038124.25 15230276.42 13349909.12 13062383.11 11088594.97 13252432.33 14637131.66 13093855.65 8448544.278 12499794.88 12366759.78 14355646.68 15611696.51 12563806.39 12236537.71 14975443.98 12831340.72 6145383.074 9838499.105 11494208.77 13866813.57 6030314.665 11076218.64 13346807.07 16505665.45
N~6~-(2,3-Dihydroxybenzoyl)-N~2~-[(2,3-dihydroxyphenyl)(hydroxy)methyl]lysinamide 35337.49302 48241.45226 39187.61001 40508.45893 46335.51745 64232.51201 119234.6906 366205.2627 1458074.253 306140.9047 83739.97263 1107547.854 6677939.525 3973530.305 2464535.37 4415951.987 3450198.591 5430541.087 7047881.97 5066680.992 5242004.314 8407743.273 10555709.06 3229011.697 7377763.573 5568444.291 4902238.263 6884059.213 8242429.721 6997501.134 7655817.716 6834958.572 8163783.159 8468124.687 8840483.506 15123884.75 53114.79072 29208.02854 41959.17795 55687.35669 46117.88026 812171.368 348624.9198 62683.42223 44272.67227 1036251.794 2948625.468 2407312.951 1523530.892 4769105.324 3219910.768 2464164.256 2953486.535 1883477.166 6011782.854 5638252.546 2836787.795 5676638.855 2649923.122 5248356.292 6289165.737 2476923.66 1721347.92 3607289.96 4933919.424 6749596.646 1702982.344 839498.4616 910215.5967 45738.14731 47248.59049 6684917.852 5429359.697 7375091.752 4959368.237 4899020.375 12505662.5 12324293.53 7488632.592 6182883.128 11100808.16 13509974.43 8548424.613 14863904.3 16315754.17 9346180.418 9075648.8 10261890.58 57011.01899 12571834.27 14056451.69 7891405.078 2735251.549 11225348.34 13403124.96 15048527.45
N~6~-(2,3-Dihydroxybenzoyl)-N~2~-[(2,3-dihydroxyphenyl)(hydroxy)methyl]lysine 1114808.94 1828360.62 1627631.625 1901501.027 1839842.186 1479163.951 1060602.292 1429972.401 1600201.504 881313.0456 381760.3453 643499.8901 1109560.116 1105705.831 1625655.675 661619.142 616124.4075 920718.7008 1166150.76 1333820.274 1679451.095 1447202.935 482971.8293 921390.7906 1342482.06 1129613.889 1635891.476 1786101.982 1232339.55 1262649.251 1162277.88 1400346.322 1523596.251 1952617.838 1414626.685 2452196.607 1484900.284 1452463.923 2202169.028 1202635.679 1872182.159 159099.5718 866621.0189 1883846.452 241974.1345 1546321.01 923732.187 1148326.002 1383533.316 1000684.397 1624590.257 974119.3865 1002748.302 1455850.616 1140744.5 1267632.038 1143503.831 1308732.232 1632452.098 1007859.8 1133529.288 1634109.517 922186.1616 1413738.95 1403634.624 1332127.604 2026948.746 2001229.115 2103014.311 2029901.533 2432021.042 1965277.381 2084776.839 2885193.684 2163466.919 2284668.507 2263765.963 2075301.816 2421944.893 1284183.142 1564086.481 1882183.671 1759103.99 1991685.359 1913374.025 1268279.331 2030937.607 1822860.167 72919.02266 1475873.459 1448951.91 1372070.797 324055.6658 1528066.175 1504431.132 1406727.363
N1-methyl-5-methoxy-2-({2-[(methylamino)carbonyl]phenyl}thio)benzamide 218132892.8 109759477.6 568800418.6 355307893.2 1309988035 1652442026 218768650.6 92401128.57 495835909.3 234782606.4 1057131657 1110682760 266016725 93419157.47 469461498.5 251728639.6 1085853700 1433582500 225735270.7 64992596.5 504779527.9 343569074.2 998286319.2 1261818455 211494608.8 45181337.72 391909633.8 203721254.5 1298994271 1351079612 204807741.9 61341218.28 392822250.9 239201162.1 1124505425 1849049715 404980.4224 295935.7192 405487.7009 340132.1661 402542.3635 295111.7843 296203.4269 348641.8587 182493.406 374754.0245 308677.845 315284.7554 405333.08 280708.0794 310091.507 303545.19 333007.8595 285336.0384 347578.4405 329626.3582 267197.194 310068.9017 339017.3548 308269.9537 315486.7111 286992.3078 271213.7214 340632.1948 282736.7037 320759.5342 715575.8225 403559.0687 575452.5369 315730.7073 1339708.962 711100.3677 770032.4946 690905.3506 372851.9979 881999.9575 342377.9808 354409.5669 363470.7776 542538.4374 273453.7181 279736.3049 519770.3616 306177.3296 354832.8991 289733.1986 356737.6195 319881.032 162783.5197 435461.5902 330535.2409 996402.9901 183482.2499 271238.0846 318187.227 336800.4003
N6,N6,N6-Trimethyl-L-lysine 30039497.65 16155939.77 11613241.32 9604642.245 63261472.57 74081370.62 10057589.4 15097406.53 69334206.18 3375502.125 1893923.677 25420449.02 13505661.25 80676203.45 80995532.17 38735770.81 25474099.74 36474077.57 8697855.118 14147255.86 71107155.78 61309787.63 26581299.19 53005435.13 81949083.64 64792184.15 65184050.22 69615213.77 51478870.85 71609482.79 87975500.67 76051315.7 73276279.51 78596144.99 73793102.67 95026930.59 9012635.228 41983078.42 12244705.22 72361840.42 17021728.75 11971598.54 6101387.197 92208835.2 11378393.04 83056849.27 44450909.22 46823290.81 84915103.44 52650168.74 82968091.4 44208255.28 42033436.82 69631239.35 47232846.17 75156592.33 58962802.55 54672208.45 65338888.33 54557797.18 66538924.16 64883825.2 43503348.59 67657633.31 69631903.73 73697235.95 80880831.95 68349354.7 62906423.92 42384146.91 76605524.35 57192663.26 67740138.03 47068697.53 42876913.31 47363541.4 58540709.4 65288926.74 60264719.7 24956245.47 63505078.53 63800790.04 59624852.55 65929118.15 37124785.94 28406033.03 59574430.49 52274084.96 16661376.75 28841796.69 53235809.27 62121943.46 18445686.1 44127037.06 43673417.17 60809971.19
N-Acetylalanine 5636574.613 9327402.168 11998374.96 12392915.41 6944773.736 1907747.424 6997994.217 11886545.06 3920472.445 10387622.4 11785520.18 5410735.677 12761562.19 10789108.22 4157806.75 15237386.21 3670887.955 3954538.478 3223683.154 1638910.792 8661407.171 4931252.466 3982745.869 7406338.738 8968956.256 4537976.16 4238276.964 4347059.355 4785537.742 12208971.39 8531969.598 4396141.859 2275936.902 13524981.49 8349030.678 6248413.977 6543101.168 6103666.738 3446838.994 6835010.553 10525806.15 9060502.815 10211526.26 5465453.579 3379534.738 10348837.36 11222823.03 15529198.75 3707184.787 3955561.875 12480519.79 3167975.712 10201598.81 3394616.148 4184451.303 6061198.188 3230188.114 3925872.337 3372821.146 16777633.93 4420876.333 5922676.674 4001842.773 6057528.56 5914973.74 8516191.601 3469262.647 4356503.286 4557397.407 14437654.06 14450884.45 5099081.583 4421072.993 6058382.487 13457694.92 4371384.099 7278352.6 8221793.748 7834845.156 3529303.856 7130795.014 8070000.451 10240976.17 4676392.812 9413503.712 7548010.645 8581098.992 11799071.52 2656219.763 3162296.431 4235464.585 11834848.3 3051420.023 3860601.327 11925047.1 12347118.93
N-Acetylcytidine 1962199.246 1804152.264 2142494.329 3575187.586 9517071.542 11870233.73 1688185.089 2093701.86 2318026.43 2912689.777 12285081.59 10017534.1 3027288.394 1706720.628 2581346.613 4403703.019 12674501 14650323.51 2798035.432 1643786.38 2643864.292 5486158.439 11739072.87 13722323.86 2647085.962 1189386.573 2110907.986 4531030.308 11163314.02 11820206.97 2583762.76 1428082.323 2439461.621 2956230.432 9079102.194 17565809.58 1644255.828 1692958.26 843981.4981 1725094.158 2081463.454 1329853.768 2098972.326 1008907.701 430782.6903 1272396.27 2012513.496 1705502.077 1227535.702 1726747.19 3377921.072 1109568.374 1499263.817 722142.423 1779994.558 1349638.216 1624056.913 1394262.74 650988.8563 1376186.625 1653209.03 1474033.255 1738513.7 986699.526 1653422.737 1443079.847 6631579.472 4285301.729 6216943.721 8003006.587 5003876.409 4978116.286 5081195.086 3757800.65 6136527.052 4854582.16 6893406.548 5785171.379 3943554.092 4019169.23 4017458.724 4823330.767 5959544.801 5275384.945 5042705.031 3769136.497 4795349.502 5978401.172 279085.166 5222656.224 5509438.22 5611162.374 1388483.027 3643893.807 5914881.81 3824286.506
N-Acetyl-D-alloisoleucine 24520979.01 31412453.26 65274114.97 58387807.26 18574426.2 23976653.87 27012361.31 22711694.5 50409119.3 59803664.15 27954034.66 25311917.11 31707036.76 23586012.85 44580686.4 40830495.23 20555899.78 23944181.98 22585097.19 17805900.87 37280361.99 56620446.53 17208982.15 20137458.23 18948136.33 14711988.06 27966811.36 35674686.29 12276744.54 14345453.03 19283139.12 15438886.61 27933811.19 27912519.09 9288345.594 14594864.36 51519885.59 46251266.41 23969642.93 65230729.92 82559284.46 45454272.5 89777991.09 20319393.32 10419407.27 66077499.19 51668106.06 85600586.13 22632043.59 58034955.28 60717440.42 30034793.08 55653899.35 13271629.99 41265241.65 44232108.7 30681527.19 50743672.35 13027075.85 35723583.06 41490590.51 20873086.33 25851382.8 14214288.12 36844690.32 38063976.68 18936478.93 26378773.03 30075999.9 15974248.17 28036362.02 21140473.18 26887215.34 22312111.66 18119013.01 18223134.69 16709204.55 24350083.44 19463369.31 6818968.939 17610900.76 13107832.49 19864302.39 16754116.86 12037052.6 9549432.866 12414401.32 15009848.91 1452508.315 7224754.933 12456480.41 12676873.15 2804616.396 11816264.38 10846027.31 15061866.97
N-Acetyl-DL-glutamic acid 1780166.728 6542008.266 11166047.87 5001851.899 963601.1484 2924808.099 2073198.026 6079555.832 10369117.2 4528506.717 1000158.858 3160669.37 2948149.751 5934209.826 12160929.2 4857741.403 1177417.149 3404334.372 3632444.534 6742627.626 15541722.25 10813601.57 1589872.703 3958187.1 3801125.346 5470688.941 19256317.21 7073690.56 1717157.714 4195811.105 3249241.507 6848719.505 27160689.11 7760533.565 1937067.092 4487914.519 4145154.173 4819909.728 1167931.143 5793459.88 7546643.227 4111504.736 6940347.618 1127122.812 1495407.524 6760954.718 5831012.53 7848460.879 1638961.837 9309369.002 8573669.76 4765988.313 6598498.301 1815328.76 15185698.75 7621913.305 6080889.532 7100493.779 1404936.376 13399987.27 8350537.514 4598799.427 5101168.621 2031008.694 15827539.69 8732366.402 4699794.4 4431038.239 7014400.13 14650797.41 5494666.087 4023516.82 3729415.506 3290268.785 14092351.21 4267569.932 3641705.083 4877891.964 4594195.03 6864854.356 4204036.811 3501414.106 4047170.512 5777229.534 8256986.764 2797545.326 3785714.9 4220755.494 140891.1564 10001988.38 4418061.53 4706602.556 772587.7688 4184146.931 9970116.779 5261299.378
N-Acetyl-L-phenylalanine 30671604.88 21191590.63 24531027.82 38531879.17 29920020.61 53090162.48 28969990.74 16048850.84 24268417.51 29972169.38 40399679.16 48502131.15 41820073.06 18864672.02 26424242.94 25343078.26 40906428.04 64085873.99 34028327.25 19419944.96 27775721.12 36987242.73 34640406.06 54315951.94 29361148.55 14914160.54 20972342.93 17181658.01 28213662.04 45241814.34 22187066.26 17445487.64 21433742.25 11593897.79 19340119.36 52472185.21 25116100.34 40749681.63 32423180.56 38103838.63 58339179.3 23007260.22 77789138 29879183.69 6360485.417 49115666.05 28518194.56 80411539.29 34150043.63 36679590.65 61400610.54 19781888.77 57419447.6 29083385.99 38163858.47 50500075.32 22956548.05 58650348.09 26748562.25 31552749.52 47568295.17 18447874.81 30645706.12 25492953.08 36214433.26 45268542.41 21796693.16 24610531.03 26004067 18801340.44 26987912.11 21628222.53 24698773.34 17783956.32 22913388.38 19099369.47 18978879.75 29660999.28 21259671.7 8615632.495 20042347.63 16736676.43 24177193.17 20270745.11 18218707.73 12559537.66 16830142.23 19709248.29 796163.5148 11518682.35 17025484.28 17989449.85 4249028.81 14406813.23 18089639.8 19718827.72
N-Acetyl-L-tyrosine 3801922.08 2384544.839 5685124.028 7560016.854 7946000.169 14245774.57 4062300.11 1836322.077 4824179.467 6594852.291 15456339.23 13741339.37 5872445.09 2543745.122 6332298.013 4475347.086 14597920.16 13249541.59 4781920.861 2653067.396 5094239.636 6065279.203 17308541.84 12710002.52 3567117.856 1682008.949 5090045.07 2790418.99 12570883.14 9875557.318 2622492.395 1695677.776 4231164.164 1539690.5 6663208.205 13506987.3 3502943.756 15537202.48 7106698.133 5280106.129 17390687.38 3516510.924 32170283.12 7656742.648 857871.971 15839237.89 5254054.783 33477854.76 9711822.106 5303559.174 17115256.43 3264470.813 23722771.89 7092580.921 5115510.458 12505688.18 3668297.143 22407153.04 5974962.695 3546361.51 17243585.23 2536365.276 14396462.08 8693714.364 5604215.815 17609395.95 1809353.575 3398327.94 3180704.797 1654264.357 2736852.305 2804066.963 3502405.757 2096112.37 2430828.976 2235654.421 1517018.097 3195773.905 3125623.491 871618.6942 1669037.538 1465218.331 3188950.492 2802393.242 1642558.711 1476577.838 1769940.591 2838179.11 265647.1925 1158887.915 1818687.906 2034542.105 701236.3027 2206270.641 1822890.669 1837280.722
N-Acetylornithine 1987597.113 1906976.81 3385145.402 2839982.424 1672535.214 2459837.032 7608616.159 3192585.789 14352004.21 5369167.58 3633086.287 1416407.538 32224248.18 24517068.34 33146143.77 36372882.85 33198587.79 22020959.12 24234331.31 36282950.84 22487383.15 41529926.29 60554561.26 60237145.43 10888918.38 19356433.64 8959674.447 8168747.608 33004476.5 20132287.32 2992324.765 3089546.136 3959804.529 1675746.726 1181494.02 2129853.025 1900629.297 1702346.799 1687142.271 2061003.146 2627046.548 1467139.108 19611050.1 3034562.841 4823452.966 19899297.53 30397019.66 72979328.1 34510275.96 146703889.3 68373293.86 123029399.9 40163833.51 47263388.44 152794027.9 41063532.09 37361058.09 17323198.07 28816857.78 41521366.74 7946879.715 3381717.094 1760654.994 2105263.056 4398210.078 2534806.138 1577000.193 3657225.692 3377373.538 1122524.394 2019865.581 1550350.921 1249963.065 1463035.245 1419164.005 1043093.446 1525986.961 1475475.069 1656859.363 791715.1969 1022957.697 1060059.767 2250341.828 1382226.211 1308200.631 791035.7378 1184092.965 2042872.225 399550.709 1534351.328 2056123.932 1204452.475 753077.8357 1229715.202 2464132.333 1200809.566
N-Acetylvanilalanine 597781.8016 2222690.739 2471605.266 1157274.04 918536.5064 2565929.81 818565.1284 2716598.489 3397163.869 1666405.948 1952544.658 2564720.423 1386082.198 3348167.477 5219030.929 1699181.283 2157886.441 4021019.013 2274518.726 4913989.805 8271348.403 4487274.685 3407862.254 5035589.427 2757406.064 3348182.012 6240352.247 3694615.659 3897441.945 4795547.197 2678356.26 5040379.66 8115272.499 4955721.158 4346670.144 8240135.423 4300636.876 1414225.034 1693900.167 5220601.663 6402419.494 3842415.821 2333843.57 1894341.429 830034.4712 6009754.704 6249729.969 3466051.978 2489120.756 7635105.504 9100544.651 6412423.7 4472571.107 3352375.605 9118066.592 11061873.07 8349776.693 5407362.524 4158192.706 8912531.146 11480909.54 10296843.95 4392111.872 4037585.996 12277710.02 13289933.16 1158976.117 1736400.714 2174368.786 1248485.188 1827985.229 3950814.066 5332070.569 3002733.657 2475566.933 2937625.745 5648841.723 10046435.96 6885246.868 1604173.213 4805931.236 5752003.274 8688584.25 6330786.38 3573956.838 3671523.83 6908342.317 8763387.233 319302.1099 2251693.58 4868145.067 7404798.446 1653780.37 5448540.828 3499068.784 6029353.057
Naphthalen-2-amine 7783570.52 11958987.17 13120318.99 9803078.411 10151838.5 16105663.14 7951961.985 11269772.05 12419417.8 11132590.55 13754279.1 19436124.64 13306680.91 15145360.54 12750092.73 7181818.443 14396290.97 22897205.49 10370143.72 14845355.35 16533037.68 17944062.84 15478681.26 17369992.65 14816397.63 13513785.82 10937451.45 10926888.05 14206973.92 16703684.43 10163335.91 14998813.72 17482053.2 14851463.54 9614749.171 26396737.56 15142938.72 6741773.605 13691505.61 16144406.14 16817847.19 9871661.513 16920644.6 13781383.37 2467079.548 15471928.45 14737033.27 16267258.61 17048600.75 17420495.19 17304715.24 10992564.49 11571823.96 20829651.26 19234825.21 20301548.5 13567416.14 13878211.96 5085126.292 16154220.96 20966345.01 11566603.81 8142461.765 19176700.91 20287118.38 16270389.39 16742435.59 22606219.81 29958369 19312587.51 22095187.17 24956728.19 22238020.78 23159320.9 27753334.93 23038030.04 25052912.52 29239526.01 20466244.1 10328973.49 20486611.26 17635558.26 23022064.88 22536035.89 27782225.4 15812500.7 22741058.93 21669392.59 1043433.742 13148416.28 24051918.06 20900997.38 4292539.206 20443194.94 24426275.32 26176549.42
N-dodecanoylsphinganine 922230.7003 873082.6119 854025.8102 885962.867 767960.1576 893532.9312 1255386.409 991177.903 1633608.259 915497.9877 1021695.62 607790.6276 698986.7719 900448.7386 761080.3309 673579.3318 1047701.378 844030.9661 749256.7801 804666.5224 841854.38 873669.9077 746306.2448 861809.4517 972358.683 899182.828 700637.092 1019741.797 1174344.295 1013399.226 818232.9905 1389908.931 889223.6972 732508.0891 4851347.983 1168164.239 647490.1525 446670.2879 989331.2596 723406.639 1034371.997 732722.4939 757659.1695 716399.7235 374354.8203 962584.9473 699253.7562 879024.7285 1146189.746 1036038.465 780887.8965 685741.1874 842421.2011 1226275.713 795328.6549 653485.924 1047212.593 1100597.162 716232.7774 1050843.578 1103689.126 3802583.544 1375138.707 1220248.21 862275.4802 670746.5646 595132.6015 1090489.652 878864.7668 751565.1894 744633.9988 859050.594 1018054.945 921579.6835 1215217.489 918878.6845 770689.5353 1030305.908 774181.1031 472337.9862 1529017.417 738561.5302 652042.029 915279.3144 833885.0834 826261.2865 1106557.715 870448.4207 313310.697 854472.9645 1341420.993 969303.4947 616539.5879 7084297.57 1716477.026 2139697.941
N-feruloylglycine 1261259.8 2183674.697 2510185.192 1211482.397 1457803.902 1606142.91 1654004.821 2815530.935 4177805.584 1718970.249 1796856.266 1672062.119 3297561.202 4383206.804 4286671.29 2182160.406 2479336.076 2416821.222 3018765.253 3957500.152 5378802.835 3361658.612 2705316.833 2302989.153 4182827.096 3528088.747 4098193.992 3914030.5 3870253.969 3345768.116 6486352.85 5140537.039 5586527.317 4833534.145 6142305.09 6924915.008 4539340.053 949446.2501 1930357.094 4851809.232 3352175.245 1351491.743 1762129.986 2331670.003 632918.8193 4174317.111 4490406.899 2472273.939 3424492.392 4033671.75 4752877.273 3284886.692 2447274.172 3121877.422 3910488.946 3816213.225 3487363.123 3036823.727 3342931.623 3857292.163 4345370.262 6084866.745 2697982.744 4470560.006 6924924.632 5248406.582 4056936.67 5432360.147 4947364.855 2076779.42 3415941.966 7535157.034 7841505.898 7850914.914 6675562.13 5711150.556 8201802.485 9252558.512 6442447.857 2026614.287 4611850.945 6009998.955 6207835.996 7193280.765 4946878.614 3755693.683 5991844.232 5847173.268 202109.1183 2918825.698 4366314.825 6547926.421 1090255.266 5579495.859 5232994.084 6383316.078
N-Formylmethionine 15987039.52 18739761.73 39484985.34 36596124.97 3887879.998 3148265.905 16068002.1 15692586.39 39171866.62 37067483.43 5958096.521 2622345.407 23083052.24 16688887.19 41982293.91 41576818.43 3605105.573 1821636.597 20637593.88 17160480.51 46678843.84 52193447.09 3834936.695 904596.8644 19215658.93 14215785.68 38274014.25 31042585.95 1616820.166 1049265.333 17437722.39 13702681.46 38768648.24 30970515.59 3364259.881 1097912.528 20437993.51 21042802.03 12590524.37 32515869.23 22217170.32 20631699.22 25223679.51 11230981.61 7660817.812 19220914.32 26210974.31 28632532.24 13154984.3 37063102.74 22721820.63 17137644.11 21094758.53 12649301.08 32708227.21 18922473.27 20206629.92 20177388.22 10197002.87 27503703.32 18407083.7 18160363.42 19060620.03 10916161.17 31528055.12 19634905.69 4373244.765 6641333.956 10408809.69 7443108.012 7309458.283 5078376.776 6046076.429 6462404.931 5705756.959 5160430.666 4998141.117 6989726.172 7394183.065 3147268.896 4784931.895 4315752.091 6521729.081 9014725.323 4807304.276 5003539.579 4007239.969 8085488.984 459312.3162 4526927.493 5230781.065 5518915.99 1362234.194 8015612.181 5899123.986 5793598.68
Niacin 3342379.209 2435499.093 2640736.196 1485438.136 1004300.899 738441.9109 1305537.17 2740241.034 2346204.208 606008.0809 1594175.157 1286676.678 1369063.07 2878402.485 1723239.159 1545003.325 2444658.747 876592.4255 1147968.634 1820482.382 972891.6692 973796.7499 1374269.454 1354165.87 807935.4314 2178643.226 2522980.269 1345780.115 1921050.601 1677724.852 1280316.679 612883.7084 994609.9183 1243463.291 1628762.458 2198427.157 982092.2689 1036552.135 987966.0032 1370704.061 1146589.024 445897.9609 687927.5163 667156.5239 172542.3953 1059127.094 1903308.86 1285188.065 2216773.461 1828904.129 1970464.865 1070142.159 2023336.46 617826.5703 1467289.533 689996.2382 646973.2066 1034491.246 533822.3107 762788.3059 1200633.478 627137.1542 833002.937 1221238.055 13471546.56 2366355.217 2317672.425 1474188.298 765255.3397 2422944.066 2233335.973 2033828.188 2143645.718 1148196.425 5973656.943 2993155.534 2268098.601 2187459.509 2244904.122 6701521.144 4493711.481 4812636.454 3569152.415 5006902.216 25510309.11 8221426.607 4036426.34 4107861.616 1362523.601 18824528.63 14357468.83 8338666.877 1534131.228 6655222.105 30326142.27 19646597.16
Nicotinamide 924692351.6 773720090.4 674058560.4 889292320.3 748318146.5 753643346 597747566.6 566244644.1 626709696.5 544653859.7 532525115.6 450866553.2 880793702.8 676601149.9 748688912.1 657766451.5 835143421.9 867698014.5 1115901093 1073721259 1245682950 1224552602 842113928.9 906998238 2826854414 1780744625 2263702523 2784646919 2161060642 2322726612 3866906339 3826153440 3686300483 3986784698 3802782159 6136195631 777536196 754393654.7 799111203.4 1162211167 771318578.4 433907560.3 736388797.7 579782201.2 238983801.5 735060716.9 668881725.8 902813143.8 696039532.2 716516870.9 1006455086 642985577.2 878091314.1 856993939.3 1000021237 1040614245 1963859078 2111018484 1969046579 1964384756 2321413879 3544449869 2781074831 3216123522 5451941758 4199312471 2440080461 2219844396 3528655411 1317277800 1552606647 4112776206 3411045008 3457842039 3396458969 2913986198 4538896757 5380874642 4489981073 2127890554 3952453686 3468416498 4648258110 4120398066 3642548464 3139315720 3915916210 4479457725 319909287.3 2513111480 4192263847 4649238991 1189763533 3828269220 3635634679 4564510649
Nicotinuric acid 150361.7674 1827640.974 1245773.409 734518.8103 347538.6691 2163474.447 198963.7584 1635900.012 975032.8565 736713.0902 943036.3454 2275930.971 389184.9883 1817116.608 1378868.683 773600.6945 934238.1371 3192035.585 244861.1391 1552831.667 976570.6976 1386549.27 772022.7856 2788865.392 179733.1868 896777.1189 911594.3458 406793.8001 652021.4373 2579155.1 677639.5458 1179347.014 1325388.487 531136.9117 341806.8402 2469903.373 813338.0361 563760.6151 390723.1766 960101.8669 1212282.274 941323.8223 1074018.908 466292.1182 167814.0022 949539.3285 1224123.055 1371560.008 499356.6355 1195842.514 1173315.634 835221.9348 908825.1438 652733.3752 1163255.767 744705.1008 843289.2266 813527.9961 197368.5038 756058.695 966918.1637 482545.7178 526109.0238 223533.3332 745119.1593 844760.1464 687704.3785 414563.444 968439.9883 7286440.647 1296365.596 531633.7549 361127.8283 630207.1162 8901137.224 1380979.395 561012.6965 660973.9042 569170.0239 3637871.32 1397014.953 401786.9584 435887.6909 1060794.936 7530733.424 1017166.458 496123.9048 542177.6836 141672.4362 4480048.532 1508068.091 432968.575 140409.6675 518256.9496 7446765.764 1784199.349
nifursemizone 535411.658 6538049.813 1448557.144 171587.3453 438426.1433 154028.8063 257344.0431 5548561.791 2552070.036 1874316.045 5563570.296 1086974.982 353658.9998 3941642.023 1102074.201 1491066.017 4254905.778 395508.5592 3067703.553 2568528.18 535216.9891 2279206.346 3182758.584 1311073.9 7970871.817 3007834.195 8659736.618 10317562.47 13513067.73 11864619.77 9161711.716 7243060.728 9752879.51 14019191.73 20001440.08 27495239.79 5833805.99 219063.3481 2668517.749 5503098.85 5339681.479 250895.4836 185792.8968 175938.6669 498461.5014 3147215.092 415181.8177 330666.1405 209243.9084 311358.3977 278205.5176 1257903.613 2064891.864 246226.6205 1927766.204 286366.841 342912.0084 3904207.033 3739962.781 316067.2806 274072.0859 1814447.077 3209029.99 3067906.224 1476102.072 292489.2285 4465336.472 4012456.724 7271248.026 172253.7195 198941.5496 48117724.22 43262556.5 46387306.92 24215082.66 31214627.98 45805370.53 51014172.58 59732279.45 21346137.64 28899082.16 39756222.93 36010103.12 45236654.03 30883301.68 13506584.07 29408954.73 30370552.51 1545736.258 19214838.11 6340511.739 20699227.43 7950488.224 28255815.64 14464556.88 671215.7436
NIGAKIHEMIACETAL A 284124.0741 626959.7096 727742.4587 818088.2158 4327644.07 11643060.53 386229.1991 646040.2829 527774.3489 876314.6944 6193429.295 9462054.132 413081.4718 782627.5005 769189.1561 848144.0734 5431362.452 12025515.89 314243.1957 709483.9759 638310.3992 1129278.729 6521921.898 10437597.9 1511460.973 426910.1108 535038.808 592053.3335 5897006.842 12216329.55 519130.9764 329713.0136 487834.2394 472914.9046 5392366.32 17104840.43 47135.62729 166691.0905 472309.8619 420503.4729 277636.7436 304927.6698 280169.818 454619.5051 27946.37559 233782.1213 464377.9123 358414.5993 495828.8997 434232.2046 39743.95526 284311.4267 322350.9884 32548.55344 410258.8971 57746.83484 175504.7281 269802.9295 930321.5049 302708.7039 100642.0803 1954415.406 1390781.373 1635308.809 269756.4444 160379.2507 90402.57285 257325.1634 145445.6778 852917.0254 202411.3043 291727.9237 272302.3369 78469.99244 1183133.334 187570.9257 211128.8187 338576.2781 192289.5359 543629.4496 308595.8491 300209.8324 500008.0006 172004.3231 906666.4844 144065.9087 294936.0505 280194.132 26227.58011 690979.3627 217151.2834 214695.732 107266.8854 130001.1174 1140939.725 267318.2638
N-Isobutyrylglycine 40993708.32 213827705.3 63250391.08 111594835.7 23313028.56 49466535.14 40820682.71 194311023.1 53330645.3 105431225.8 42156864.85 49458997.09 56415900.34 203034931.8 60462961.11 132435063.8 34921292.07 58509795 48515899.8 203487002.9 73981460.69 151110630.5 34961634.57 56139173.08 49037349.47 149761083.7 53277014.15 89476843.82 29601960.68 47412169.28 48790102.96 160937972.9 55812680.51 86891350.44 28744196.99 60262645.88 147318713.6 43353746.2 67289106.96 69315063.42 51663467.81 139639725.2 48986647.44 62936131.43 17478731.05 56985506.38 176623349.9 55492631.45 72850666.46 78943441.11 63419069.09 124854571.4 41999535.82 58257766.72 67004850.33 46867787.76 141346121.8 43886176.15 57708831.94 54375498.72 42728597.36 117477102.1 41555380.4 66929828.06 74807745.76 53851382.22 21067342.69 21093989.13 26229772.92 46124548.17 19625214.39 23589013.6 20790318.02 22764591.62 36440282.55 16577925.41 24237029.4 24384082.3 22102680.71 21940436.16 15813847.34 19037413.27 23304599.22 24040805.92 30805349.53 17787841.33 18710102.5 29123459.02 3784292.235 27371642.52 16760118.59 30827954.4 5398819.294 19611804.28 35741874.85 19132110.9
N-Isovalerylglycine 17300224.45 90926113.88 53785635.76 44884484.78 16464931.33 27759380.72 16493768.27 82037784.97 50923914.9 47308355.58 29135139.53 28598524.13 25153261.6 85658801.77 55401239.49 35753472.59 26199598.59 33244616.28 20523367.74 87181441.63 63931424.49 63273615.04 26936274.26 32628440.18 19756588.93 69286374.42 53282588.49 41738017.37 22795682.03 29991575.31 20431607.4 72544419.68 57236091.59 40809397.33 18984770.84 34580150.73 50172847.43 18503334.63 18602542.76 38538000.46 44137634.93 45966586.12 37038293.95 17274234.11 5872860.469 38753399.9 54515732.68 43756546.01 20699627.52 39640418.84 44201327.46 43799570.4 30612808.82 18601372.21 42380502.5 39753884.91 48179229.86 31310776.92 17042444.15 33941235.84 39511091.46 41118609.28 19557128.98 17944939.24 38319017.71 38917202.77 18200845.44 15337440.13 24990488.88 44832929.51 26427433.23 21070406.12 18110404.13 23197972.07 55862668.26 19925522.08 18797790.91 20136236.77 21148783.19 23543817.4 23769352.51 18795062.75 18592319.84 22136550.75 46713725.08 15152843.24 18740740.05 16506492.83 781785.0784 29037198.84 22106681.98 18183069.92 4723982.842 19760890.25 47761342.82 25919034.6
NITRILACARB 19691741.98 17788190.99 22157754.15 16330294.26 20685491.24 21743873.94 7969630.871 16331327.49 19073566.31 4928812.4 1663692.533 5533135.912 5170664.213 9711448.131 12343253.85 4028759.532 1667107.805 4016102.999 7103843.732 9034236.754 10660674.56 5211966.732 2408142.168 6773661.817 8003545.451 8871837.427 10492651.58 8795518.583 9528332.414 14661572.67 7594864.893 9544086.207 10192151.29 10933759.76 22172418.07 22459974.78 14850967.42 36413456.45 20264670.8 7032525.244 30843077.35 943607.2835 4909411.936 17394618.86 6538953.956 36447866.34 2975894.665 6167173.251 13704961.6 5977293.923 14123942.3 5145483.578 8684680.923 12872854.98 4421165.858 15110857.15 6063217.043 13641056.87 10294307.79 8292993.516 13354341.38 8639925.03 19935704.96 11961381.67 7523674.458 12301507.92 24512922.41 24421286.4 21683621.86 22970350.69 20055151.27 16069483.88 18932774.63 19518524.77 16696333.73 15061414.06 18181832.2 15379186.85 12216433.93 17316566.78 12044678.63 15053961.29 11432318.11 11058501.29 7515514.734 8097689.456 14420217.9 10436032.17 2961576.375 8008094.179 6772502.358 9630806.393 9785179.256 10519001.51 8073150.244 5680282.109
N-methylethanolamine phosphate 91524405.58 84356703.24 63433831.4 54780722.06 76844119.22 45554742.62 59962631.27 47175622.83 32311740.12 17128809.61 59997265.55 20372635.96 61436334.02 46000067.77 12952909.95 14981256.04 24590685.59 17065426.55 33044007.69 31862809.12 9491552.066 12229090.62 10223543.83 6331337.014 20645431.61 27403007.95 12032644.96 6114148.798 10910121.05 11170862.81 16035244.79 13885334.49 10350928.02 9658856.1 8002386.646 8013455.741 51085601.84 74151408.95 57367656.28 70746431.24 48488048.32 20553788.13 60885815.64 40128204.75 46244819.34 39506751.38 15584120.81 48554580.4 28402476.02 15548365.89 23555405.89 11580080.37 34359896.34 16447492.82 15641916.73 15906656.92 14599429.22 20254837.82 10941531.16 16320670.68 8761313.08 7089603.247 5697228.357 8710823.794 5205524.586 11048439.63 33381951.63 38705654.96 38301368.72 29871883.48 41126807.27 9662135.792 8464100.121 3317707.569 10011363.37 6905547.129 7494479.176 12042466.57 7050609.239 9193690.114 9257383.789 5756264.163 2716326.15 6148832.165 6231488.911 11088010.63 11735695.05 7260842.574 40962271.32 3694183.683 6916734.63 7395581.368 17076660.46 2792829.506 10016075.94 6100343.272
N-Methylglutamate 34577060.55 56674526.4 44572175.86 48301845.57 70709433.4 44918972.75 25903318.55 52969681.83 40393750.61 30082201.78 49542393.84 18937971.82 41908544.38 54421458.01 40179739.2 26887908.11 50632632.27 26974353.23 32253875.87 46165547.85 45440969.04 39732943.95 48414703.89 31449090.44 38230357.13 39571869.38 40205439.28 41147433.4 58125325.62 36304405.11 36112210.96 46012906.77 39542370.63 41973873.42 57687437.56 60739858.09 54804610.02 49025208.97 48231219.95 64915722 48700525.35 30021677.65 27034100.52 48139015.5 22092658.03 46539439.9 45269779.23 35089266.5 53269871.27 49297241.66 48172750.65 31929530.2 35229336.66 37921568.68 44592783.57 44380897.19 38935093.92 37008826.83 40529140.9 47640949.65 48514174.82 43937776.48 45396271.66 37582569.45 59303229.36 45598488.76 57273034.95 44927372.47 64688283.06 42758181.3 46263522.4 51920993.88 45503183.5 47029015.82 47302945.58 39399317.87 42500762.24 41596013.56 52847832.6 31261847.15 41111493.53 37136498.7 46322926.71 53948686.26 41956976.71 29490457.98 38151776.37 39256158.42 19209510.02 36775754.9 35444660.21 38932953.54 25721347.88 46263551.32 44451825.6 41947034.88
Nodakenin 3574418.026 1590481.243 4182870.37 1706030.45 2596224.825 2081512.491 1620079.977 2517651.197 2790900.507 2139116.05 2704450.98 1294652.536 1816803.552 1224416.074 1627585.765 867507.8107 2133233.681 2417863.872 2017364.084 1515553.087 3344328.579 1645952.003 1290461.337 2473280.324 1692547.706 2986892.398 2097863.046 2634767.965 2465406.12 2747149.301 1828689.866 1137472.205 2699885.94 2731176.747 2928039.886 6599148.058 1472562.419 691072.2114 1316435.469 1665975.732 2811823.128 1390262.701 1694290.126 1165400.198 346585.751 2202021.296 2310944.598 2327142.772 2518453.616 2710547.176 1527806.905 2056007.973 1648191.032 2597532.249 2041690.719 1315124.33 982358.5991 2530972.919 1804912.607 2518872.776 1262321.631 1142436.608 1249705.39 3530264.208 2785857.291 2709172.066 2868534.44 4138391.669 2247741.168 1530108.613 2058507.083 2494242.142 2223812.697 1975010.387 1980552.511 1158392.276 2777958.504 2492898.234 2207566.569 1245975.493 2139309.284 1574912.256 1254219.158 2133244.118 1758511.426 2025288.787 1598284.607 3001211.51 225866.3531 1020296.404 2252193.148 2034830.327 538376.7886 2117920.203 3474826.211 2559707.014
NP-001596 21512330.45 15264828.68 19203235.32 10136684.98 10237042.36 11799512.7 14531874.54 12110387.1 14096123.64 9267945.031 12076569.95 9506718.815 11480906.64 14917220.43 10734989.61 5730301.438 12323143.82 11472064.62 13500000.96 15039182.66 11268034.33 11015526.61 8999378.441 9917720.971 17649533.89 15899233.28 16162883.32 12109393 9658498.343 16260813.85 17741342.04 17238378.07 21499947.69 12668772.44 14893901.04 21541840.17 12000871.77 8543119.569 12383940.52 13297893.19 13056272.41 12329943.87 12351270.22 11003101.36 3810103.625 14356587.95 12308310.94 13175504.96 15546110.25 12377343.65 14642551.58 13200028.37 12432556.5 9762769.576 13737472.82 22187947.5 13397654.96 13117874.3 14189705.23 13228261.26 14370374.8 17970223.55 9270397.09 24800959.4 15216233.93 15165694.74 12061056.93 22591369.65 9224911.681 11671119.93 13351837.77 16833220.87 11609676.52 10306405.29 15399578.53 8220963.655 11776865.49 19347150.14 11952850.03 14516168.39 18318919.09 13398000.25 11648927.1 16821896.73 14956226.86 8818136.681 18090566.72 12665227.06 1369970.038 6500313.931 14087944.77 13904374.36 2286700.368 16005699.38 13158703.88 12963651.48
NP-002855 6943634.034 8203529.174 8174799.305 6187432.852 4905751.047 10246678.91 6667733.867 7581505.97 6480312.486 7539628.036 7358200.066 7662749.701 6252699.653 8657915.52 5863224.836 6602249.911 4588573.112 9881167.696 7416686.997 10629543.41 8540076.361 10006183.96 4674744.542 5260703.088 12834190.67 6561592.791 7404434.042 9296000.723 9009812.009 8572466.229 19758740.24 14202757.2 12558369.7 13290893.63 10377552.4 14459562.43 6560021.587 5226806.323 8186191.405 5928654.776 7240631.56 5596562.06 10293798.77 6592280.877 2890783.066 8423432.358 5452748.909 9674819.191 7859294.955 8188845.106 7369077.017 7176573.528 8184637.176 8910687.32 9368588.451 10481873.58 9891854.107 7746284.856 8827577.723 9324931.359 9664525.775 20058376.5 11302874.06 16939536.09 12674251.82 11269953.82 8400421.489 8269244.353 7304669.053 6093255.417 7806648.315 4903900.986 7334005.713 7085084.468 9163271.601 5059408.141 7752873.464 6414987.447 9482560.989 5489582.998 7277093.974 9954795.198 10793460.43 13169635.96 10881089.66 10185684.05 9047220.851 10936391.21 2610970.914 7639829.117 9766299.395 11324242.12 3427307.033 12497397.23 11673203.48 13938607.47
NP-005709 3866706.091 5625320.698 4295834.783 10427652.05 278168.3101 3541164.735 6117740.36 5345674.457 4113025.305 16320829.98 1284105.427 6607204.372 7889706.113 6581879.865 4368781.634 12307943.58 980861.1632 7452324.925 6011611.936 4712832.984 3571596.665 18801808.13 1027963.528 5515918.299 4231805.841 4222108.723 3436149.767 8365221.852 768980.3529 4217418.397 3682715.819 4001079.963 3420078.1 6233350.927 919317.4599 2860047.4 14055827 16420762.61 7394251.912 60072868.1 31003122.98 23333972.64 52443538.64 6975464.742 14118896.56 26303935.86 23843693.08 43844693.73 8923963.822 86667319.9 34634383.48 14650740.73 34009780.16 6804554.586 73170883.53 25310944.55 16044037.61 29127709.74 6140196.519 59232566.28 25425475.64 8124590.931 12331839.59 6824870.438 40984647.36 25277222.08 6079462.394 9077039.688 12900229.42 39330863.41 15521133.16 6906665.682 7794136.657 9066506.628 53278762.06 13728151.59 6177096.951 10195591.39 9987084.545 18081822.34 14009175.75 4684619.398 7361958.171 9275262.225 38668369.31 9212686.297 5318870.902 7226276.806 334471.3673 23840896.13 13190744.78 5949301.796 1318644.682 7004746.349 34629033.03 14137536.1
NP-007966 3779521.209 2964923.06 1091782.384 8870518.537 10491719.67 9195759.653 4855724.852 5189529.423 1328999.006 11045080.28 20893513.08 11926995.43 7270685.877 5254750.971 1462864.288 10106736.35 22110222.31 14556974.98 6641231.805 6185485.301 1854510.222 18288181.49 20152847.48 14356844.27 4354617.225 4849750.699 2173145.38 9346778.888 18090628.94 12309756.83 5858070.484 5957916.685 2838785.61 8758867.71 11395036.61 14782935.21 4207785.403 2091597.659 8893911.758 2731568.607 4331035.949 6514518.174 6466763.174 10135358.6 961994.5556 4151073.341 6739485.491 6645455.909 9637417.083 6577768.097 5789778.307 5335554.017 5902791.969 8032519.134 7657586.615 5096266.707 6578664.59 5623963.008 7757669.741 6566067.591 5326168.021 3511431.435 1980852.772 8347014.746 5722042.476 5293511.992 1075723.795 987385.7709 819481.1888 1052940.345 888634.0077 3731411.962 3034217.338 2434734.583 1841686.422 2357356.07 3439225.701 2496956.057 2820580.21 817063.1298 3409626.706 4147804.066 2158624.445 3284804.739 1968060.795 1722960.202 3410554.327 2121968.319 547486.1385 1318259.78 2737103.597 4487339.134 529317.4418 3454579.491 2120941.834 3407000.562
NP-013098 1498104.147 138986.748 442205.8272 1781163.331 134019.5898 985000.709 2691101.018 120768.5817 404021.3374 3197727.828 131698.3877 1633396.915 3545905.781 176728.6513 289894.7323 2008473.671 176815.2478 2222368.327 2739624.692 212309.9021 548787.6002 3632887.487 151364.9656 1554164.002 2120743.643 154638.1852 460013.4185 1520160.004 155554.3184 1099705.667 2094343.551 146187.6363 412431.9728 1397841.335 152431.7555 910274.9965 134584.5379 116995.7402 118218.8535 127128.4669 129247.865 179380.27 452393.5657 110510.8771 94287.71271 119028.0345 140727.6389 547114.786 127142.5777 176889.5973 134607.4057 154047.1251 247905.1061 144813.7886 242145.2401 141081.3171 146899.5269 232123.5168 141838.0785 219843.8302 144183.0801 139526.3314 135923.8237 157306.5688 232297.3598 155007.6528 120565.2559 127942.5412 122769.5888 168088.7123 142221.6418 110338.3385 119616.7977 118131.9619 238990.3815 108807.5162 146731.9918 147581.3749 144052.539 174093.425 166108.7692 138349.4362 135973.5644 146022.7261 181770.7912 142569.9014 141885.939 147638.8611 117197.8967 133005.994 214239.2379 147317.5869 127379.817 138863.3238 152670.0142 223079.9879
NP-016596 102371.9884 593864.1426 290369.7915 477645.3481 51551.18876 48922.74599 213030.1428 673269.5285 195204.4723 500465.8628 111239.8163 48507.23908 223127.4706 704864.8714 172308.7188 286793.2673 65839.32116 206271.6676 297201.3192 550860.7116 114845.888 398518.7746 53131.29015 56412.98858 183423.4926 471133.1155 79328.0263 296128.7146 123174.0374 43424.32162 351916.8676 621960.7096 121492.4265 225658.6163 71618.16111 59333.56346 3924221.796 155365.4211 1306913.7 6996826.615 300564.208 5286575.059 336009.254 931893.6466 1578431.129 210982.3326 5123541.514 356758.5705 1087071.093 9018189.955 517354.7334 3349488.644 295307.7521 862121.0465 9288929.1 306472.4317 3440185.928 348050.7975 947402.3289 7052069.609 325439.8232 2147853.816 257539.6313 1182000.84 5161658.464 392472.3969 45135.37125 142287.0771 115365.7133 42723.98163 295161.3252 59425.27166 155609.0212 95037.6304 41163.53283 148537.8514 56341.8993 89355.6698 102247.7919 35783.96486 172037.2142 45948.55671 119747.1148 117168.8729 44160.71363 216276.1015 42990.14585 51302.25233 30542.01415 53633.48205 265689.042 170468.402 30856.53203 97639.94183 163106.4996 207790.1146
NP-018661 4598394.414 15153263.97 6223605.732 7204321.17 10033092.82 18258233.46 10101047.73 30767139.87 11082838.5 11431668.38 17076529.41 22002826.53 16534889.23 46225180.27 13850152.05 12248052.96 21445665.99 29760485.3 18702548.87 49238513.55 17742216.78 26148832.89 22407034.47 29687724.23 16741360.84 40672614.45 14672078.1 18018778.05 20205061.43 27403834.56 18402854.64 43219819.23 16162586.29 20927791.81 15568192.89 36179118.94 9657076.93 6162270.406 14512767.07 6659068.988 11085626.65 10843802.24 13629270.04 16982798.12 1784749.329 14750366.14 14169979.77 14637402.18 23954457.67 10709625.89 18595770.12 12944519.08 14307720.96 22661383.32 11038920.13 21078643.64 15148984.29 15677604.05 20326667.99 10646097.09 18846666.24 14176296.53 8336764.628 21985822.18 10457180.1 20380406.17 8297222.636 6535736.387 6890462.743 5080317.451 4444382.626 10355999.98 6401872.985 5557668.9 8277161.642 4189569.507 9513535.763 7732686.457 5514370.303 3212266.571 4711819.726 9400496.821 7968983.434 7009556.078 8284809.67 3565333.098 8636915.168 6459156.063 255482.3965 4516922.395 4646445.35 9851625.262 1502577.947 5832364.01 6912196.638 5139601.339
NP-019483 12950744.04 28150049.75 16574848.59 23357801.95 599635.5033 512504.3588 22991819.63 29942278.69 14956930.43 30313967.51 1283490.913 413363.9608 23029511.05 35600086.34 16189847.42 24112016.53 879149.2057 587807.3204 22398885.14 29287474.75 16235731.79 41652070.1 1671243.408 706116.5947 17378595.14 25670803.91 17228332.69 22404966.74 1562377.612 734196.5342 16226719.61 21177675 15214738.72 19310565.51 2207500.059 1045491.198 68124127.08 14053301.03 49498965.7 108649640.3 18662891.61 101541429.8 38937796.8 49430597.75 25779119.85 18604596.65 111797789.3 38366259.48 57721694.98 155952352.3 18977758.87 81671636.19 18193004.9 44224156.44 126926043.3 17373426.76 86216117.05 27822553.14 47266396.3 111646052.5 17193877.15 59769939.65 12999925.68 42459869.31 88256241.39 21367342.08 1561259.099 4752818.815 9644864.375 2324322.995 21755367.05 2018522.372 4757277.512 7777541.368 2551688.151 18493225.77 1479337.766 4306084.172 8357467.375 1484796.678 17007917.8 1363877.414 4090205.521 10163101.51 2852702.487 11828325.77 1597452.893 3757176.478 838188.2935 1429473.723 15484436.58 1299855.787 924182.7801 6976827.678 2666368.923 17531577.28
NP-020078 173017.428 285625.0729 694418.8027 315408.7253 210148.7771 244277.5703 801142.2654 901081.6339 908238.4507 969500.6735 742533.2362 2837799.096 3773281.649 2099861.825 2839036.347 2200730.466 3079476.971 6701861.905 4007484.106 3111001.408 4172711.457 6300218.661 4405358.113 8391187.152 14580251.77 2766790.228 4412679.907 5608704.814 5122332.435 8445504.972 39654064.31 8164364.107 7678423.116 10776055.79 13513701.47 21563842.53 224831.7505 160454.3916 521951.4949 2261765.299 574436.9024 403769.2799 344361.0538 402227.6369 453655.7319 767241.8465 1609707.018 1003297.632 899382.1255 1642654.01 1420033.589 2678743.487 1053958.588 732184.4851 2157798.13 2162228.115 3805308.761 5714885.545 4755743.251 1870464.957 2387141.942 18317665.6 17206988.9 5515276.802 2525394.652 4333195.407 595904.8276 878360.1323 1103318.595 213458.9776 566280.9314 2209819.43 2398326.955 1752859.397 2271757.943 1849433.816 3533830.825 4816478.056 4796308.863 1905553.222 5440369.623 6108723.487 6038244.56 6330189.694 8435531.148 4357429.809 6375800.639 6325580.194 322956.0795 5226192.699 6351464.074 6801136.604 1725715.899 8829740.212 6980061.998 9026855.982
NP-020292 2301345.844 6494642.709 8293729.125 6061498.71 3991258.226 8458892.431 2865310.51 5540298.211 7525188.979 6705920.45 7556940.605 10170506.61 4016382.792 7114330.074 7661197.942 4926195.532 6733148.733 11886381.75 3093580.886 5628017.536 8085036.901 8330205.523 6438519.68 9728157.738 3044806.116 4559394.923 6696771.398 4852447.166 4398493.911 8232401.159 2800366.043 4873464.147 6807266.568 4818864.685 2928825.425 8584217.767 9358280.902 9366344.389 5727727.077 11748997.58 10765438.39 11530581.51 24298968.64 4977775.709 2414543.313 10245177.55 12342855.47 23499960.39 6144772.684 15332956.21 11326832.84 8740084.761 17803556.24 4817530.721 13921385.21 10055664.43 9611556.311 18646089.03 4601923.264 11188811.16 9272893.07 6793929.085 7690444.287 5008937.671 9928750.934 10171919.08 4175868.266 4208986.521 7017833.867 29333873.96 8360619.432 4365869.133 4740680.27 5419526.951 35685095.15 8333057.091 4063711.42 5349321.046 5902675.06 13103923.36 8597780.117 3931983.805 4507195.843 6065170.049 30747026.01 6080336.894 3864159.618 3956896.607 336518.1998 16789136.95 9155503.146 4059352.692 858373.0954 4438287.913 27731137.88 10345636.67
NP-020353 1480377.208 1730420.64 321145.7531 3040467.382 11593085.83 34435813.7 1649817.096 1821209.855 306297.106 4458660.267 19984156.13 39834898.81 3117260.563 1856534.407 393468.5931 3391570.998 21035481.3 50031500.23 2133180.841 1804002.294 486705.7556 6142450.897 20045625.85 42417581.28 2622722.552 1686260.621 676933.5936 3355816.026 15818704.29 38891291.2 3285668.81 1633865.533 754416.431 3196884.483 9512574.725 38491316.7 851999.9179 492125.3776 1281420.58 579485.16 587593.6784 1240547.672 1199313.068 1322448.52 158538.3964 585015.9169 1530459.307 1118091.089 1245275.164 783165.9912 710724.3937 1212395.206 914458.1559 1089129.861 835901.2374 813867.6597 1206690.277 805156.4517 1658128.562 978831.1795 718645.9755 960546.8242 1040576.74 2107704.456 547238.2519 798126.1425 2983245.505 2518994.336 1525382.096 7243958.782 3540409.349 3148369.014 2673778.422 1194799.826 9578870.927 3224757.849 2777923.773 3224291.66 1678596.8 3675452.466 3458354.91 2740171.789 2709076.132 1289090.917 8055926.677 2502747.823 2821700.471 2779141.513 66060.72768 5082405.749 3608063.544 3117061.235 487000.0065 1074768.563 6732362.914 3672427.955
NP-021085 3609706.28 3432081.728 3329649.112 3365054.041 3918608.154 2281471.439 2354824.212 3021010.509 3307033.363 3089248.151 3054105.206 3371456.825 2558841.236 2635723.655 2242968.946 1832735.14 3384578.979 3060939.073 2638981.569 2630282.755 3094077.23 2260606.801 2303873.243 2905276.807 11346488.96 3052913.356 3137785.456 4118014.336 2545213.256 3231665.323 38914726.26 8995212.966 3790844.624 7166281.914 4189821.909 4172861.011 2843801.617 2410497.764 2712493.633 3331488.347 3164864.597 2273158.824 3352893.27 2694725.868 1416653.836 3120567.821 2375182.91 2429002.551 3180171.354 3104904.959 2325229.911 2780071.922 2504275.129 2317376.954 2086427.879 2759526.663 3232080.064 3933859.624 4440998.706 2794303.562 3093322.688 43603732.44 22449247.65 17981001.88 5300056.098 4331326.925 2724985.341 3619752.38 3266929.206 2830418.201 3237623.304 2487331.411 2913276.114 2816862.099 3998628.931 2366775.003 3399502.028 2567962.221 2413025.529 1922485.786 2886564.667 2494406.332 2117449.358 2196414.137 2373773.558 2954465.341 3537238.717 3425163.529 1089628.568 1681174.263 2617144.853 2982590.087 1439215.437 3319088.154 3701423.182 3239490.797
NP-021797 21058100.81 52252885.36 7734007.164 24946549.43 62981522.41 68580718 33208917.53 70479510.98 14903374.62 36378342.87 133492168.8 89716286.87 44147583.05 87685395.8 20285933.83 36275408.68 128494007.5 103189502.5 42940445.25 94367452.21 21591971.61 56167935.86 90242737.82 102317593.9 36856634.78 77847618.89 17951230.68 34958926.59 100512121.7 90150004.85 42218116.16 80053355.56 21597148.45 35738508.95 62724019.74 95843959.47 43081140.12 23057653.8 113190506.2 22733952.78 35149590.56 58334161.44 56191465.16 101143000.9 4912664.208 37485002.35 66086896.36 61092560.21 120434983.5 30392094.48 45366619.36 34688712.21 47396875.62 97330194.9 34298310.67 42253338.98 54754977.28 44991919.21 100506417.8 27843788.44 45893429.87 38788667.53 24738462.58 102641767.3 26120705.71 43774703.62 13454078.25 9873224.447 8091800.157 7042016.33 5099856.269 13409460.07 8717568.211 7496731.844 9462963.145 4437075.431 11411533.94 11210627.78 6198806.54 3962131.852 4897609.815 10950892.38 8629703.913 8102842.106 7919384.683 3019410.342 12391346.23 8117779.271 522884.6354 4993963.99 4032245.008 13213040.4 1922422.704 5908595.747 8063308.082 4530294.335
N-Pentacosanoylglycine 27241655.39 118134623.2 22277767.01 86236593.59 19957055.09 24719366.48 19812888.96 18088824.84 26855157.09 23501787.62 22220855.84 108162378.1 13142693.82 126917608.4 13752238.62 18090657.51 22071530.76 25072076.77 14256200.25 103856301.9 18796247.58 25870955.76 15140201.24 18839839.86 36933356.37 14134163.01 15004301.13 28104543.34 17638572.48 19744366.05 62620828.48 19022422.73 16000847.68 14643036.54 12441851.08 19340585.25 13686962.37 67166164.18 53371297.62 65678082.14 18308800.11 103463426.9 100269001.1 103169604.6 6011271.663 17387504.42 13669649.5 26560503.87 24016860.22 14640565.39 18129393.6 17925597.24 13771243.45 11639547.74 24728559.23 135212534.5 61898639.57 15672575.13 141044533.5 19070906.99 33544445.92 32016257.45 12031942.4 18552411.68 12623854.74 10297960.48 22981061.44 94308172.42 22904800.34 16615317.41 20804493.12 18809188.41 29065658.15 16420431.18 143547524.1 18654190.19 30234708.66 13769169.85 17623615.57 13028277.35 12641236.6 14315684.37 105886103.6 22108709.74 17878540.85 13147499.92 94312550 19266616.97 2219212.528 14778229.58 14924276.36 5652974.75 3374193.993 43011543.78 13841534.5 11706013.7
NS1800000 3818786.609 8404219.894 6350706.928 6184756.093 2095950.131 6035006.535 6300626.382 8674375.46 4822162.091 8128338.539 2979721.556 5235013.441 10727758.27 14945023.28 4605776.545 8925686.623 3611577.858 7427395.082 7724771.941 15014479.77 6828263.805 13521388.73 3507338.582 11888071.08 8929478.372 8249981.651 7548592.905 6105149.614 4867040.698 5854982.721 6174526.754 6923430.068 5431552.855 5665892.689 2128427.069 6618604.295 3797492.318 2687519.32 1561172.45 10321656.94 3688504.559 5686946.502 3539346.485 1534964.281 2157522.26 3269299.654 7680205.657 4115629.736 2699279.927 7047685.341 6082324.058 7389186.739 3809367.67 2951848.206 6654420.467 4859943.473 5259194.325 3760389.698 2403848.913 5201920.844 3841661.919 4704035.865 2805146.002 3090380.767 6289174.549 5152203.408 3406237.16 2640035.58 5553912.281 12874628.01 5342051.614 3283770.068 3009710.067 5291276.807 24143422.07 7021864.228 4467924.933 3932771.916 6348492.685 7423755.345 5467741.829 3116960.427 6802202.916 5475835.736 17788258.27 4361590.851 2866215.601 3998842.568 527850.8291 11387266.66 4731519.817 6354139.548 1347505.52 3741365.332 10296185.39 5586337.627
N-Stearoyltyrosine 27315473.03 45586999.93 29888379.31 54789010.38 52090272.98 59918830.5 69813979.32 181800637 132687690.1 90987086.1 68223105.86 66383945.85 198417501 329164147.2 271834895.4 195716169.3 99113703.76 164770088.9 262975706.9 410638706.6 395922917.6 453803240.6 176516731.7 242772764.5 217698260.6 265600735.7 338122361.5 288299337.7 321109935 188124369.9 200850520.1 212527419.4 192953153.7 210008255.2 304744935.7 157028185.2 38085364.99 46796566.83 61955692.22 48210411.18 55083205.76 24548793.73 69147475.69 179002720 31607724.73 243147696.8 106633172.6 219905901 322296948.7 172402353.9 467118511.9 151231076.2 290457437.8 371122352.5 263074026.3 618139729.1 203119393.7 352492977.8 320370749.5 231450719.2 459513047.2 228581359.2 340975034.7 230898510.1 220903217.8 385790394.1 36371637.14 24113200.92 32615214.87 27035967.64 41403638.26 32358955.16 27707250.14 17453718.84 20019054.14 39802991.89 17781644.33 20040716.64 7910609.103 10620562.92 29583126.3 11241076.81 6352031.911 3659705.662 7185489.979 10297619.15 8784268.192 5543508.405 402688.3234 6468320.826 13583970.16 7144164.958 1040426.469 1767380.608 5601141.682 10367086.48
N-Tigloylglycine 7448902.327 17037622.71 6170098.354 19570931.84 4978917.601 7503482.482 8650884.534 13622753.2 6623242.555 21592086.9 8502908.203 8164694.467 9354017.065 16267421.68 6488870.182 15618068.41 8014686.26 9709979.682 8370764.656 15540548.94 8286059.902 28756418.64 7343794.572 10835502.83 11238686.9 13090727.72 7357773.424 17773389.15 6065062.456 7172105.814 10163970.04 14782658.87 8074331.046 16382357.41 5002474.148 8980406.008 11678911.38 3460413.024 6959671.975 5926389.59 6365236.975 11572735.79 6539827.055 8074877.732 1213967.528 5989008.475 13578547.34 7128045.497 7212967.007 7136629.589 6644184.228 10268336.35 6216886.063 7223178.282 7839142.61 6063929.658 10878002.68 6641403.293 6289555.626 6153359.551 7441357.237 8588936.255 3236075.939 7823198.903 6512253.514 6221942.583 3204221.819 1229696.132 1627654.807 1997271.251 937275.1816 2886498.499 2956577.229 2985322.023 2839739.246 2833660.462 1368838.945 1361003.39 3208357.969 1330858.767 2533062.075 1022091.892 2343011.906 3146141.329 3748258.556 2174784.438 2662698.404 2422739.27 2132365.597 2911951.114 2585196.938 2696621.044 1683852.694 1143616.382 2354367.659 1261276.41
N-Undecanoylglycine 223530895.9 181434731.7 107418779.4 106406127.1 84265489.88 90811866.24 112573948 95047102.74 165516575.7 105872631.1 84069532.35 123860643.8 125872286.3 118708835.5 155057024.2 93941321.2 113221840.5 73559346.42 116129655.3 80066250.66 98191539.72 117993577.5 127241376.9 79757032.62 140378523.7 123234662.9 118764644.8 199149938.8 140444325 76520912.02 84070954.23 95521486.96 90314396.95 75667248.94 141520972.9 71863845.06 96021186.49 85158484.87 129370124.7 98745378.79 89675708.07 143399388.8 94456069.01 108253653.6 81892024.72 106944491.8 96815200.43 106883993.9 105634715.3 105594136.5 128282211.1 111620091.9 94231250.11 92370236.49 88684115.63 104138777 113691885.5 180485032.5 98123189.6 120885013.3 156012600.9 102802240.9 82057677.05 82772507.85 109289053.6 83956758.62 88672053.85 125440013.4 158391355.4 125268978.2 76178559.63 153711471.4 143417082.3 93730571.53 123268278.7 100440270.4 139578793.9 188677095.8 175763666.9 103945209.3 96233575.8 133597456.5 90242375.24 95755431.54 123955419.8 92366347.32 89871480.59 108498747.5 68771731.27 107906935.2 149519392.9 167509818.8 69411975.21 93011292.42 84234772.11 144234199.9
O-(4,8-dimethylnonanoyl)carnitine 2308345.156 2094726.716 2030796.267 1857531.799 2094311.393 1978706.828 1593538.772 1830922.672 1923578.627 3040379.94 2269375.082 2421277.633 1609146.67 1855142.802 1472132.171 1552357.812 1768874.922 1748563.507 1151288.842 1439748.255 1531675.65 2674685.636 1504913.611 1292636.365 10135460.13 1604067.2 1719118.509 2519134.908 1837858.902 1892400.882 43522423.29 9872801.967 2004048.483 8168152.71 6380443.616 2241682.687 1947239.532 1248070.179 1990469.758 2005482.892 2010979.671 1743791.949 1864020.456 1881012.843 660651.8425 1639417.163 1773376.023 1619553.997 2016468.461 1563612.305 2452605.686 2677234.527 1522341.469 1540131.56 2617628.676 2854608.682 5775553.935 5443334.139 7841801.939 2264732.21 1531306.83 46255631.96 18710356.9 24986969.38 2825550.079 2067026.587 2023517.42 3598513.824 3142769.889 1524424.07 1898763.744 1675170.347 1887782.878 1669587.734 2116946.041 1325110.556 2056705.104 1758093.287 1500795.505 1175900.503 1767447.657 1340518.088 1562937.292 2411474.343 1580596.067 1483587.165 2729645.782 1616693.047 362494.5304 1481161.668 1644542.197 7531766.361 3432767.673 2963806.175 3196543.878 3187703.286
O-{Hydroxy[2-hydroxy-3-(stearoyloxy)propoxy]phosphoryl}serine 11812474.22 17157818.11 13228819.15 21436976.69 11122488.66 14707563.44 16124676.27 15316240.18 10762374.82 20136189.05 16887096.52 7571461.113 31594196.71 15444061.81 10483152.02 20719629.9 20119323.88 18171718.72 9773122.015 12757117.01 9817832.789 24558142.61 12586371.82 9535932.943 11546006 9118003.037 8696456.841 10364450.64 10792033.1 9110678.248 15371435.91 21398394.14 18213623.39 21522118.08 11959533.94 16141541.05 22849295.55 12225064.09 10450145.1 12633020.71 14301783.33 17680618.99 20943602.51 12084541.07 4107509.557 15549415.02 25648160.52 24049468.2 18412832.47 12241394.93 20600559.34 10932117.39 14697625.62 11039621.7 11590295.06 15348237.87 20799812.65 13166647.14 14279134.7 11643477.47 14346207.31 20257609.48 15954560.75 15017010.27 12297299.37 20965626.52 15896764.49 17923692.11 28700210.41 17699918.94 20825783.34 27083349.29 22689996.96 16204133.39 23946820.61 17029959.96 27652598.81 35990645.92 28494167.83 11959949.7 17225860.35 38275684.51 36411255.88 36327358.84 23680176.1 15943339.08 32118477.14 32423148.41 1522883.615 17117986.36 24801810.31 53630173.45 13576719.22 30874290.19 32886104.81 27514597.73
O-heptanoylcarnitine 1518377.004 2264263.984 467304.7846 1750810.458 1378564.041 1475751.484 1551606.633 1889777.832 430644.1081 1444833.328 1749132.505 1469872.238 2200618.288 2241429.346 415902.1525 1129959.326 1484412.81 2035494.98 1634626.167 1899065.484 602601.3172 1757997.972 1346683.858 1707133.769 1588920.734 1459764.069 380796.8231 1623758.91 1536758.458 1389113.857 1589970.385 1835105.226 404822.3372 1406394.939 1009367.775 1944423.545 622166.5466 966752.4033 4474097.115 538682.8344 1430199.342 333534.4502 2193657.799 4175192.466 126502.4818 1139819.029 560241.05 1876205.767 4191582.818 461198.5673 1481418.529 384700.0745 1521877.859 3742875.843 535497.9751 1229373.703 492955.874 1262900.65 3067631.567 431546.54 1211319.314 296731.8226 991077.2375 3217744.579 490444.7407 1220116.125 72117.1978 61530.62585 62535.39942 54637.63436 63305.8113 76835.26656 65945.56652 63483.74638 67467.50769 65736.56904 118087.0865 70163.18705 72258.41572 66180.64649 79687.13101 81277.88048 80356.49843 89097.32392 85557.51899 81497.51502 98276.96439 87093.27234 63079.23428 81539.109 88360.0547 97140.21002 60436.53672 89154.6193 88823.00181 101436.0105
OI1695000 2321299.009 2508949.45 2036641.684 2314640.393 2276613.32 2402435.506 2048660.417 2433711.438 2034492.402 2055537.722 1745050.864 1559328.659 2446898.954 2351825.986 1994908.143 1597589.236 1438184.911 1528049.475 2454682.018 2257013.942 1925806.904 2355473.968 1240610.849 1412826.072 2894953.701 2137382.673 1785564.905 2280323.005 2241438.779 1656509.246 2691611.211 2227891.929 2075233.326 1903081.553 2601906.565 2642013.295 2081319.587 1580314.493 2023951.848 2024932.884 1758172.212 1839066.995 1692529.924 2387907.63 1135593.923 2124532.231 1795372.306 2149396.079 2716805.812 1986780.593 1950199.663 1501165.385 1400654.829 2105463.456 2217555.694 2040766.727 1561390.39 1509218.034 1664699.547 2163318.342 2150086.972 3726916.241 1697762.403 2308860.304 2473228.624 2221305.474 2114208.927 2712860.534 2139727.911 1771714.418 1788451.87 2733569.185 2664616.195 1836818.61 2771161.003 1713511.091 2088675.985 2088823.564 1659281.576 1877740.331 1365046.803 1707097.613 2111779.054 1946543.43 1995111.725 1582970.761 2110513.41 1930351.527 694148.5688 1106489.623 1388195.677 2788131.698 958639.5103 1854902.117 2041310.996 1963665.103
Olean-12-ene-3,16,21,22,23,28-hexol 7992336.498 8861003.182 9276255.167 8558950.791 7919228.239 6748840.568 9890523.754 12065491.17 11392059.25 10399385.28 8743733.625 8380485.644 18573140.4 16704781.12 18015401.15 14287411.03 13613545.36 13388707.59 19757304.55 15434264.03 15752103.43 23976635.46 13775951.42 15741246.01 19693942.28 17982030.18 15750130.27 14705691.65 7395224.755 11414635.87 17732876.34 17712357.35 14176272.95 15077243.82 7567892.437 13960054.39 11809023.52 6541383.737 12512022.24 11143525.82 9919667.968 11206056.88 8947362.586 10765200.28 3727189.32 7613792.089 15185767.32 12358463.45 14939371.82 16810511.09 13064805.89 17216018.88 10213525.25 13345294.4 16361053.8 12520023.84 15172833.13 10570184.31 12257040.4 14158353.88 11088191.06 9411625.295 5834905.548 10459725.81 9089061.611 9827568.441 8505909.94 6916838.59 9074541.965 6231184.201 7938267.726 5667892.651 7841760.259 6356467.574 6324762.263 6327307.106 6754720.619 10316861.72 7059811.063 3714058.573 7131416.364 7915842.739 8426092.407 8790357.542 5059927.318 4238202.887 5132815.638 6187417.869 226417.728 4203004.43 5877235.959 4846618.576 1678497.783 5652615.944 4902963.049 5226494.918
oleandolide 22260109.65 14104001.68 14791139.62 16060472.95 14207846.49 13659330.58 10611871.99 12758017.49 13653932.61 13054594.59 14265467.62 13045860.3 13145630.8 12692753.43 12357757.88 8856693.75 14092600.12 14436960.72 14064878.7 14172067.43 14991819.26 17451395 14179827.51 16086540.53 100207373.9 19578200.03 27860382.19 25699198.93 17649525.03 18741173.69 269722695.3 50436308.47 35157482.2 57697041.36 32809181.25 24413915.63 17102860.8 9732303.747 12822611.23 14905471.2 16062384.82 11907986.84 13184914.96 14209581.04 5589884.024 13920475.94 16401828.07 12196482.53 14923031.56 19754324.56 14008006.7 14470697.5 15771641.98 15429872.6 13096628.01 14887522.12 20909822.27 52847972.67 41608167 15959387.06 20567711.88 186879295.6 99278393.59 124191403.7 25380442.15 21601443.39 13742473.43 19352428.55 14888286.26 13145007.19 12927041.94 16551868.68 12506015.75 23364936.8 17366370.52 12878104.3 17083828.32 15280017.3 17519557.17 10680130.63 13097655.8 17058079.41 15882351.42 18508833.64 19595007.98 15922924.66 20225548.94 23860458.67 4024010.545 13698033.22 17525142.3 22911506.44 6843179.091 25158058.18 18852673.82 21289659.92
Oleic acid 1885082.784 3527694.969 2460500.536 3044276.435 4869838.983 7451994.107 1524832.67 2887742.376 2769092.769 1180501.885 4077196.747 2846482.125 2429200.231 2732869.494 3884563.658 1606503.344 5960503.394 3700252.485 2867676.3 2916638.876 4759813.938 2857101.947 4592141.369 3240687.35 2960701.729 2711653.661 3068976.708 2954419.682 5628300.706 3259217.383 2772402.774 3004529.016 2915171.601 2774023.065 4512341.396 5434771.099 2617867.212 2503637.704 3523037.212 1922645.25 2907265.121 994419.815 3023991.08 3170738.682 272879.5935 3022379.6 1878131.086 3693660.581 3752879.019 2095548.179 3706189.756 2486407.921 3853859.535 3684305.012 2074384.786 3344191.378 2897958.05 4691845.296 4192157.587 2086674.989 4019933.57 2729806.68 3256879.191 2219734.953 2137613.771 3373542.785 2838504.442 2086469.442 3195901.428 2586930.046 2421728.477 3152374.113 2737382.958 2485746.063 3166049.117 3201135.172 2570642.902 3081796.849 1796468.754 1416742.538 3669269.726 2008787.101 1808070.682 1125966.102 2069421.004 1516982.759 1992967.257 1513052.655 63466.13938 1383206.024 2195803.595 1294179.926 419295.8192 684309.8751 1423005.681 2314544.474
olivetolic acid 348033.6095 572500.7729 536831.9109 712832.1706 248227.5176 559041.8472 2849227.543 2582409.14 4695982.564 4507681.582 3234471.413 6564920.122 15136235.53 8068709.553 10310528.33 9947628.713 10095558.54 15379133.71 20813883.91 12822480.43 16178145.7 27777921.6 18730734.69 24959682.36 19255185.03 10868416.3 14705038.16 18046041.81 18158638.68 26589902.62 20166485.21 12408609.2 16053877.79 19198292.41 12068797.05 35912029.25 215087.0927 158399.8732 179026.4614 1534377.478 378532.6266 2916135.675 1894102.662 1135465.733 1275138.655 3768566.671 9201141.467 6044393.499 3849384.24 15386554.98 8959596.14 11479466.42 10530199.95 6037884.302 20564039.69 11730174.54 14430662.57 11269602.64 6318712.746 17795083.49 12939134.77 11762597.96 6939124.078 7286097.232 17382664.52 12074414.39 4448165.059 3647563.147 4232719.063 1156960.678 1620749.103 19286505.16 16967357.64 17201088.07 21051683.04 16433920.51 50277429.62 33806407.04 42860711.92 22445191.37 57146641.25 92009281.92 79961387.62 97820589.5 129933750.1 88474646.85 79213598.88 70427578.5 3891696.04 78431306.24 111621216.7 80614749.01 14131478.02 74587064.16 126135082.4 136836388.7
ON1225000 3916314.84 3588152.123 3764458.25 6800743.55 4562158.901 11089167.02 4355975.396 2889138.882 3026901.228 8067439.295 7120770.632 11084394 5636244.144 3070377.05 3545648.302 6519592.931 7039728.309 15504422.35 5385793.588 3147154.54 3599884.606 10367798.84 6487974.11 14726711.44 4394286.557 2932618.499 2741021.648 6080896.088 5094473.936 11036356 5484703.982 2875684.584 2863859.098 5999263.84 3346319.057 12092034.49 2412776.048 1549856.782 2155273.415 2521178.273 1948912.907 2854965.607 3247138.392 2068824.168 426356.5207 1549281.137 3254072.03 3440648.713 2037546.268 2895152.682 1991765.53 2346827.334 2139235.963 1905928.874 2883448.657 1691296.557 2606126.294 2492579.803 1823488.704 2368370.116 2190798.116 1811322.681 1690918.725 1896103.345 2440546.092 1547093.243 1315985.7 1169226.708 1495401.552 3984538.063 1566086.056 1275682.717 1476099.567 1034631.175 4801692.029 1364757.776 1153991.719 1568885.74 1178867.444 2439496.694 1466054.173 1506558.584 1206094.681 971428.6868 4246250.43 1170374.043 1196307.519 935673.7413 397997.532 2318879.926 1313693.046 1488945.364 210499.3896 892735.1977 4973183.851 1800133.709
ophthalmic acid 22481102.91 66185597.43 43969762.27 45680728.14 53755254.15 62430832.13 12013058.7 57699467.43 41060413.11 19785413.74 17273517.64 20346382.12 23066436.25 60341797.24 49531099.11 25485671.44 27457806.21 39188121.45 21907545.35 69186944.45 57898190.58 43898724.59 36933858.11 35068281.44 23126087.01 55057015.43 40353085.67 27709424.75 35710185.4 33114893.22 15157707.52 52752467.25 30310265.68 20848280.29 30194060.84 36299927.58 54759932.28 53453985.67 59862181.03 48232024.25 61032074.08 13253922.97 25633841.92 52081417.03 11647623.96 54584332.03 38593261.54 46377055.92 64278474.31 39618716.93 65560314.35 36462908.21 40585423.95 56876512.83 40939632.6 54737536.99 53188929.97 48281442.61 49378752.04 38601950.79 56546459.7 37819881.68 46856014.33 32062870 48632322.97 47717973.93 42279745.18 47721617.78 67589688.81 49522224.89 60727494.98 15913658.79 23489854.29 18746705.6 22450434.16 18537275.28 6881843.528 12465851.32 11778543.59 9616173.256 9729946.014 894959.0825 2800449.141 5650321.457 5206468.12 1821198.67 1310723.409 1979076.78 506236.9604 3959554.895 2460137.455 1641431.742 385660.2632 3086461.469 1994108.821 2639695.958
Orotidine 8967604.588 11873974.06 10909715.07 12343121.42 9659935.763 11712291.04 3908168.308 9427376.96 11487964.58 5583619.196 2432242.284 3840078.565 7688164.098 8725106.246 11906574.8 8318560.998 4282848.429 6690637.374 7549475.817 9719980.624 11973067.51 10587113.74 4555689.678 7127750.834 9712653.143 9753487.933 12083572.38 14424519.94 9676103.112 13987459.76 11289810.54 11563496.38 13520003.41 17267395.28 13402157.03 16514020.25 11989085.76 14227083.94 11384215.81 10848093 15819936.31 2005784.253 4103196.513 9829697.024 4894959.962 15789159.3 6528140.123 7478516.41 12822835.8 5758363.789 16961404.51 6302706.01 7115074.503 10849901.74 8516912.747 15621997.95 9487116.653 11365751.04 11465593.54 10599815.32 17528459.26 10936966.61 12153706.1 10970353.3 14348649.87 16049644.56 10301036.36 11309177.14 12671788.16 11241101.03 11780971.77 10987461.19 11579940.39 9412655.903 10787624.26 9451524.937 10345701.43 12675268.44 10607790.86 6675368.828 8765739.604 9946311.637 11101691.11 10879651.7 9602826.097 7946721.756 10684012.34 10709664.33 1434288.918 10590742.47 9043316.501 11993275.44 6457223.764 10929282.36 10975624.33 10676473.89
O-tiglyl-L-carnitine 716092.3497 1440622.37 2327639.779 3066545.079 968677.3857 1297349.053 814955.2073 1223188.782 1966341.096 3539367.1 1308545.943 1140906.551 1441950.791 1585052.036 2593217.494 3295255.409 1481131.825 1511004.325 978147.5743 1130938.358 2708651.386 5537606.973 1189660.097 1202320.94 1257383.021 853945.3977 1627557.106 2087495.168 1003083.146 1142591.201 957543.454 809881.3474 1930573.738 2977291.357 803145.2113 1109907.88 7712872.393 1036640.693 1827872.367 3959270.576 1531146.994 7361711.391 1614237.456 1472546.173 619754.9716 1344215.391 9267380.46 1849942.433 2020504.201 3720430.524 1873935.264 6053636.982 1480666.137 1370512.976 4136560.404 1372509.963 6778357.233 1463463.482 1271284.712 2753734.411 1073775.129 5007101.818 760494.1561 1229781.826 3755430.877 1372663.075 769606.5602 702628.9935 1176024.325 796526.6199 1230653.407 858533.9793 623399.8004 586460.9491 1126597.019 818373.866 607572.0427 641396.8472 747332.1681 335996.5347 801990.9964 664522.6793 500758.8042 726150.4219 924437.6434 489704.2597 461137.513 571202.8615 29528.31432 567622.6747 749693.0707 504045.885 93981.95135 552433.314 744400.5549 1113727.154
Otonecine 1015546.122 3092796.214 1639232.357 2241574.847 1048771.697 1739006.989 1128418.896 2630109.912 1709232.292 2339545.325 1413567.315 1763886.675 1529663.546 3145444.085 1939696.6 2030925.16 1485233.654 2172971.971 1485376.989 3025876.9 1647127.614 2978308.951 1177055.34 1846627.972 1481009.2 2308676.207 1421903.34 2103571.049 1274317.218 1791275.077 996688.3189 2482628.693 1704696.128 2175362.275 816437.4254 1808388.725 1281674.842 675385.18 1311843.167 601998.4971 1361166.031 1122536.095 1151100.618 1467514.86 185341.6846 1061700.013 1452997.863 1391172.1 1523324.113 1104802.924 1293447.338 1258896.201 1252277.161 1266445.91 930548.9789 1435476.185 1162469.811 1153362.919 1503974.533 801706.8919 1142660.485 1210164.344 459613.8177 1275140.428 799632.8933 1215575.579 382790.9654 356553.5965 343893.5489 327652.0558 376187.4101 349150.4481 198677.1759 236339.0641 669113.7896 366926.9161 396384.5766 359937.578 251535.2325 459450.6782 326716.2809 311847.5812 357580.9323 400748.5263 544581.3826 334112.1829 349792.7626 377862.4143 39324.37433 260980.4372 253808.106 445622.7228 44009.2938 255949.8674 551280.9537 360485.7253
O-ureido-D-serine 18359069.9 22462857.89 17258266.52 22778173.95 19246622.56 33686724.77 6805667.774 11808743.25 25712602.51 18238452.91 35090375.02 18774875.67 18303473.71 35224897.05 16594039.81 60414517.68 43035546.54 51736050.05 33340920.65 41229524.61 59822551.94 41295205.06 52920139.85 40596272.39 22285195.01 25572266.93 25099368.67 19043430.75 31907862.57 27580696.99 21303517.54 27546030.39 33900562.47 17322004.93 19783809.41 28663085.32 29353139.77 19432183.41 15245168.1 31951528.2 24892639.85 9801855.49 20049520.05 6304024.076 4635480.202 14020864.42 32446702.32 32864393.37 21053080.28 19931990.22 26590116.23 19835467.5 22303677.48 16834291.6 50581612.04 30939107.17 41318627.21 32027769.39 14231236.62 27715912.49 34436308.41 42964059.08 24825050.91 20181469.84 97476161.05 46670286.2 11826419.7 11885863.89 23253306.87 10476175.7 19338550.66 11466539.44 21797954.29 10552017.71 13132921.53 6693584.805 6484225.306 21211001.02 12147032.81 41842839.03 4285170.146 12307822.75 12444086.84 16834204.12 12963898.33 10728496.22 10545429.6 21784563.74 1947951.423 10092420.58 8864770.827 67798657.49 6099681.297 8144162.26 7074720.69 7625585.991
oxiracetam 49695744.77 69957808.1 56489403.62 57481864.78 51686501.45 55318080.82 47237717.58 55687182.48 51185035.36 63438312.74 43169608.07 39330725.62 58324230.41 60250277.14 59025129.45 54764664.65 43562252.96 42173943.17 58107043.78 59011133.58 63068598.93 64107568.38 42060970.54 42396904.79 57648090.05 61223548.91 43916223.97 74734377.44 55453322.48 43070955.41 66640820.54 58520930.1 51574948.36 50682604.24 56309419.51 38244486.57 82857275.46 144842199.5 62460279.22 108087481.9 116302760 85751290.58 172690311.7 49958230.71 236938574.6 102977665 100926610.4 167041527.7 70669289.38 121426495.2 114671935.4 78298044.62 136508622.3 64820902.52 110226264 101303304.7 84227965.08 138936914.6 63831292.19 107453426 123819010.5 81447171.93 132364884.9 67077823.95 105438258.7 103161803 78647531.04 67853728.01 81980696.74 87260299.91 88623521.24 83588609.95 74610490.23 62105872.37 72117575.8 95039580.92 81148428.81 78619037.63 77874511.08 109580119 86538967 83630838.68 96942934.09 79278869.12 77532269.93 92107369.54 86756783.26 80873048.29 71280579.98 94461895.84 107487099.3 89355945.9 147626887.6 91764980.06 79775980.76 108966302.5
oxymesterone 757228.454 747694.9887 843447.1039 741678.7906 793053.9667 734257.4589 727688.4625 837225.8462 962184.8582 695828.3218 744339.4522 716686.0281 4003383.921 1036295.451 2093757.919 2664188.581 1566053.542 2629067.296 10810429.3 3841312.08 4933553.627 12395285.51 5616352.806 3884171.281 11615706.6 3622210.084 5724918.4 6893654.364 5655573.657 5159081.594 12758694.57 5658284.296 6957715.707 8329425.204 3333745.399 4071111.938 740144.7171 502157.5959 589412.2789 765556.2096 808761.6811 764025.1109 815159.3413 659694.469 348886.8019 624850.8577 1240531.462 855597.0301 717966.5894 1186293.294 1504991.559 1671618.991 1545419.945 1210163.807 5256036.838 2491549.494 1836883.249 2324471.946 2095382.061 3152230.427 3763053.221 5396880.061 4046464.335 4431842.348 2779452.543 4903314.456 736474.6581 999509.5547 657678.0551 677367.1897 689141.8251 1785997.762 1116554.556 1419940.86 1164811.809 874194.0718 7243817.548 4340577.868 5233665.088 2141970.838 6602869.396 63662929.99 62901422.35 49595562.78 44651540.16 37090450.3 52009404.3 55325843.37 2394267.544 30669243.02 52637220.45 60135295.3 10622731.1 47842529.91 50614835.11 61458902.24
Palmitamide 7589336.377 5225530.567 7762437.808 5977460.765 7426715.184 8140089.282 9261716.379 10085696.54 7879261.956 5617317.84 6735230.877 7672958.512 6181080.277 5073708.899 5896880.246 3854018.43 5032171.548 5574713.983 5809362.926 5420819.686 5829838.795 5334458.873 8174529.962 5940532.792 15968648.94 8676256.248 10284325.9 11816922.19 10664914.37 6519677.977 6997114.021 12266837.35 9390039.509 3700952.195 16127585.72 4379427.469 6750188.395 4096812.102 14031305.34 7159431.569 6185686.707 10389574.42 7068091.488 8605160.474 2828404.534 8445492.131 5747750.312 6988092.781 5012690.65 6784915.029 5191433.554 6661491.349 5625192.214 7923624.57 4882890.755 5033044.617 6451360.764 10102330.88 7600754.204 17081009.99 6633880.652 9501658.548 7056038.496 8592164.652 4088625.276 10521120.55 5037474.29 7808207.336 5420780.136 6780730.405 5664917.817 11712183.43 17269680.16 15763201.3 6666176.963 7467872.965 8817226.491 7030619.581 8626506.863 4752809.579 7309340.984 6992331.496 6416078.59 5627298.155 5786971.643 4148667.955 11488463.58 12139760.1 839213.5867 8176034.494 26305452.34 3552796.627 3500267.518 6164245.426 4600731.088 7008989.247
Palmitelaidic acid 9178007.511 10873008.78 6830471.31 8061925.87 7809778.648 12180131.8 7432847.143 11523291.37 5567891.079 9493650.457 15051038.18 9157092.652 8569906.015 14206734.25 5359264.682 8677352.443 11799339.01 13387739.26 7517837.848 9998594.297 6319946.332 14096447.33 14485000.04 7381757.266 11071270.74 11570213.56 5146198.891 7588885.012 10983577.02 9239294.499 14008046.07 13133065.4 6941250.411 9902117.217 8696654.065 11242552.56 6422679.228 2880030.113 4515164.979 4901662.672 5291438.611 9984074.03 3805136.362 5607013.385 1254611.104 5230144.195 7476274.471 5874997.304 7312702.603 6839506.048 3305503.086 7297069.343 4875635.645 3852317.604 3729612.417 2232442.556 7223636.508 6676998.515 4550851.076 5218585.579 3677365.001 7193391.353 3984985.296 5571305.856 4374205.009 4696639.965 5730267.644 2679879.977 5254684.245 5013949.225 5712703.756 5931714.94 3723463.127 3994859.905 6978189.895 4352981.204 6667720.414 3613616.494 2652555.086 5191088.758 5535459.064 4562490.491 3177323.386 5871301.901 5718748.834 3583186.767 4742214.253 2723643.579 523127.6694 3455017.765 5552195.391 6360631.531 2607640.218 3731516.567 5713982.252 3935929.056
Palmitic Acid 3900183362 2507093609 2263162636 2625141250 2117069321 2714900811 3961128112 3035865234 4598827661 3156904513 2934098998 2613322987 3198292240 2471835086 3137703597 1757057065 2894016912 2772860283 2863474649 3335202363 3010849731 3186382058 4317976461 3123489966 6054693855 3786813395 4098285217 3517835162 3004422948 3014665078 1577278050 2031168646 1373016668 1070996887 3739793490 1443038996 3214427845 1570685198 3982651858 3078217917 2561696796 4766013645 3316060028 2731978244 1120145748 2977049218 3311541873 2767528994 3091211011 3198757109 2694662885 3944596863 2359364754 2502577453 2493905532 2591221945 3559253752 5603727612 4320597239 3317207991 3349644961 2103638568 1578590582 2238946832 1098898254 1413525965 2925581379 3690419210 2501185328 2538505851 3011891052 4068506344 4601970300 2795628382 2741669032 2976350723 4474221332 3801293941 3533171494 1737380735 3703650801 3348099530 2868223560 3058211666 2665094848 2801979648 3948208359 3237328223 327898411.2 2373913217 3720843505 1781674514 615220838 2077556059 1918615574 2337978320
Palmitoyl ethanolamide 163802098.2 92508399.01 87452929.61 101097515.6 90257672.82 96691677.21 132152486.4 106613029.3 147911620.3 124061236.7 89567404.04 122516523.6 113547490 92087595.28 116602334.8 66984540.29 101560404.7 96000013.66 113096912.2 98210880.49 120719506.9 123479749.7 154191124 113346135.6 162323641.6 129914578 150937375.1 154952081.8 103705559 127930139.9 11474725.48 21452134.45 8503492.313 10005728.24 17651986.95 6764032.065 118535522.2 75011927.88 142090028.7 110145561.1 103555967.8 166972902.8 122799318.6 128054792.1 38101184.37 124179047.9 108538100.2 87649323.63 105528184.5 103775688.1 114689002.6 117439733.8 104259605.1 92695029.59 94009334.83 113886328.2 143330059.2 179871458.5 160244544.6 129891885.6 150452644.1 14080462.48 10939270.88 13149397.41 3919785.642 9184868.761 117365654.6 120353124.6 102148711.9 86745966.87 106490806 131513782.7 121086629.2 115718817.8 110086833.6 113516960 131363210.7 143211828.3 134359694.3 65618389.6 125173535.5 126210592.5 118009910.6 133341642.6 115524762.2 84648751.33 168595776.9 113707686.5 8733719.66 82424186.24 169820883.3 16702551.48 5403849.576 16888996.86 14547106.37 18512208.71
Palmitoylcarnitine 485423151.3 623045772.6 534577014.1 688322455.7 672489646.4 910619157.4 406076846.3 482530763.4 704795692.4 378037891.1 491908528 395086756.3 684296062 760899254.2 734851256.7 526583446.2 492732969.2 571704423 684611547.1 766249597.1 1163755672 837105902 669845024.1 455752406.1 852354601.8 627396751.6 835361474.6 668444312.3 654317652.8 531536025.7 979031424.4 913548577.8 915211968.3 854005367.9 906952867.6 1127063488 599309577.5 535861899.7 753901700.8 550469416.8 652263901 138544074.1 432574711.1 715509625 162229836.5 811408362.8 575441895.6 737977128 849758601.5 657621898.6 1080011857 619682112.2 794174060 773344288.6 795081512.1 997037070.8 879292715.1 834601888.8 757027596.6 748189562.1 769607538.6 860852446.4 869737583.6 825125963.5 775558748.8 1071527672 551494164.5 407669706.7 606259498.7 476679067.4 519361978.4 599382994.1 621780614.6 487402530.9 533380654.4 614039568.7 449870841.7 544191912.1 416963853.5 294660568.4 686524298.1 473771974.9 495604753.2 396435632.5 507003268.7 384153130.6 441675949.6 434114162.5 31657029.1 387436638.4 592660665.6 452386057.2 154446772.1 281595121.6 498265109.5 503317107.5
Pantothenic acid 35486943.9 51729622.2 39211117.21 54136185.61 48834966.76 72441559.69 34860701.92 43937996.67 36676192.32 48162918.48 51598870.68 53915072.08 52689709.08 49208700.9 40879549.47 64672629.37 54144773.97 71656624.68 45486353.49 46759562.19 43699444.63 81154188.09 55845696.7 73347050.23 39019213.69 35825719.38 30205638.76 34884808.31 48674753.86 62483718.65 17579357.65 24988464.92 15800061.01 11400580.58 16586702.28 43449098.44 33469116.51 27009128.65 20000014.49 40846023.14 34837888.88 26362772.17 19842081.76 18331118.19 9661545.234 27381387.56 37284214.08 25332317.74 19494259.06 47430760.01 34685059.53 26425142.86 20449418.41 14132981.28 34997872.09 34983642.58 29491019.65 24401497.37 11081299.39 29385162.39 25777188.13 8308214.334 9669398.226 7226066.867 15445322.65 22982363.84 65167552.19 68270820.89 94997576.29 119113813.7 77639119.91 80745758.05 80216423.24 68279921.5 115255489.3 70531044.18 4216584.739 68165843.58 4951627.142 3672853.936 29876099.15 6378909.949 14191521.03 1712059.577 5498926.011 6677108.304 8034797.014 17608617.12 318777.203 7023838.774 9211725.743 12315502.72 5319592.721 4049525.141 12831450.92 12697057.08
Paracetamol 1449070.906 1832288.537 363907.437 2160669.738 1635240.849 1241190.2 1580051.942 756616.9102 1307034.574 765600.4887 646875.3792 910962.108 1288474.448 1560177.32 2785567.461 1693216.975 961815.2587 2927881.65 1998988.477 3243614.816 4847803.043 5095745.36 2116633.713 5109303.411 2710490.954 2362015.333 4293600.339 4805891.75 6527424.406 10990235.64 2263515.102 2257178.028 4530012.413 3681695.698 4136034.498 10042742.96 1186549.897 1515934.841 774661.7552 2153255.676 317119.316 497008.3997 210551.0957 1019534.893 1367919.386 682417.1045 3945956.601 384428.5687 1564849.478 1708102.557 1398825.745 4887483.616 339066.9683 2631716.899 2645065.096 2560202.405 7172322.237 1884796.365 2054106.632 3450738.386 1934739.182 4534028.971 902995.305 2817871.689 3636054.452 2119843.986 2156665.971 1709448.22 626082.5777 402254.7305 416193.1803 2048537.305 1866945.753 1529951.611 727724.9592 1668127.253 1804369.235 1949236.093 633413.362 1184302.881 1705151.428 225510.574 1725320.986 1734542.386 1515365.469 703182.0829 1338586.481 1595590.976 1083262.615 1112085.13 1286688.556 1213830.467 825349.3637 1090968.468 1260654.406 848092.8281
paracetamol sulfate 14123144.38 12167050.46 10816499.96 16914105.25 13472030.23 15578162.59 21434250.3 17676769.06 15697215.77 20562298.28 26825682.78 14038412.73 16231915.05 12309309.5 19570114.62 18747261.65 19505264.09 11133719.84 14795392.88 16679943.17 25044137.55 16847186.53 21747275.83 22191002.41 15911340.31 17137848.01 17004328.8 18619684.81 22233497.41 21255029.77 17188237.51 47212669.45 25674858.21 36709979.69 27868247.69 43326145.06 14692013.4 13477380.93 22141531.08 17212836.52 13376799.35 13891114.46 29834384.37 13637078.04 7642261.754 21787557.2 15220017.14 21676433.82 15930655.44 34362974.61 22725169.23 13768352.66 20486677.4 13389311.58 20066780.19 16236581.44 23666475.11 15842735.25 19071589.64 25928795.89 19866837.21 26510650.99 22478358.39 32270017.16 50464286.33 41472899.79 13000224.07 14587314.69 12519042.02 15217021.79 12667346.42 20702509.19 17754528.73 17560065.08 14282109.5 13248820.89 13970356.25 22271726.72 18739710.66 16226533.71 11320440.11 26154340.57 35305621.95 20686951.6 17051303.57 19854438.62 19687688.8 38965925.14 3397855.572 16674426.26 20824662.06 27873541.34 11294615.91 37599295.64 37145308.12 23060053.28
PC(o-22:1(13Z)/22:3(10Z,13Z,16Z)) 10780119.55 45747690.4 28495922.94 28760275.78 26974948.96 47156523.1 1794975.843 16815267.11 19823771.49 11034798.14 15264307.93 7343916.008 26112679.56 34590280.43 25053999.52 31996576.96 28392080.73 29289673.3 13603776.41 27444866.93 31620211.79 34864228.34 22288394.62 23524980.49 12200677.2 3832143.129 10506609.55 13028149.04 12468165.42 15100356.31 12189604.28 6464841.904 23938594.12 12519624.87 4514066.779 36543173.06 29133304.99 27457225.76 28492813.42 27364562.9 28487763.45 3188974.511 8375806.391 7693923.58 2160958.987 7789025.751 19704138.41 27417020.02 29149100.76 6221464.278 32467325.58 4111363.331 17188286.03 4964571.737 13601052.69 20858298.01 12079418.66 14624770.12 6060236.744 1730653.536 11692454.35 1722592.605 12908237.08 3860443.891 31416837.02 17016478.56 15951804.73 15470414.54 53074551.62 21806008.15 42767638.32 13539385.36 24606385.81 7203058.434 9615421.26 7161015.652 5415406.793 36973351.15 22575603.71 3017212.502 6754029.8 8637612.747 12909918 13503661.01 12783034.65 6186761.124 6599117.737 10764783.56 2108858.529 14340872.26 6099359.625 36381250.88 3194132.268 7469482.35 11230564.23 16961726.44
PEG Diethylhexanoate n6 41033127.5 26818933.43 32878482.89 23877584.7 29480149.54 49794612.08 25736490.76 27857204.85 30942936.79 27291071.87 29023523.13 21595661.75 31052509.63 26789019.14 28707992.1 21363810.3 34824454.02 31163706.73 21002177.75 25085400.17 28636910.74 35892950.71 25621142 30947497.63 44499938.86 43540748.17 32490785.45 39463659.59 34719846.59 39589886.33 27696102.41 39510170.79 40385214.54 33540384.31 44125431.22 63315287.19 30138694.36 14212740.12 37355052.47 35341682.63 31318083.73 27798226.32 25469879.52 30297132.73 6867139.778 26209175.93 22770472.28 27486780.53 30961279.06 31346451.09 26076028.21 35395059.57 27381464.67 23647178.57 26435470.82 30232121.39 25196109.17 29003840.87 36471507.6 34652185.78 28544080.54 29737021.47 20541332.61 34922224.08 35611924.18 40077757.89 30853317.77 51349561.37 33410017.76 23184625.06 31024515.8 32148381.52 31685813.13 26869841.89 36369337.06 15136792.2 34586306.34 34512989.92 28980039.91 12564499.27 31378234.01 28926253 37463709.68 41210732.19 35534044.4 30939514.35 38364232.53 38791827.65 1324399.49 14371954.35 26818201.03 29690236.52 7218999.506 32749157.37 39806334.26 44971292.51
PEG Monolaurate n6 78468166.58 78217793.5 110405534.2 107031387.2 79343296.94 73599682.15 110299535.3 100118655.8 161005931.3 131264716.1 108609004.3 113149286.6 253303341.9 191292960.4 269077984 196957766.8 158100057.1 218900971.7 309777328.2 187450761.9 353885758.7 366092482 256844416.8 286758440.6 420538187 219773144.6 300296300.3 298135556.2 194172243.9 282678326.5 420763008.9 230193055.1 308981784.1 326207700.2 170895043.6 368362120.8 123072386 96917319.49 148349594.1 106256871.9 98021770.76 116757467.4 176486933.9 146088781.2 34194879.47 124399833 181142937.4 237250116.2 194188564.6 208280597.3 261533068.5 224922239.1 243988551.7 224072338.8 276680525.5 253792156.8 223774757.8 281139684.4 255977852.7 235119973.3 260565627.1 231498990.3 185399176.2 244691943.6 152938069.2 210997074.4 100878749.2 82158292.03 120597293.5 65544342.25 101790885.7 147409419.3 146700830.6 157383905.2 119467989.2 213471818.4 180765025.2 201637755.1 234214211.3 102446445.1 268382959 274421302.1 213401458.9 303127843.7 217893299 195961207.4 183246897.3 158630047.7 13922420.68 151989411.9 319165989.9 158681876 48544392.21 186391942.8 183110479 252446658.6
PEG Monooleate n7 324249719.6 242226198.2 239972872 229205338.9 248771922 312780384.1 218395966.2 228874285.7 288528697.1 197474344.9 244729384.6 208980749.6 285576537.6 252477299.7 274757920.4 220172496.9 359385100.6 284467410.7 211088087.9 296785530.3 265145801.7 266184300.8 221083445.7 283429515 341732894.8 339626575.3 335338303.3 330050392.4 294281704.7 346079896.8 324731063.8 486642732.6 429148998.9 379712548.5 505333858.2 524639466.9 265368613.1 200615172.1 289024805.1 264647589.9 280131978.4 193128846.5 258271802.6 219354463.3 48731003.68 221309190.2 237660666.2 166271139.1 313399966 222109162.8 279886645.2 196938258.6 261814292.5 265440253 234448069.5 273185772.4 314875324.3 314644770.8 276326224.9 329605917.1 287841715.3 286750850.2 271066921.4 363102702.7 336876830.5 450906326.3 211732992.4 345604643.7 220859272.5 194585952.4 307506076.1 228701841.3 273408349 207293724.2 354111832 138641668.4 304065951.1 364699847.8 207205703 160306575.6 252996510.7 245821753.9 350945722.6 264295861.3 405905262.2 275715792.5 387390393.7 325917598.8 12003554.62 151253198.2 433488179.8 382289764.1 77783142.09 346047814.8 414810693.4 361040886.8
PEG Monooleate n8 342414938.5 276984821.6 295029721 327072742.6 297822130.6 421616204.7 261203210.2 291433478.7 377894691.8 238510051.3 306030182.8 261524099.2 356735276.6 290661501.6 326180736.7 242701897.1 434211051.1 369339853.8 257113466.1 353541147.3 298726718.2 287149864.9 245972586.5 313434594.2 441415224.6 403530718.5 394803701.7 436219858.7 384690605.8 390913744.5 440775170.7 544655806.4 525176939.2 483418624.6 565921288.2 620957700.7 312009374.2 261039529.6 341216173.7 321020374.5 359225158.3 247897312.7 317554314.1 273235630.3 56191605.17 247572262.5 307124526.1 204636524.2 352223451.5 269940506.7 304383967.4 248859307.8 323241386 329466863.7 297623581.6 355046217.4 371559167.7 393726863.9 357420320.2 352413189.2 342630506.1 348404554.1 303947480.6 440225292.3 424143272.7 556736717.6 253049872.5 499098937.7 286274797.3 226104646.2 336895699.2 242121086.4 283908987.4 268250173.4 450085081 193982087.7 377017905.4 411933252.2 326953659.6 172465805.3 336135889.4 284757416.7 358226301.7 322929584.3 496294475.5 314283973.2 427002479.2 398593674.8 13849862.9 161860077.5 551014445 482314790.7 94208419.76 404933988 512975919.2 500502344.9
PEG n5 4599108197 3190893912 4177218366 3014118214 3502920303 3640876832 3093910967 3187859932 4073189468 3122805223 3353577500 2428901253 2404027580 2031232027 2403291577 1784370795 2801501515 3252522427 2283812226 2323547585 3056727045 2399408641 1969459345 2980010963 3846587407 3103909808 2564025068 3545921627 3142494176 3694585116 2448135939 2134623746 3151916931 2873593238 3504527313 4520101201 2608657397 1420374369 3074402516 2780371471 3358900220 2417466793 2583997902 2661338496 539349632.7 3124114881 2837637606 3898790343 3888144226 3093274910 2654190951 2296214063 2403511634 2762284686 3178006780 2690029773 2159333618 2972360372 2714162499 2693693365 2634812047 2161456701 1564142133 3765317148 3017333293 2814310045 3518045897 4687129162 2810907643 2447480924 2742185258 3261608842 3876118837 2862819873 3160140273 2126027251 3121063543 2815483179 2725931864 1446956523 2515118082 2252292882 2202992540 3458830229 2712799237 2666475581 2689278792 3423618511 125854430.7 1154526499 2431108569 2102332066 489373212.4 2343275968 3359630557 3311138521
PEG-4 944067280.3 471035269.5 810738810.3 604751401 670751693 732671630.1 623784196.3 672459002.7 767514021.2 594908324.5 673593607.9 432426116.3 475272540.7 420871358.3 451500043.8 647727658.3 617969232.3 639053856.5 445693254.8 432941483.1 735241516.7 502002155.3 340815549.9 562647041.2 872863719.5 494687533.8 451611942 601683714.5 548104253.7 684803063.9 347026329.3 306503458.7 538282903.7 502430402.7 564338964.8 1374831880 511399153.3 420623520.7 610937688.8 544909861.1 669984147.8 405052233 527324074.8 467142443.4 165490862.4 560572967 585997474.1 959242023.8 743766232 632441745.5 514472341.5 492495730.3 435330046.4 495865388.8 640198481.2 542896106 348230193 618999724.8 493515970.8 604132879.4 506531099 313091900.4 409521934.2 739163957.7 898459383.4 425385510 683514028.9 999807918 614661512.9 785010987.4 753019969.7 656877531.8 882897967.6 512814555 556058159 337547492.1 689959182.9 554067845.7 513759437.1 458365572.2 371990811.4 353918475.7 582497026.3 663940850.7 383885804.5 811125496.8 416074395.5 946569577.9 33478473.97 313057692.7 336075594.3 510649264.2 120422575.4 680697834.5 625788698.9 504760356.7
P-Gal 33248.52526 32916.06054 42287.69944 33102.57362 35534.64321 91159.24659 45584.67131 39317.32833 41221.96759 77789.14421 135287.8779 139941.5247 48199.64347 48526.30763 81997.31836 143856.0892 300638.4553 336622.6059 145059.1923 74351.67355 48285.15659 70386.55177 172702.2509 392887.0937 74526.17275 68076.66629 52478.95836 66414.58637 175960.3356 389848.4875 67300.03732 66094.96872 71088.45067 101021.8836 169918.5667 238556.0537 34287.48882 30993.90236 31002.10997 42787.64486 35255.39916 63709.44967 49304.72162 36356.9596 30566.18909 37780.00996 59913.94865 45296.85414 41942.56276 61679.26075 52275.36048 71937.10028 52033.32927 41460.7512 82250.84204 43114.33712 54813.72347 177393.5452 47005.56852 48742.25782 67685.06419 81550.24759 60066.39444 61684.06875 64493.84699 65462.87887 274312.6192 249518.2604 205173.3243 107469.0955 40134.37883 683457.4438 585304.1394 394065.0115 986825.7761 684544.6415 1275911.209 1055836.65 728791.6462 2787572.875 3392534.963 809016.7641 890613.261 467882.3629 4804305.162 1140882.994 580951.864 498968.1329 41872.42055 1657437.344 925762.1138 321169.0238 87662.55231 163382.7306 1178803.617 565771.7642
phenacetin 365788.9367 1326020.091 1900655.181 1539556.427 1554503.373 1823647.287 2141281.442 8235595.768 1480473.259 1799636.487 937476.7384 1974893.936 1625445.993 16569158.04 2705081.682 2078404.438 2368091.194 1062960.526 2833588.892 19886293.15 5282260.892 1270473.299 1640734.215 1954916.735 2102315.224 15048301.25 3595108.442 836360.6424 1649326.792 2653315.12 2370486.746 16231389.77 4454759.452 566281.3589 383188.2779 3426806.72 1054213.977 1892888.112 1586137.797 2238288.097 2161876.922 3178867.117 737597.018 1132370.376 1001012.863 2526307.07 9221796.712 2053621.136 2733946.666 6858296.99 1111787.046 7094244.653 490006.3986 2533586.609 8135124.674 1575661.028 9814891.074 1205592.028 3321222.844 6467114.086 1235555.85 9326496.342 746995.0733 2579498.49 9999084.87 1502082.26 1750524.94 1699538.399 1828916.862 1655712.747 1213440.286 1602271.218 1803391.395 1257246.026 1370497.834 1196617.66 2306456.14 698610.5735 432843.8033 1648568.255 362648.8213 1338344.147 1740365.116 448571.8893 1766927.857 1217002.61 1485513.018 388900.2258 1361767.996 341757.459 1632947.706 1541548.303 994226.0769 1277945.178 1367948.856 339159.169
Phenyl D-glucopyranosiduronic acid 366674.0995 4204057.905 5636516.123 3869277.874 1938057.019 1788946.832 590082.2782 3830607.095 5310074.57 5653057.038 3815048.406 1746410.11 698907.7549 4776923.232 5698094.174 4163082.384 3109740.365 2105685.6 566813.2628 4069359.548 5993820.378 7135535.744 4187333.046 1989424.445 515498.2761 3400586.273 4917389.732 3663340.927 3035675.709 1657010.852 390944.1958 2990989.026 4711056.213 3355255.785 1546378.86 1315464.071 25587588.04 4174249.035 5606368.162 5874476.157 7277712.648 35248564.32 10917083.06 5312989.188 1146800.709 5996368.77 36895590.86 11459240.71 6127408.774 8270877.954 6928202.452 26563255.94 9410145.28 4950474.807 7938638.292 6144592.405 24677290.79 8172780.882 5065318.022 6144538.376 6323427.342 17357555.09 3974557.883 5040154.556 5224398.684 6126900.301 3827632.077 3791595.256 3447746.535 7664109.817 7120131.497 3848959.053 3647029.005 2726815.223 9828385.459 5643070.791 3835329.664 4638749.205 2936620.016 4177594.907 5740350.394 3519807.863 3447141.531 2953154.229 8069568.035 4103154.374 3663584.416 3801825.802 93317.76205 5143130.259 5615067.657 4340172.853 602475.5651 2271978.83 8006352.188 6185124.473
Phenylacetylglycine 18842696.65 31009659.32 60860606.06 54179401.09 37145845.47 41546258.48 19922276.95 25296217.24 56387934.5 53634984.4 49058165.1 37006352.43 27982540.55 31101487.91 59665513.86 42750267.65 49229034.59 45610909.5 24544877.77 29881693.09 67324422.04 73883361.1 48520522.91 42684304.34 22655457.49 23425497.17 53764281.94 48749958.41 42571974.19 39386324.36 23154902.68 25238758.37 55238265.24 50487562.01 33143126.75 48661614.99 152343061 65310239.01 55962982.21 96598663.46 101775886 133267458 117496194.2 51980254.6 15218182.14 79852986.18 172234264.9 125638009 60715095.56 103709271.7 101025639.1 127295383.6 103507196.8 50439076.56 100935051.2 90366160.7 146579742.2 104587047.4 49208453.1 84436659.96 88970886.82 128111925 61229591.29 52499742.44 92793349.19 89003362.29 38823309.87 47714619.22 50843079.42 103280489.4 82350440.96 40980130.72 47634182 38653553.59 137773906.5 67768347.16 41433938.21 59281362.84 42865411.89 53003713.13 71230313.24 37732054.97 47720216.16 42009509.15 118365159.1 47707432.54 37364126.92 40553763.65 1503330.774 66579035.41 66846774.25 36868812.79 8910873.739 33335627.98 107475990.3 79019164.3
Phosphonoacetate 7558450.341 8862663.556 7066303.12 10410545.4 7470658.759 7217117.056 9078835.131 9775599.382 9091113.515 10605812.04 8696638.91 6144128.573 13216237.68 9526307.946 7231903.099 9463214.19 7713059.426 6980335.044 5350938.846 9931060.331 5195275.04 10487518.55 5615400.944 4781004.537 16753648.75 22400771.09 10940394.34 13080748.28 8153937.809 5790200.907 7644352.355 11618737.14 7427385.952 8842815.319 5455045.723 4800407.501 7370972.643 6781420.401 8824017.299 5973174.962 5191606.124 10678550.55 10172360.45 13004091.2 5196943.318 9074239.111 9852587.522 13414908.44 19634387.13 7040552.414 11403816.9 8993626.713 12329362.29 17527493.14 6441477.862 10878916.02 33360494.61 16729347.57 16525782.07 25162962.12 21789411.23 24033317.46 22705472.93 21293009.41 11974236.92 15776470.5 20030397.34 24246512.26 23511282.34 21251683.57 27727083.39 12346447.14 8885193.933 8417326.181 17944816.48 17948024.97 5153651.221 5912629.582 7538081.035 9638777.46 6655772.654 5597331.784 5660384.198 5485634.047 5679562.807 4760720.704 9159149.917 5731346.858 3380883.927 5909258.624 8573620.787 5694043.852 5978763.544 3904527.484 5833112.614 4239760.905
Phosphoric acid 591435473.9 525597340.8 602432611.7 591892303.2 535998942.7 825374910.3 497854055 641508010.3 637557249 585856239.2 443661163.8 985382913.4 509798924.4 628418722.4 630745501.2 600594145.3 540985174.7 994366381.9 676394213.7 832938740.9 904676851.8 833544706.2 704071084.8 1296238681 969698973 1063335684 1371652204 1530124849 1174220941 1754311977 1075915525 1032502368 1449458631 1699510049 1645723639 1846878038 1026409738 591991974.3 734315403 836733396.4 702708491.6 873280398.9 477788788 852926196.8 824505898.1 750377245.1 1063011258 676796981.4 939020746.5 1020120249 843814462.6 1395705149 932934732 1435598353 1210809624 1122444592 1503091544 1264903524 1565286233 1411746431 1198197654 1721336988 1652467505 1865827495 1555546303 1302882056 237649546.9 253729507.2 182621904.1 256704797.8 294032563.4 342163834.3 339938120.1 184672580.5 104054259.2 229239701.9 956156086.1 830202020.8 521030327.7 512451523.7 831157926.9 1338077861 1278297657 1121585999 1026011761 1288592290 1455446718 1544920489 438715704.1 1249295566 1377957532 1715812603 1262944268 1323659727 1062148980 1234011474
Pimelea factor P2 5993751.453 5253543.372 6988294.916 7330785.984 4302495.153 4112396.053 3120917.843 5472028.684 3767556.497 4096359.237 3469186.711 4759076.009 3919698.804 4689650.895 4787990.834 2750927.473 4105990.051 2980738.053 4078359.204 6215080.825 4582205.983 5372324.045 3459741.821 7954445.595 2464653.896 6525698.995 4377782.322 5433314.576 6285820.034 4791991.48 8147282.553 2911608.061 8692997.622 5509522.101 4598806.334 11767862.33 4155006.468 4050239.002 838356.8392 4352132.926 6512334.153 5539237.822 5788892.562 5438327.43 1106835.549 4993544.15 7175588.125 2959315.957 4701058.521 7575222.132 7500886.297 3915918.377 4860050.059 3750517.885 3353434.504 2584519.855 3923057.574 8559556.587 9135041.818 7385684.474 6819873.431 3442438.58 5237183.675 7799150.778 5071534.912 4300465.259 5287762.968 6538474.019 4122404.662 5014056.693 4145135.392 5677678.478 4032438.405 5830480.548 8148751.967 3553684.209 5541923.852 4114381.987 4545878.043 2889762.298 6206096.777 5321775.948 7471536.074 3108632.106 8139361.308 6156414.841 5640193.52 8713630.387 286418.6883 4191657.473 3878307.242 4534479.702 861764.6944 6891883.041 9597497.667 4288375.225
Pimelic acid 10807130.64 10457676.27 7702478.358 8100407.886 4144514.396 9197561.017 10454016.31 6884443.376 8530677.654 10535073.59 6066833.533 8393509.958 11227921.42 7921762.738 6764516.363 5901272.859 11015674.73 14326116.86 15167434.37 13339272.08 15271577.88 13263710.08 9104262.122 13395424.06 16370419.96 11587918.33 15472107.62 12520599.94 4841667.963 17472299.34 17607704.97 13014716.22 11696124.02 12883837.14 9634068.251 13454697.01 10428510.32 6758115.588 7820035.841 13636697.45 11271809.79 9298080.823 14329161.31 5333452.523 2625894.808 9052807.801 10644548.9 13857341.63 7388254.461 13810367.45 9369879.837 14251441.3 13649878.08 12942500.08 16422312.91 11882398.62 13660466.07 14608685.51 10657039.11 14707387.13 13835200.16 13957558.31 9590775.734 14025393.07 13096818.44 14428351.61 7150942.288 7784066.812 9542975.055 14526116.77 7914876.893 7048764.745 5391944.884 5469727.494 20551527.78 6791786.575 11655758.63 12652772.54 13610130.42 18827209.5 9273930.556 10597738.87 9925890.857 11253986.55 21379887.65 7955282.515 7870161.423 10259519.04 3471887.17 13694476.5 11089608.75 10566546.43 4641080.545 8512297.688 17617903.37 11383828.32
Piracetam 4387884.026 9054869.806 5891790.653 5161574.655 4869787.7 3971270.932 5238092.543 5942342.063 5282138.689 6370744.275 8010989.383 4196864.82 4786460.055 9874910.594 6116921.756 4870051.999 6519748.43 4009030.233 5507313.035 8212137.322 7971452.904 6071562.427 8821884.274 6975951.164 4866201.511 7227968.381 6333371.377 9487041.795 6437899.524 5638079.565 6844780.05 5749405.781 8266101.787 7456304.229 3454045.947 4387640.981 5887753.444 7509068.868 6982523.332 5929690.162 5402958.867 6931547.194 9074649.79 5836203.752 4676939.407 5086095.959 6568671.88 13769811.42 7365126.275 13754325.77 8185872.813 15480258.71 11112410.4 8878411.509 34229622.16 7096301.641 8465438.417 7366779.188 8806840.55 9733273.003 6568322.036 5762286.536 8344031.464 9455867.305 6768595.61 6534615.807 5316124.633 6144168.001 4751251.541 4653270.268 5048919.25 5456575.893 6810540.897 5479125.863 5845257.932 5887570.131 4551216.315 4786268.575 5362016.09 2832909.471 4401867.544 5586476.267 6508605.375 5439759.536 5643857.776 5618213.088 7172872.723 6577996.631 6106285.659 6485384.518 4422678.129 7176717.771 5967131.605 5259894.563 5890240.523 6557450.373
Pivagabine 7525710.151 23313835.97 11281750.45 15845902.87 4330055.673 13608482.63 8619826.673 25385106.86 11089540.03 16059630.1 7881910.359 11226940.39 11085940 28881385.58 11369702.42 16331978.38 6308038.381 13123372.45 9122462.186 30060419.99 13051581.93 25418904.6 6268487.732 13556808.04 8139113.9 18017288.37 11530946.01 16732250.98 5037557.923 11556918.21 7755370.51 18278269.47 10631917.34 17141844.92 4152521.056 13624357.25 9930060.536 4542434.601 5750978.667 6053718.344 9132978.55 11246578.17 8936402.271 4646952.421 851637.016 7337290.624 11531916.33 8052190.044 6290949.824 7428887.385 8312347.874 8785973.437 6963733.545 4215699.648 6699322.671 6870718.665 7934686.783 6301121.738 4261756.791 5559308.884 6891553.28 6316768.166 3852458.01 4911017.712 5529439.386 6535224.512 1129396.125 1363648.018 1425463.945 2524316.554 1905416.399 1288664.524 1393268.742 1287071.765 3532388.018 1652252.72 1189827.424 1583722.762 1565438.39 1081074.349 1805649.027 1202297.144 1213253.369 1537507.154 2955361.794 1254694.432 1220417.505 862559.5751 409445.0667 1405028.608 1594683.983 1207361.336 227750.7058 1135422.621 1899045.907 1951368.872
Pizotifen 54613161.88 50219641.4 49960847.28 45309960.69 51621935.36 55104152.68 43448016.39 41564939.49 49031083.15 42231015.43 35064153.91 42182773.57 37423488.85 44059250.24 62974341.19 52652393.06 74963095.96 43546860.32 42830641.17 64196259.47 56561597.52 41784252.53 37192184.86 45084801.26 31830738.72 46106627.64 32347278.45 32573040.69 31098800.95 27674133.22 35510390.45 42471122.29 49614189.67 41270142.74 43800169.41 44334644.9 58533763.16 49523577.41 60135590.4 53003667.6 51260166.05 46636578.37 53370191.63 43228002.7 31107323.86 44839893.25 39057429.35 41201334.22 46465495.6 40837253.72 39848330.69 36351424.96 47135626.3 33865011.04 48413947.72 40479839.92 53042622.84 41939846.65 65268013.87 114314461.2 39379850.5 42043008.27 43217676.31 21869625.74 37191371.76 36846331.66 51401469.12 46037287.84 54947810.63 39342059.19 47072636.36 35898984.95 43231558.13 34418940.01 39440226.05 38719395.76 39839471.98 43011002.88 40177059.98 34452915.24 36528956.39 46883287.38 38342579.72 41802101.21 33524697.9 31315095.7 48401478.69 28876459.65 8250619.311 38195478.8 37027532.99 44165351.24 29075774.74 36378483.73 36384420.21 44072431.18
Pregabalin 319263117.3 691179273.9 470206538.8 452988626.3 805760344.6 915039320.1 244303485.1 531973069.8 462011834.8 357212828.1 645393035.3 385227362.9 288961970.8 529591435 478530067.1 334523086 436906656.2 495492894.6 198618180 401644354.2 407825392.8 297555741.4 414653055.8 505633177.3 237956413.8 439582122.2 438738962.1 342082475.1 529329252.7 679833491.3 311169226.1 384988372.6 382785564.9 337918522.8 551412407.2 962225505.6 584644964.8 533117737.4 688886732.7 712963438.2 399034955.6 681566923 658687506.9 724179175 197216239.6 410205401.1 756171387.8 781028920.1 657227586.6 653395043.7 428998782.1 440449756.8 457590816.4 498240926.2 484982858.6 349975703.9 542921401.4 499917182 535734761.6 570548595.9 324983136.3 459394073.2 541082316.1 584928667.1 640328777.2 364923115.7 531820682 713983665.2 1033721524 796998469.9 855743280.9 735660832.1 629953875.6 794988516.1 848627559.8 679375727 397863711 493325543.4 611999562.3 433305044.1 530771730.3 388247889.8 548696426.2 601691477 551288019.6 515311839.1 449361407 526601527.3 321809.7899 626003653.5 492628294.7 639302160.1 287425539.4 903112476.9 605621902.3 646431178.9
primary fluorescent chlorophyll catabolite 5479531.054 8272240.503 11512748.12 9655105.57 8327382.207 12198156.58 2812571.812 7865872.073 3747821.106 2628947.027 8450910.937 4778087.219 1558736.373 3055856.141 1465530.222 3415658.705 5587086.41 3882651.152 4598185.189 2306620.397 2794804.83 8537672.277 1927273.41 10708800.79 3566552.573 6792999.174 3302420.662 9273340.758 12106506.09 4138324.346 4798526.183 5370448.603 4045045.896 3910159.068 5154829.586 11165677.2 6317545.612 3316525.87 3613512.304 4663273.384 4337979.955 6493350.894 6976654.79 5880428.377 532166.6555 10240703.12 7399452.083 1864594.179 5614193.134 6429826.921 2012130.678 2615783.116 2989822.055 9876290.075 9438016.232 5208782.119 2254171.347 3788542.309 2836024.295 1907635.695 10206991.15 3364994.883 4211818.519 3541421.614 4049042.666 2437473.812 3614700.515 11089192.43 7832219.684 8097809.688 7936347.691 10699238.88 3068052.438 7653265.203 9585190.501 5221686.196 16083044.49 12459257.54 3602181.459 1247714.318 2156282.567 3711378.551 7341891.135 4171863.624 9785146.578 2427490.658 7227404.847 13644143.69 416529.1302 903933.6214 2257536.14 1795529.464 619933.5111 9649970.828 7824632.774 9506817.987
Probucol 3828730.255 2281001.026 3922716.101 3921043.129 3180682.652 2295362.857 1308629.663 3346583.394 2265342.802 4899993.808 3269478.727 5483030.927 2383267.209 3141517.85 1963980.141 1459118.21 3623483.166 2702034.524 2921813.191 2959298.278 3293595.098 2647897.636 2588844.004 4467597.926 2323820.646 4348841.425 3529240.514 2794204.206 3703846.89 5099328.242 7634542.244 2910593.855 4947124.908 3550660.809 4716948.257 5207805.49 3148095.149 2136416.904 1318016.252 3198700.391 3791721.245 3913342.294 3437066.499 2980929.313 422819.1025 3623474.616 3040109.681 911478.7165 3957852.787 3815341.432 3455410.155 2209558.549 3489089.511 2673677.545 2406868.247 2591192.064 2681209.246 4627960.049 4833104.096 2058657.057 4630264.384 2596017.448 3172489.696 5005115.805 5168132.809 3148794.252 3862661.729 4843012.754 2219268.117 3471350.984 1818120.397 3913130.39 1659472.661 2894056.057 6073089.394 1830753.749 5011864.942 3169658.803 3925331.181 1611666.659 3320767.812 2839028.288 3350394.305 2608973.991 4091138.177 4515596.881 5018554.94 5803129.42 210834.9192 2276666.441 3202861.397 3774883.371 956004.3605 6510612.08 4105487.403 3900769.106
prohydrojasmon 6878931.178 16278984.83 4604708.966 9850114.454 983409.4418 1379531.861 8404496.895 13293353.56 4494076.676 9973127.545 1343741.09 888810.77 9403954.671 15157471.64 4429823.658 8475334.326 1413690.396 1140985.744 7911657.494 14046148.78 5387164.541 13242625.32 2278392.243 1418243.135 6478637.57 14016551.02 4484062.275 7678099.142 1868583.383 1012911.827 6956615.936 11778249.08 4569991.194 8040857.313 1837760.015 1049989.982 21095555.73 8131000.721 30116987.98 19593483.91 8766963.473 24879362.26 17984485.19 25644097.64 4469573.715 8147372.585 24637571.57 17193024.68 27490905.51 26532217.58 9253692.207 21572401.13 14225807.58 25795032.32 25399478.41 8203311.665 21825645.89 13944200.29 24814605.92 20904443.89 7656285.838 15373733.29 7419134.969 24073275.98 14585690.63 8651459.034 938981.7501 981801.6257 2033863.805 660601.8019 3644222.873 969136.8148 938637.1071 1613935.786 837245.2266 2648803.462 930955.7026 1452491.838 1720763.999 975138.9479 2563774.954 965248.1832 1296432.346 1939802.847 877734.5844 1848222.222 939280.4842 967362.494 475292.8395 562715.2115 2415270.343 978793.9011 690361.9341 1656251.099 931906.4179 2712818.972
Promazine 17493572.06 8802603.622 16491694.02 11553364.63 10245565.88 17285294.05 20530792.37 12119070.1 23994856.75 60576362.69 20628968.97 20372858.57 24142924.73 16744057.44 34846062.04 18569769.91 19779601.48 23594265.18 24092566.99 19866416.54 36002764.03 25593106.4 23094161.59 22709241.3 21668433.72 18609151.7 41010289.17 19501773.44 15115331.17 21388001.29 21161262.76 20144474.15 30955153.01 17949458.32 14738284.75 25000083.99 592403.711 377674.3366 464271.9421 592443.9997 687250.2256 447772.4758 511497.9211 529093.5144 189740.4402 490313.2187 427955.7051 371055.9726 501666.4005 541350.978 406370.1901 395190.5703 532958.5153 397777.4389 346069.6157 436361.0962 357622.045 458119.289 477189.0419 405837.0868 463441.7464 341166.0646 321664.628 377041.041 407931.8682 390365.2543 968233.3177 748545.638 2208187.412 1886392.218 5684410.507 561104.9437 2248555.202 3736177.598 3824541.455 11545145.89 2019569.006 2106973.177 4124416.421 2375045.654 12205036.19 2715487.287 2761486.739 4298698.021 4044200.849 9048816.794 3525409.494 11173088.74 155738.9805 3032912.562 13889323.07 1761516.609 155897.7069 2835059.145 4244012.608 12195047.95
Promegestone 11206387.64 5146063.972 9637045.56 5088372.402 7927206.028 6566221.37 2825605.296 5567625.576 5350525.234 7800853.668 4621235.699 8441269.347 1536420.059 2933863.834 3344998.772 3817283.296 6410079.974 5049429.061 5815657.52 2125842.954 3008253.559 2239291.955 2996169.599 6427726.904 4081795.861 4550177.286 6793429.261 10431768.42 7987046.382 7453057.775 6737601.909 2256300.721 57064784.16 4346615.589 7015646.162 8871729.749 7603045.141 3744866.349 1871986.648 9279410.692 4345833.485 7800611.407 6934003.41 5795237.185 972120.716 7042618.02 4668475.265 2176693.814 2816705.499 8155802.09 5373574.466 4552328.123 4074596.403 4933126.113 3578268.166 2546013.035 4714044.267 5205069.476 4000033.774 5164413.577 7805732.641 3698613.413 3255709.569 6977736.677 7075822.84 6529295.652 5659915.682 9739673.961 4787915.383 4313646.02 4209031.136 6828708.445 6232680.399 2691271.248 8453565.381 2079348.116 7451414.397 7431171.736 5488962.575 3187508.69 5888767.9 3630387.395 7038015.986 40613023.91 4838564.124 5642566.465 5846263.93 10557519.85 431997.8187 3472699.014 2968184.378 3906089.219 1929485.702 9206304.079 7586702.08 5287045.629
Promethazine sulfoxide 37470942.41 43685601.89 60764381.98 54280493.8 33260273.02 53929844.65 31389183.52 33077977.28 78557535.33 33431266.55 24084730.86 31695121.62 43925845.84 31668797.7 80579208.96 33655218.86 23990790.1 49223679.61 46531518.98 26565603.21 76592972.26 51666760.19 26410511.65 43977323.97 41120927.4 23499371.28 57584032.81 38975105.59 31460313.39 57193851.68 44359675.82 33614936.5 53689161.06 43492520.03 26298091.67 84169619.96 152486.325 158566.817 241722.7887 138728.0838 387452.5944 194939.3252 261567.6272 86271.15625 75712.85138 197798.7034 171616.2758 153074.6224 325740.1679 87221.20505 189932.1778 133155.9476 251754.2627 113912.3215 115964.1384 178314.7492 147466.9698 128823.8682 223154.0712 200633.424 239331.3793 202789.395 194211.304 200685.2389 219387.0908 171503.8289 6508313.128 5254291.53 10595426.9 7690438.753 22933240.3 7595583.129 5898675.557 9004204.473 8934155.654 18059040.91 5541559.796 6305244.248 8065027.357 3752013.577 15426343.17 4055437.044 3219251.195 8252693.455 6015188.147 8856599.423 4322022.049 5143585.021 62421.99817 3867984.424 10943029.43 4524997.518 799849.2841 6478211.975 6003523.991 10705540.83
propionylcarnitine 8958504.593 19242280.23 11580255.83 12217224.09 6803286.348 8256986.422 8819830.034 17787527.4 11321267.85 10972709.69 8578041.183 6002293.425 12454789.93 19327063.28 13239025.55 8995306.86 8638709.653 8812077.213 11185998.39 20086474.76 14385148.43 15569052.82 8921241.476 7042741.87 10818748.77 15230946.72 10486471.96 11672443.78 7717133.039 6643629.135 10660768.92 17544043.64 12753812.61 11959353.17 6847783.181 11990427.04 3765884.115 8158658.274 11875092.79 2229337.639 9449040.981 3171476.94 12558290.75 10975772.92 455624.8706 8178047.941 4074047.724 14264745.63 12882269.71 2647955.676 9583032.08 3049661.71 9974770.587 10177168.2 2711027.516 9796223.009 3674788.18 10717745.83 9488208.565 2162202.023 8547077.282 3303733.537 6956590.273 10516663.38 2647883.075 8620197.983 1125482.304 727424.5678 1598995.783 3359159.169 2087850.314 1329561.72 668625.5247 1508565.127 4327975.166 1780461.165 1206838.104 929103.8587 1732589.897 2039900.508 1797822.141 1103062.62 813661.7662 1535538.991 3871410.51 1247439.027 1207446.306 670358.1529 81606.49468 2524717.269 1855694.379 1382938.836 146794.9254 1162648.667 3766644.806 2059057.845
Pro-Pro 6459404.129 17319636.71 45852290.67 11436414.54 4582209.608 14362458.59 7821407.869 15260710.01 19362370.28 9750105.379 9621472.784 6989675.308 30119716.08 31261036.57 32947261.2 27949971.38 24460720.29 26727250.33 29905576.89 42429188.49 30120246.69 47363356.73 30526710.38 25219025.24 38498145.99 38468824.13 25637702.2 36623415.13 55424271.01 33427968.02 42218320.72 59679912.37 35745698.76 20797875.6 31602860.54 40875725.19 8053746.747 3626852.997 3203496.263 3833715.136 5828966.29 15267399.12 9939288.91 11371740.06 11494261.41 33678867.8 44477849.32 27633084.38 36559092.24 64405779.67 61255897.67 33245837.09 22471025.69 36115012.01 61247954.23 64685359.58 55366340.29 36092212.66 56485546.52 56991420.93 52982389.17 89042581.36 30274419.7 70168752.26 96992861.02 70735345.63 37194947.4 35020727.6 45815072.43 18255174.34 17903234.47 65641906.17 54015899.69 56149727.59 43697258.4 36507017.34 41788416.98 59811279.01 55284137.48 15020724.96 26583183.72 21931478.84 28445863.58 30702229.56 11702127.55 15366483.26 24894005.34 32750572.29 2203792.522 10783879.9 20062306.97 36404858.81 11305367.37 28697932.74 23307838.57 23741757.17
Prostaglandin A1 ethyl ester 712188.879 1139933.682 664941.3856 1320446.489 588841.034 895097.2932 8378808.471 12004161.69 18242719.46 19433710.92 11228963.2 20697653.85 54686149.6 49292611.94 52966363.98 42926398.69 39597758.66 54715765.5 100480505.6 89893399.99 97964787.89 150641866.1 84266099.61 99362205.81 109312643.1 87653558.75 78228665.65 80686039.99 62711144.66 84815864.53 82574397.07 87309711.5 94667067.66 96821857.91 62165702.89 164146162.3 782942.4075 150515.1415 550537.5725 1573251.769 428142.7991 27608593.76 4567707.853 5210836.383 4980937.486 10640036.91 74672461.57 17104801.18 16008116.42 75827215.95 37240699.97 79038957.8 32215313.04 28321906.55 123848421.9 65592367.99 78431901.04 33888285.92 30420884.2 99486425.66 68148259.07 64656490.85 14469998.51 33679416.27 69547423.62 54988963.02 8940426.384 8001773.481 9956538.187 1284559.397 2008271.202 58156963.16 52272095.79 51440744.18 38402789.23 33863247.17 116354599.6 101725777.1 138577920.6 37956892.51 90923669.07 166320684.1 138531194.7 171021949.2 161409914.3 63503989.76 145628722.5 123522380.2 6163088.149 93061312.76 147673270.8 114810134.9 27314115.45 158628391.7 131458759.6 146891326.7
Prostaglandin D2 Ethanolamide 522408.9522 506442.3608 507231.3162 429169.8865 481879.1663 424870.6675 408477.9805 471985.1467 1105855.453 1058747.818 471687.1746 975719.2914 5039545.996 1952074.565 3388214.287 3039800.662 3044421.847 3867690.313 17116792.06 8468068.759 13044371.38 22714616.92 12928007.01 9060765.129 19814089 8742013.377 12178377.26 15560667.33 16078800.8 10601275.58 25088121.25 14147247.79 13911427.96 16781865.35 11283424.71 17498914.08 449596.729 355561.7325 391238.191 477825.1464 476989.5841 922300.7361 473737.7695 398615.0979 217649.1742 738697.1881 2871508.86 995575.0698 724793.2781 5122132.02 4235096.717 4184516.984 2997649.586 2951239.211 8998919.308 8915441.899 4920814.301 5070304.207 4350881.395 10143295.72 8158464.239 12081320.52 6386456.215 5916876.148 11560204.75 13301291.38 446041.8925 619689.088 415827.9056 417649.3311 426812.919 3171186.436 3266088.633 4019895.505 2248434.005 2415989.311 13145445.2 8576564.458 13267467.19 4193400.072 14217723.18 83332818.07 83585137.59 77122816.09 68880174.33 59181252.17 77961379.02 70823176.14 4371888.774 51029445.53 106606474 82162494.69 17626875.67 75233851.71 69116402.04 105062416.2
Prostaglandin F1α 89039.15461 96662.85038 113051.2898 372568.1635 86370.55179 193688.7956 456401.8336 420827.046 721482.0825 759268.043 436517.6404 610080.6317 5437469.372 1837469.033 2516319.251 2898720.671 1884856.693 1594305.475 15962699.69 5462691.294 6909679.274 16372084.09 5767151.285 3952812.427 19392373.97 5141222.552 7169016.447 10472777.6 6689481.626 3937978.468 26243680.94 11659025.01 9257697.408 12822631 6951973.611 6885610.708 88554.22533 91204.96711 195015.372 92431.60041 89457.4474 431292.2339 162540.883 128565.7654 185646.547 518934.1377 1530830.129 694073.5945 977057.8707 2389034.768 1635778.276 3386742.382 2123415.401 2238692.006 5583882.244 4448462.782 5998367.903 3006014.889 2791013.469 4795572.933 4970087.413 17295368.53 3596330.898 15952548.71 8010861.058 7410592.908 295806.4193 157525.977 325043.4675 82363.76796 88504.86389 1915087.817 1585587.855 1675473.236 1847813.206 1437555.484 6957832.72 4428506.088 6298925.235 2888295.933 6107471.285 24910377.18 29886240.61 33097256.4 35978153.23 24576771.54 26843192.11 28213060.51 1454587.096 24407513.77 34859814.31 31215392.27 7239843.722 26196132.88 39112868.26 41731384.81
Prostaglandin F3? 944880.5614 1039242.038 606368.6103 843867.1206 586020.1833 624765.7268 1312103.451 1559642.884 2492206.847 3356551.156 2034654.83 2803879.782 7050167.308 4020215.124 2467748.056 5692115.351 5619958.248 4211200.314 4636662.594 4912138.433 2357417.359 9915658.582 6385094.374 3161304.781 82239259.1 4373521.337 9925966.497 19759781.34 7072434.13 5720653.996 260768264.7 31658840.74 29885494.01 61916541.1 17185521.24 16918467.37 641632.3141 489823.4132 580631.6508 1911773.558 897075.1606 2871601.384 885709.2557 1338765.731 1052257.464 1829860.874 4221843.663 1930132.229 1727653.835 6658014.03 3763830.551 4281274.784 1762387.471 2155636.037 4271052.794 2328400.811 10155628.79 31977947.32 32813611.35 4603248.385 3974828.224 169740972.1 113866296.3 134836915.9 12804033.66 6571986 4887274.121 3309209.311 4225968.231 1394489.24 2022224.728 7583483.494 6665731.852 5878204.612 5942888.843 3384476.692 9156216.303 8398628.383 10840911.5 6780164.719 10887390.89 7124384.414 10037027.27 10194706.17 9496116.69 2801565.986 3619938.349 5820054.135 412761.0005 6724042.629 8792861.805 15539666.38 3368647.341 9092418.102 19765495.63 15207193.14
prostaglandin G2 2-glyceryl ester 46280706.25 16195716.99 18844357.02 12069617.73 7294149.699 15613142.82 23840088.34 16586828.32 23237474.32 8225171.597 15649777.28 5485552.866 21117205.08 9890895.689 19777178.67 5899448.805 4527312.075 6707028.055 16967584.87 16167589.43 27509809.99 7617948.42 23474611.32 14211109.83 1909653.435 3074352.812 13433513.83 10992776.75 2553398.747 7815992.977 330819.6359 293306.0565 221451.7642 226782.1776 229220.9443 273077.098 4217104.777 8242023.995 9181275.856 16161215.52 14807945.2 35272153.79 31123284.66 20680647.51 5519912.23 27295787.25 12247188.25 5075672.336 19202529.06 7610871.692 15600581.57 15378995.84 3551767.242 9283196.529 7152720.403 10582284.35 2573880.303 4662672.328 4235746.683 16360816.92 6058354.191 478801.6644 323637.7489 205789.8891 328576.3609 150183.2127 17235281.68 22304203.53 17890815.29 20434696.96 21301813.61 26527981.24 26397546.98 16494841.84 16222550.63 10233138.76 11952721.01 8789474.897 24876188.16 5851165.557 10573309.2 18450694.1 19050290.08 21683184.34 21620789.94 7190767.163 4162552.667 9714648.244 204735.107 794066.0333 10202757.78 387098.4403 43620.74476 217600.1731 168978.7842 158766.6266
Protodioscin 9188845.51 7082371.583 10792246.66 7428358.002 6802845.679 6010470.979 8728880.029 9379499.134 10586967.25 12156542.8 9178710.698 9031159.638 14710431.36 11472900.29 14091179.36 10813346.02 12806026.56 8357233.836 10949218.69 7944121.755 5731238.906 10532215.99 9360259.185 8457475.001 8707672.302 8851821.792 8558324.025 7125391.139 7318000.921 8583422.066 9931022.68 8907430.759 6363978.249 7251756.308 7590111.237 3207096.259 7315164.3 3475863.269 5339002.123 6750067.007 9267439.063 14015407.74 7693036.094 8533230.344 9565937.462 12490582.55 15060437.55 9246923.541 11222237.22 24603177.98 11689208.69 8482128.912 8168279.017 8353322.938 15378390.64 8663445.691 8674840.401 9254050.467 8526045.869 11793120.08 7921180.525 11067056.1 8457804.606 6698827.237 8236014.483 7034564.985 8163711.826 10670933.12 14599194.35 8202485.341 7867985.896 16348444.02 12881087.88 14627488.01 14192643.95 13630945.1 14758521.37 13782423.9 19581670.72 9561428.361 15985164.04 11112347.17 11439920.25 16665337.75 14520865.46 13931850.79 10698120.36 9881469.429 6878191.929 5784692.643 8098594.019 9515149.906 3700822.913 6855033.309 5205617.161 6474392.707
Prunin 10191122.67 12631535.38 11251918.13 16685682.08 4263065.602 5461175.099 15249315.34 11470724.72 10550056.91 24432405.98 8171017.866 8643437.205 18078577.66 14385833.96 10808075.97 19820726.03 7919555.907 10058403.51 14844086.83 12615874.15 10279637.9 27309930.23 7722121.568 8443097.73 12061042.29 11431846.8 9134555.865 16827294.99 5855077.469 7033699.434 11041206.63 9968255.129 8838067.23 12768094.24 3809532.465 5801107.724 17568894.38 42942652.98 29826004.98 88467481.6 38983299.16 27832775.42 122776943.2 27826345.09 24181502.25 32468601.17 27834499.16 112466754.7 30646779.25 138521716.8 42828917.09 19302770.84 91040189.34 24956508.47 124229652.9 35683385.8 20447790.47 78725031.03 24022792.7 98604877.64 35872369.98 11003676.45 34124923.21 24968946.79 62677368.68 35900041.6 11024004.6 13144310.93 23620902.03 24450725.33 36151008.78 11956558.44 14284885.48 19179644.25 29831655.61 28329087.43 11459487.75 15559833.39 20898410.91 11181699.11 28335875.85 9849398.596 12398868.42 22174496.65 25142521.87 19454280.88 10537467.59 11451432.76 1158627.35 15193358.56 26180207.6 10510410.44 2641260.538 17045730.31 23785242.19 30185420.2
Pyrogallol 880404.3638 1375619.969 1274832.169 2172195.944 3337718.49 3114810.92 1008756.928 1276104.471 1305721.325 2575924.483 6833460.668 3590537.156 1510532.829 1575280.141 1205366.814 1807951.302 5505528.051 3592910.923 764858.1701 1035787.723 1146643.393 2233235.95 3890533.585 2794026.006 537568.8801 771025.9643 700123.9065 1063491.939 3120688.831 2217532.053 387083.4253 484100.2956 556353.9506 843412.0761 1247082.318 1463451.234 903616.0023 504729.9706 963408.4964 756013.9574 1107987.148 1131449.488 1232524.949 991475.6737 187796.1421 1009866.066 1097917.601 1160478.481 1026381.71 884511.3754 1298501.213 492229.4254 692629.8739 670870.0296 734881.0846 737929.3849 620265.9637 538693.2826 668263.1475 557526.7528 651313.0829 276086.2531 337182.3024 596673.1683 386564.5247 497645.8381 1276895.829 1089999.883 879292.7672 879837.8053 1120455.52 1379025.833 1154614.86 651343.2583 1164606.841 882672.5251 1003215.578 1188531.803 727575.0191 488828.2456 831046.3454 890671.3717 775778.0814 668552.7703 759222.9643 535837.9761 661119.6213 497571.131 171744.2904 503748.7355 593391.0656 391817.7512 143194.4829 269130.0304 554826.1353 565561.8888
Pyrophosphoric Acid 9344952.537 6521228.069 8290084.816 6958102.302 6471205.472 16232808.64 7407148.99 8708993.32 11373512.21 8843134.46 4786798.901 20509205.54 7108259.177 9176353.789 10664730.69 8884690.076 4116131.211 23405616.65 9822018.948 17670754.83 19972123.65 15100896.94 10453772.51 38321230.55 22882753.87 25031083.16 43867631.22 55739889.65 29986135.47 76033483.57 27359837.35 24706463.67 54450476.89 73906816.82 67680894.27 83331737.6 21908861.76 9965767.167 11296005.63 15450455.77 11549961.65 17345233.71 7238658.671 16306252.97 41730212.73 14985688.4 22576373.52 11760664.27 19859786.64 26348154.39 16956152.24 43221350.98 25262289.7 40273450.38 36200732.93 29390970.23 51765500.31 39055267.98 55312447.68 43933888.56 34238341.53 58704284.03 67238499.48 71313018.11 55967788.99 37547873.1 1154865.324 1618322.721 1343559.666 1687584.621 1430186.733 3006886.235 2988287.667 3667758.275 1338188.24 1217470.94 25218908.13 20018804.63 8021292.211 9531195.677 19177865.72 43046508.48 40100954.07 33089682.64 29053120.57 36679532.9 54353759.05 50102983.29 20724817.61 38752745.63 41202472.3 60244111.69 82657123.8 36946892.04 32034245.36 33370982.22
Pyruvic acid 43319276.71 178515058.5 165238466 133119147.3 104540755.3 142184235.4 103214161.5 223982237.4 211998957.7 203103275.9 81011657.01 166232910.2 184028189.7 293008512.7 284323479 221903286.3 122231755.5 319652058 328037630.2 461246605 522244713 657862689.2 305145565.5 799246569.5 473774878.5 476529990.4 698936941.9 804058075.8 514061574.7 1090042420 617690649.3 466785436.6 446056538 1087033749 839645382.7 1485754110 307382795 92365629.63 145839179.8 185284221.4 234944175.2 265232013.1 150611803.7 180905825.9 102769274.7 229459374.8 471593663.3 242250793.4 256566889.4 327257766.8 332577287.2 451583970.6 268431083.4 269150325.8 438051278.6 382695469.7 552004448.4 425055026 400602001 383931291.6 428022621.9 640566640.5 544178256.5 649142927.8 820820586.7 588859730.9 199505403.3 208226061.9 243680651.9 148922924.8 193842932 460242693.1 385530460.2 372158890.9 253161533.3 332265524.7 714394609.2 834763465.1 743036467.6 282945282.4 607896950.6 1095199098 1216594191 1281239724 818496010.6 1006098141 994442183.3 1228087826 136766415 726212459.6 907716452.6 1106789619 465566276.2 988369133.3 836751732.9 989855322
Reduced Glutathione 1814635.329 2090445.612 3040921.352 2270874.755 2045976.217 2255042.688 1560124.282 5598239.039 6054862.389 2051020.873 962681.3193 1037901.879 1823229.987 2682573.757 3707472.869 1443339.206 1027828.155 1394068.047 1995882.138 4908809.568 5257788.584 2173124.573 1788259.073 1621022.384 1487379.323 6649009.291 3434810.346 1920379.63 1264560.56 1030073.135 1039452.453 2513568.6 1492961.75 809163.8436 884306.2322 1501458.901 2710124.605 1454741.491 5774299.208 3230523.841 2281131.37 462276.2785 380724.4211 5842632.368 445722.1016 3381555.012 2287510.053 786292.449 2350016.638 2945215.562 3192900.472 2459212.447 1822142.963 5267532.37 2809036.796 4719791.901 2829043.096 1615851.819 2619970.572 2473492.82 3177766.024 3585485.905 958401.7458 1591241.571 1155985.208 2584089.177 2304051.733 2478698.503 1191447.805 1155360.037 721956.0309 719826.0343 665489.8588 803856.7582 887742.9692 1127415.07 415760.7726 513383.0399 282962.0124 125830.679 402685.1022 447227.4216 429299.0174 439692.6017 629651.0769 416926.18 581354.6375 541258.7192 63275.93395 550282.2906 597068.6406 584608.565 241024.7524 549865.0833 603775.2916 707956.2774
Retinyl acetate 391082.5136 369727.6107 361164.4591 374168.7007 323489.2519 375913.4608 1010574.678 1180672.564 1708830.933 1791326.17 1052906.617 1292630.83 8872113.496 3358324.625 4197424.719 4306044.647 1840533.39 4460495.272 7602812.698 7162702.67 7197099.57 52510686.76 3972036.64 7236232.658 8571947.652 6282385.873 4997794.879 6163869.962 5062250.675 7639167.688 7479701.715 8456324.643 7956812.075 6961542.915 5447550.559 12894085.69 276519.522 190486.4076 421311.0752 307630.4409 439250.5028 1612455.423 316091.62 681970.5561 359403.1324 942241.8794 7060568.926 1153904.416 1421199.17 6161581.417 3516442.908 6168885.133 2952735.465 1810747.81 8588764.33 4737356.993 7087539 1709964.117 1980386.518 8649870.817 5175266.028 7237692.284 1020664.537 2298570.738 5205632.043 5199202.848 1113679.643 457165.3038 664170.8515 314414.7453 311211.3234 4364138.405 4050987.473 5080353.517 3657037.95 2781684.19 7951151.704 10858080.31 9826811.514 3770022.991 7608461.922 9167754.313 9757091.223 14046860.41 14639656.1 7141078.862 7858096.337 9003108.795 351907.3067 6430281.954 11966200.85 8758846.418 1852939.154 10648516.06 13638246.68 14556208.22
RI2735000 948411.1912 2459435.939 1738861.104 2224016.306 1810499.097 2405338.943 1212429.432 860663.4256 2361408.04 1178297.693 2105369.882 1737842.728 2371604.083 2627612.79 2478788.372 1954031.65 1926034.18 1658631.428 1313498.421 2094047.093 1963905.209 2984334.475 1773725.852 1706330.182 2006812.671 2112045.708 2095961.741 2135146.997 1686950.209 1303304 3546102.732 1934695.039 2021530.753 3037158.456 2906298.117 3807986.99 1895195.897 1774568.261 3099720.032 2002334.442 2394200.584 894189.1076 893973.6599 2295688.449 301084.2063 2658193.457 2004410.908 1792643.331 2470764.607 2012745.456 4565254.047 845866.1711 943797.4865 1569660.877 1617533.456 2442271.559 1639880.394 1569664.23 2034434.612 1609605.502 2488690.938 3598198.379 1917314.576 2455419.099 2677922.101 2503431.317 1485665.676 1885977.088 2317241.775 1503054.369 1675222.177 2430695.524 3199943.339 3004169.528 2796787.72 2540222.301 3217717.27 4166104.134 2758114.11 915818.9214 2432902.872 2535902.491 4041299.298 3700995.193 2487229.807 1198281.091 3313858.73 2075887.07 124031.5418 2187737.802 2576426.616 3985143.942 613930.2236 2360948.228 2168977.678 3084419.345
Salbutamol 2265390.508 5229735.427 1523134.995 3458054.432 950083.5258 853726.6148 3062846.081 7841473.392 1354486.037 7357815.858 1366657.399 932622.0283 3438945.287 5348970.056 1728850.954 2983515.185 1187309.222 1024016.776 5623926.713 6813001.604 1912160.324 4223910.956 1096847.868 789130.1103 2663392.823 3742349.054 1332314.665 2464214.533 925846.506 759501.7367 2359692.291 4263215.56 1373807.229 2391216.498 809449.9233 886628.209 4920611.412 1550627.21 3120510.455 5045921.675 2538080.223 5382042.377 6308442.162 2537144.896 1005683.597 2402212.887 6297606.358 3253700.81 3009529.854 5246616.73 2291613.741 3966546.327 2229582.431 2396062.143 4645012.833 2165244.958 4307583.404 2296956.592 2353276.838 4257119.632 1779899.93 3282160.782 1262174.135 2125987.344 3812356.43 1950710.15 331247.1405 617329.3239 943491.6233 485008.8195 918845.3525 445119.751 627642.9864 661367.7368 392183.5944 844905.3927 360231.2375 603695.7076 687576.4547 186391.6225 798868.9864 458093.6334 464637.6746 769335.2264 390040.9086 442010.7522 370052.8077 406151.9942 54610.06344 199685.7558 464530.2255 430261.0047 130675.0192 636339.4984 584297.899 700014.5668
Salicylic acid 226777.3642 2070110.393 1782764.718 1567091.361 1632465.52 539489.514 187180.1152 604795.5459 870985.0057 716904.2478 1005107.249 1150880.349 834125.9369 986945.6455 1126385.324 789082.1625 1377556.566 2000610.739 954522.6212 1539407.745 1690719.067 2158074.632 1654736.544 1827231.317 957594.3272 1268117.102 1373911.639 1534831.737 1489653.694 2582442.382 1114389.107 1409685.945 1547608.089 1512494.292 1278341.858 2508918.998 2109384.981 534195.1103 2125078.623 700904.517 756131.0998 445868.3873 860253.7562 473341.1201 1168834.455 863724.0247 995172.333 1238175.98 804111.4898 1427194.498 1328498.91 945680.3079 1971054.701 949916.1223 2120595.911 1725403.104 1250916.214 1680580.369 991802.401 1530709.824 1822594.542 1144500.262 1270799.041 1152721.65 1657843.216 2046100.138 874669.3079 1145179.377 1315737.337 2220020.705 2022390.63 1404052.23 1293016.446 1068282.756 3201495.953 1519411.782 1363305.684 2102912.788 1692768.932 2412423.467 2272090.62 1265281.55 1642622.459 1598230.37 3924745.978 1521800.93 1116920.154 1576227.238 1077622.564 2024657.487 1973642.488 1612221.114 236351.9403 1411820.894 3372467.645 2540717.343
S-Allyl-L-cysteine 13932661.98 19786981.49 23852693.7 11065832.15 12626532.05 22418517.13 38445157.61 26412593.05 27316349.89 32551395.3 36851634.58 40457221.44 29485750.44 27878682.99 31714888.96 20530158.04 40068923.5 46110382.75 20068969.27 24296387.3 21515588.83 27787327.75 76759913.4 49933133.62 25171599.57 30240129.19 20205911.35 16185263.78 24499240.9 23953657.1 19139146.89 10883461.66 16560106.61 9213241.534 9970276.719 21240333.38 19867753.77 11563377.99 22574417.14 30471173.02 15800221.12 15530846.7 42131248.31 19441665.52 5645526.32 12333510.52 43554832.4 36196994.94 18498484.59 33182298.58 25655936.24 19181264.98 30265558.41 17505369.83 23677300.57 17901598.28 17372269.7 27870323.76 27810756.36 22261110.78 11207865.53 18489606.21 10427503.65 19392606.77 8263645.763 8114154.855 9973548.659 9469484.351 6154521.785 9488989.153 10018196.79 3560801.043 2662438.347 4329447.458 5518063.647 4703238.053 3126358.413 2997626.204 1678223.035 1624995.872 3092714.329 3085739.582 3192936.975 3805252.899 4322817.751 2945301.568 2665182.148 3116975.277 371326.7033 2778052.538 3474821.677 2893492.025 492991.4023 3728130.027 4191218.655 2964975.498
Sebacic acid 169749.198 688464.288 500353.7397 394731.4736 406665.1136 395185.8997 194721.5431 519365.0373 428766.2262 262143.1555 142950.7558 369693.6924 375909.0492 685647.1538 375294.4201 630507.4141 463880.5718 185002.8235 370868.7557 688944.076 437188.8871 611902.9792 86944.38623 126014.1112 543723.436 472196.3309 425473.516 334048.4754 193832.5938 182351.0663 868392.201 585941.1911 526610.5959 482244.5767 220754.5196 200804.1769 441716.1753 214195.1425 204713.7087 520718.1388 546079.9233 427247.6547 232144.9653 173514.0823 64275.74164 515670.0121 1050597.846 224803.546 240229.5913 590465.6538 678732.1853 464435.4425 635198.1404 187407.8892 547786.0042 454271.0311 611699.6153 367914.9865 634437.818 361090.9231 535589.143 1125950.522 499718.6095 715203.7649 490838.7279 511517.1419 529680.0788 597187.4189 1067481.215 2353449.72 632851.6067 547625.0259 632122.9939 684802.3316 2106848.644 524432.7394 461529.0497 601060.7283 613125.1385 882557.265 677528.6289 421317.5504 518007.9589 737914.9226 1925877.93 392073.4994 414437.971 454120.1233 158894.2438 1268294.285 648922.3701 665205.6825 325313.9125 482782.8203 1705317.577 1014912.245
sec-Butyl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-D-glucopyranoside 165810389 77555832.19 106500898.6 76448617.17 96884977.45 99454090.45 63533063.55 87175686.05 92220579.19 72814720.04 114894229.9 43888395.28 75141337.14 55681412.25 87587227.79 45729085.26 95639506.37 86389763.7 89303591.94 46330822.63 92287755.71 102405265.9 86683218.33 93224593.44 94752872.59 110849903.7 105017753.9 87580977.06 102076175.3 100040164.5 69191395.16 92998688.54 153962324 111417890.5 124610115.9 151311761.8 75016497.84 26565785.14 63433582.59 49798970.22 117930650.6 45148478.93 47966154 63717265.65 14784708.56 122188111 84058428.21 68694383.72 127808903 97382674.36 98257670.11 72045312.87 96578704.96 92044998.98 63753117.18 68354097.59 55467236.44 95653110.98 77950809.61 81089651.4 76329917.51 72662506.48 80028977.08 124732303.2 110652268 137551165.7 91643000.51 111347866.2 94478734.21 81241550.68 81205937.07 96895819.21 77609095.58 94440031.52 69548768.33 86479091.83 83601133.41 76664274.37 94935772.21 36054234.15 82843566.29 79597292.53 52468350.87 81960239.23 118493369.3 70283739.4 59934732.34 112939401.5 3378268.858 47677009.6 122621998.6 112651420.7 21417650.89 79677465.4 121351442.5 131672933.8
Sec-O-glucosylhamaudol 357034.9463 285854.1946 301082.9195 565940.2758 490508.1857 419239.8641 176434.275 261432.5558 151242.9587 797367.246 1020801.127 534253.2372 272408.5085 295780.4693 80664.90227 482807.2244 748375.3601 561772.604 214416.2076 274128.5524 187255.8284 656641.8321 668507.3349 388620.0165 311974.9069 480245.8612 224136.3119 402095.4433 583616.0684 415906.0142 129343.884 291875.4268 128064.3262 256233.7706 189437.552 306321.549 1378022.508 586644.5951 1363316.747 2623462.653 1135057.215 2033853.324 1491012.653 995262.4538 581042.1555 795653.9013 1916928.385 1262001.781 1254199.816 3357020.773 1022609.119 1330238.017 1015344.267 1016606.278 2640641.16 712516.5306 1404465.898 951689.1122 858050.2482 2087530.803 827196.6883 796899.2616 544543.8924 911015.116 1600931.541 771419.8733 230676.6421 378151.5741 182837.9987 283707.8423 122678.207 263260.7402 345842.8215 241698.2797 451454.5698 373953.82 239101.6016 429962.2654 458043.1806 126090.1249 371549.9371 279151.8375 241701.9327 279463.9553 390243.1315 286543.4225 134905.3777 267903.6719 60647.57252 214898.4081 467836.5718 198856.247 62231.45813 334416.2927 311525.6605 465353.654
Skatole 6352357.736 8928131.373 10247966.2 7302948.486 7060867.846 12974611.99 6248226.216 8834338.436 8923207.574 6994926.344 10135475.79 14369531.4 9035972.082 9214393.325 10109326.09 5827460.451 9926741.369 15341045.35 6938325.001 8907147.104 11062319.04 10679215.94 9804655.172 12260557.75 11491526.58 8335906.913 9471947.477 8081722.771 9788314.035 12568183.27 9518631.788 9433591.686 10834522.03 7997088.751 9687737.354 21391083.87 11486370.53 5214551.354 10916670.43 12050332.7 12644323.68 8566290.402 11276865.1 10248716.69 2333533.748 13045703.45 10564770.49 12691921.56 10042062.7 13313932.24 14333814.72 9247966.24 8973116.161 9563726.553 12331276.33 14844301.51 10719261.06 9780922.414 10544995.04 11187929.13 13952723.88 10445561.56 5158358.19 13722047.72 11926145.76 13648472.58 15403538.77 16031819.48 20315148.2 13965900.71 16781545.46 17654510.05 15813678.37 15623413.83 18142145.29 17138003.74 17304566.46 19591256.29 18888013.17 7143203.692 17112580.8 14856715.83 17035781.19 19258585.23 16029461.69 11305673.6 15579675.58 16341566.99 866349.9567 8408558.995 18206160.54 15202626.61 3235606.622 14075745.72 17327839.18 18684683.91
Sorbitan, monododecanoate 3632013.673 10681978.41 1755651.763 5037483.881 5173188.055 9077366.64 4593303.596 9513525.136 1697718.817 4712832.761 9061855.868 11121943.75 7050037.598 11255191.13 2237190.939 4486268.198 8872156.336 13757303.63 6866652.835 11552505.64 2311358.137 6992522.587 8486017.242 12725461.77 11121271.33 9557248.826 2560335.233 5705620.293 7024506.384 11064657.52 27733089.38 11803720.55 3902980.862 7359399.785 5549516.353 12810041.92 7122646.724 11193936.06 21297805.72 6049852.011 16417836.29 8038879.209 19218823.53 18929159.76 1873423.281 15627903.26 9733631.426 21253950.48 20665833.62 7338054.24 19016497.37 6903045.193 16411977.36 17054800.64 8037949.379 16303016.58 8687947.974 16655092.11 18289087.93 7148617.39 15725764.11 14704472.57 13174586.85 28233468.28 7048573.276 17252551.43 2668215.104 2395745.506 2937579.894 2323022.887 2830936.225 2860176.237 2601539.127 2147524.713 3040633.972 2532483.759 2561701.344 2860587.534 3260076.29 1664450.57 2844258.64 3725351.033 4631929.83 5919263.504 5387957.66 3604005.869 4641446.1 4210014.937 572792.4496 3766621.269 4842662.732 5374473.674 1209496.844 5243704.348 5884347.159 5313587.171
Spermidine 286248793.6 431867438 377229318.7 510663039.4 447905857.3 674706258.8 122781258.8 312993296.8 399460345.8 200359754.7 152706540.9 205156925.7 292158138.2 374899589.2 428502000.8 400303101.5 216795871.9 404811554.5 260347814.1 371359691.1 542002317.2 423523662.5 283809457.3 403794929.6 387792838.8 278324026.9 388791174.3 483371671.8 643040533.8 724235189.1 388043163 365002819.3 492897421.6 573434998.9 511000274.8 972892267.4 598915055.7 273193613.1 424448283.4 365934217 491446015.2 61042154.08 68775540.99 320906217.9 36976766.63 387070753.1 331158825 220427530.1 454041418.7 254129250.2 459652237.1 253204548.4 152564330.4 322133023.9 341152695.2 397924552.7 516241293 318424826.4 320141350.9 319849615.7 447399819.8 546141609.2 282474456.5 382906865.8 697621753.8 465712463.8 422894934 363035491.7 541075344 336886417.4 578082196 458589754.3 419587977.3 317539328.2 345980208.5 376858277.9 317675828.7 456750602.9 338510436 144874205.6 307908478.9 303834282.2 366618098.7 346007885.6 266086379.4 272560938.7 346341443.9 437817947 26949059.53 261652603.6 324538195.3 635456324.5 103532381.5 253328643.6 376290518.9 421792615.9
Spermine 12427209.27 29556487.3 18060622.94 37582909.88 21029243 38403532.26 1200668.686 9366496.681 12231947.1 2976264.002 2057195.546 1596404.424 8063386.874 10603168.45 9548464.948 10726502.61 3542383.153 7351493.285 3086797.372 6418129.676 12740823.44 9704561.09 3365659.97 3516227.691 6684308.425 2278691.351 3188313.196 5459491.961 11917348.71 6948704.433 5276240.008 3170994.699 6166561.284 7913208.469 2743593.141 9126281.498 35643215.14 8496475.742 18797711.1 13582660.38 16717695.88 903416.7352 793531.7918 6158929.797 143132.22 9239488.977 8171344.808 4767569.021 8643214.946 3875419.427 7788530.986 2329779.139 1360481.292 3296912.232 6710611.468 5330309.176 7735721.611 3051829.561 2883927.957 2961474.005 3821289.662 4792623.575 1428767.516 1338973.701 14764753.61 2201867.141 16482651.06 11968550.9 32534578.93 11352195.15 40514233.87 15558208 15249226.46 7988964.377 7093138.399 11512872.34 5469148.804 15082828.31 10361201.9 942028.0244 8822140.104 3566215.133 7997730.87 4895939.365 2977723.737 3814253.797 3013651.801 7104126.533 126142.5258 2127601.691 4951311.045 10071390.87 137222.4793 2084367.008 5078727.576 7774709.598
sphinganine 32102624.8 17363709.08 16666008.12 22069158.48 18038161.47 21909955.17 43529479.99 22130546.26 37617456.36 27956450.4 17546232.9 29183385.96 28298624.15 18498847.85 25128347.61 15307121.39 25107920.98 17731362.13 30331433.9 19789101.5 21917316.93 24040451.1 50574739.98 27461997.93 43042203.47 31758861.51 36417064.88 35545157.65 24317913.89 24388499.02 238565298.4 399360282.5 200115593.1 205157717.5 711999535.9 214504079.1 28499651.07 14196697.77 33599203.29 24346117.45 17005185.19 38860276.64 20604501.95 25719140.66 9361085.307 24185970.2 22645301.25 19748694.15 19173777.58 27055875.53 19385260.75 31548945.82 19707029.06 17533838.69 20463976.82 25343733.9 38949000.72 45126662.75 33136329.88 29762883.07 33676536.53 409802158.4 228160408.3 419428472.9 161812125.1 224578312.7 18434696.36 27316932.88 19131436.18 17989815.12 21305610.41 36635728.67 33021084.49 23971676.41 20137766.68 23501457.03 29663514.23 29734194.66 33448902.28 14221603.18 28737880.64 34968349.38 28776468.55 37840243.8 22642221.73 20634651.83 35061001.62 28363003.17 3971421.985 21044753.49 39556475.66 267503492.7 97259839.96 332603777.3 340025898.8 434894468.4
Sphingosine (d18:1) 8033913.989 19034939.3 14903275.98 12421886.19 21080984.43 13256597.84 3344551.012 10488867.26 12925311.34 4122510.547 4722366.438 4420952.047 5688457.179 9031764.55 10855723.44 4509858.403 4553517.48 5004469.627 3951397.652 6335086.44 5946786.621 3764250.997 4062782 4083983.552 5449223.061 36611740.16 4599181.142 5958746.095 4814869.954 4663467.037 27705300.17 49085382.77 30370956.04 24110409.21 31688777.45 38633129.04 27535076.39 18395158.68 26820153.32 36261292.89 30219145.68 5878093.746 6222781.904 15032882.07 4689024.712 20172987.83 10383096.54 8614560.306 15135445.75 8811259.584 20959256.95 5670183.603 4699617.05 11458425.2 6954229.081 10198135.65 64575836.63 5790320.919 7709007.173 40118140.31 108552282.1 54269385.37 85653799.29 54550919.09 31895256.6 130104554.7 160467429.2 149126985.1 169954309.7 114777213.7 132251787.2 88790262.14 136208721.5 114163176.7 151308382.6 104386721 205329583.5 172407902.1 116467851.9 86779207.46 184503359.2 310050854.4 223435095.1 191595969.4 292778086.4 193834961.1 335272402.2 230118243.3 13058199.14 161176256.8 310799980 147156682.6 71483374.93 353588003 336827999.3 405762559.4
Sphingosine-1-phosphate (d16:1) 588408.4599 1342393.157 1347157.068 1368602.083 1546269.962 1138903.002 861102.8971 1186808.467 1397179.243 1277521.848 1348748.192 1055838.188 1027501.228 1336482.57 1556219.485 1051619.675 1544308.374 1072377.117 1072622.65 1067666.176 1172601.339 1692529.422 1693464.922 1152190.103 1426617.675 1441704.569 1472322.66 1508926.868 1206630.807 1120108.277 3223198.545 2064598.745 910945.1243 1332833.636 1677293.366 1397457.579 2130217.414 1602371.751 1574668.401 1352599.88 2380213.264 1543529.783 2037005.455 1658637.224 272654.5576 1979939.073 1936154.893 2132369.915 1616348.98 1744655.385 2218003.116 1698103.502 1783872.028 1109070.481 1496301.608 1631560.51 1400780.223 1863630.81 1078276.52 1583786.45 1387083.033 2164691.663 2275120.391 1423121.859 1110016.593 1731360.78 1928006.972 2382633.794 2093252.988 2285292.181 2442139.383 2323431.113 2441008.386 1596038.909 2292851.794 2061055.806 1823992.562 2266753.263 1804086.399 883597.7861 1269894.578 1487346.206 1563098.307 1730976.013 1331402.469 1081818.767 1745546.918 1797367.345 37684.71858 753843.9854 1281958.55 1213973.371 279548.1175 1063441.207 841733.327 876592.6383
Spiroxamine 662083.5871 1437422.399 947909.8772 1334581.542 866612.1868 1313737.981 611694.5937 702440.0399 1174344.081 580604.8905 640009.3958 965109.0332 520758.6594 560902.0972 823860.6245 512527.8007 962346.6416 631647.6084 511735.549 728814.2129 675585.712 597591.2553 502589.8737 678123.8168 726997.4301 638302.272 647575.9039 899916.4269 715753.1585 834508.7423 705929.8903 803144.0306 1599504.896 842626.9412 756609.3953 1070100.393 1950071.979 959827.3455 1750629.863 1296146.751 2155816.613 640899.4099 690640.337 1086272.236 432220.7993 2147540.821 642310.4609 716513.7196 1516928.168 835231.8453 1750412.476 693195.3561 566829.3204 1041534.861 1127498.48 1293992.208 1344059.225 716370.5617 670228.6011 696217.1175 2348634.998 999032.112 942897.1405 1084493.373 741274.0071 1943462.263 2508547.293 2740218.03 3739644.2 2644695.929 2887665.658 2784308.388 3040432.523 3026950.47 3067898.291 3828147.656 6029765.132 4570069.478 1694127.259 1444088.192 4497925.359 8994661.36 8363958.684 4036184.266 10636404.07 7468960.781 10176090.94 6257004.366 432247.4572 8833553.825 13531601.48 7702539.216 4389380.406 15482372.16 17155756.09 22532147.39
ST2975000 766582.579 816504.126 1171196.576 1321840.813 2674709.719 4047206.409 664243.1055 738568.2626 634600.562 745687.1968 3375763.071 2814583.815 1366956.128 690906.5859 1070560.831 1522894.514 3872677.018 4647231.756 921340.0336 827369.0755 699423.2726 2238956.707 3840603.513 3518902.294 1302673.577 230089.21 1030729.284 817616.0797 2932143.961 3017207.029 777387.6985 362355.6729 590038.6968 517893.4801 1961059.377 4543002.607 610527.9623 779498.2048 618530.2419 541709.3659 559747.6673 256481.8124 151892.9051 177720.1676 327174.5059 580402.5798 601410.8662 869873.6767 641923.1805 336549.4066 701004.1646 413164.5982 422597.4688 424461.855 556097.4391 726513.0165 555744.438 626400.4944 268187.9124 376583.5728 318374.7784 429663.6872 401481.6409 208518.222 432775.6408 573684.0379 1586391.18 1138426.788 2521914.862 1884343.913 1280983.73 1541274.372 2161266.984 876002.0548 3010404.508 1423091.816 1489380.658 2050115.416 1204870.68 1293335.007 1089473.785 1177417.346 1181007.668 1553182.835 1604097.943 1317748.679 1451309.76 1455043.452 222767.2745 1631193.84 899133.0919 1532063.718 501071.8933 1260282.12 1575058.645 1048025.145
Stachydrine 14155723.64 45216305.98 37763803.92 38245857.42 11271931.83 11617635.39 8717173.753 19931143.21 34073494.98 37396741.99 37844072.68 13296405.38 43613413.33 42326899.85 25847144.13 18020966.3 14221477.74 41122337.05 14901763.42 23145044.47 14420102.18 16845490.71 21018340.03 43605175.3 27973434.25 8640595.779 10481176.69 13574661.98 6638791.266 23742587.83 15595426.45 21213118.08 15974106.83 35651541.19 23008969.16 16451277.63 53677555.42 15389028.69 7421220.925 20394890.99 20406075.37 25498296.59 49363251 8066852.217 17583363.3 18258244.83 14350154.39 14183671.53 13854408.43 14028957.26 28985951.1 9704813.425 9489035.598 9882393.624 20914518.07 45286823.52 10043187.09 32640867.15 9107152.952 13242412.42 15148479.4 8730003.268 14132258.75 28895469.69 15917526.43 30541478 42003625.64 15889018.38 42052098.73 41113690.29 66147828.91 7863975.95 12654898.87 10041189.29 20679556.72 8358382.179 32368317.93 13857297.88 46363271.4 23022123.88 16600344.04 14124131.29 37607683.11 23725086.37 23912511.92 10458703 12796155.48 13347367.43 8914764.024 17749235.2 38587829.28 54708446.05 8158529.535 15293131.36 20002905.98 10592746.02
Stavudine 34885183.89 27256327.98 25337004.75 58178181.55 52558719.24 55049112.51 27074387.54 30251762.51 30956663.99 25207285.62 8159972.621 30931142.64 22469676.79 35295338.18 24970377.19 14856370.31 6505776.687 21599945.55 26790600.35 39268958.22 26927029.5 48193644.27 26508832.32 29919888.39 24600008.15 23420141.7 18674874.54 29515633 36867417.2 44781555.31 14926062.56 18131365.07 10897349.93 25147977.41 26181991.76 67663859.79 24580604.44 13533157.81 31083321.39 19302597.94 43040046.92 6450112.749 14332074.04 23653393.25 8547166.844 63436590.41 12923350.1 14713827.3 18500854.21 33193831.33 50039522.47 25001633.69 14686253.08 19059704.07 20254639.03 50811374.37 29901598.83 16139220.47 17449143.71 26357991.24 42258463.01 16934631.67 7447775.878 13503431.62 25734107.58 35483452.59 87122289.06 90533925 111343204.1 103857357 100152239.8 80973342.19 78998620.28 95569370.08 115595580.1 78621366.07 74640415 85075209.22 87780178.73 57988751.62 72592258.33 49880049.82 77561411.95 66013169 76744678.63 39370659.88 49770320.74 50389202.76 1895457.954 39441621.22 41164136.11 42017700.16 4296025.437 43169029.79 51401314.28 26359954.95
stearoylcarnitine 171331908.5 265177003.5 210456713.5 315407567.6 211005814.7 371398683.1 122740726.2 224641135 253135751.8 129100689.3 96660752.12 113063670.1 231365275.7 238003873.2 299086393.4 179814728.5 140222246.8 190432885.5 282342616 254914521.6 346183128.7 351465528.5 162996633.5 210609330.7 252424275.4 215041543.4 300043345.5 254212106.7 174632989 193883339 256215111.2 261825682.5 235852459 334656771 301063102 338814723.9 224671853.6 211172106.7 306098692.4 239675047 229610281.4 31913764.71 70970421.85 231516975.5 57227582.85 269223235.5 126132920.6 170108050.4 202240287.6 211071166 260076847.5 183248765 177968697.2 275012704.8 272549341.4 316501807.7 209205441.6 197464165.1 260263362.7 214775841.2 286808345.5 241653687.3 172398699.8 231757128.5 152321494 279459400.9 230420243.4 180502480.3 202716309.1 154282384.3 204075998.4 270733044.8 209924826.2 215615190.8 171768781.3 312126724.2 243818932.9 339155568.1 266892560.7 149860116.4 250771511.6 258275330.9 228265487 234269134.7 211157202 173557999.1 192669704.2 168933138 13893946.48 139224911.2 262758758.3 165094956.5 68659074.87 141756414.5 186189388.7 243749505.4
Streptamine 4-phosphate 724557.6529 2893614.72 1329697.116 1561795.771 450017.7029 1145185.022 1895796.983 3622715.847 3665962.209 4508562.966 5246865.142 3270340.447 5970334.891 6195555.309 5943174.149 5951727.175 9147980.552 5278684.625 7181480.65 9984381.704 9391955.251 10667544.52 13199484.68 5836517.195 8666839.664 9662974.638 7790616.411 6166454.185 12272724.46 4272462.916 9200571.868 7354487.821 8412535.362 5692688.957 5231521.587 3032716.102 2013511.381 325339.6548 740978.7134 790359.5451 692949.9947 6548095.489 2666839.009 1453151.96 952111.3525 1172671.339 8080350.367 2885384.611 2448749.008 4460771.245 2880035.389 6643484.009 2893306.212 2501762.27 4601092.141 3797235.397 7105192.865 4231301.895 3749351.749 3855463.658 3663804.6 3825248.697 2782891.428 5564752.007 3627652.305 3596950.252 811773.8752 742629.4294 787840.7069 554458.5791 730550.4422 1423331.347 1573217.841 768062.4798 1003840.652 1623886.65 966138.2826 1054322.888 1271377.28 698332.1289 2556039.833 3421877.795 5425808.362 2770159.588 4541370.589 9288843.242 3174539.458 5385635.991 361616.8502 5457118.648 10301797.83 3292613.858 4042700.918 3663782.802 7371772.904 16075624.46
Succinic acid 132223628.3 286610074.6 229088825.3 205464867.2 46967942.56 201783110.4 163667076.7 277081286.7 202312491.5 239974894.4 91011847.39 319730342.9 180262653.2 345333134.7 204574316.2 90681538.78 61401646.52 306209848.3 134901691.7 270345775.7 214920218.8 198190533 64936965.32 260905809.9 128698184.4 228376592.8 175099121.2 132772632.6 67408883.81 215411096.4 114392272.4 206318112 158939650.7 124865349 72690601.56 219027339.2 283840953.3 32268809.71 79331744.57 204963088.9 107217171.6 344973160.2 170946199.4 74951032.89 17351668.02 99732784.78 410648618.6 204492344.7 116609007.6 152941576.5 125420959.1 201304202.8 134018258.9 92607734.83 117229179.8 84775876.33 307083465.9 151583827.6 90987406.37 99518710.39 79456225.42 228956455.4 29219433.78 104341011.7 130289357 80183290.04 61411438.87 60225209.32 90836892.02 24532672.12 46606918.77 81483139.08 79915199.85 69895040.95 107708791.3 66986443.42 51127475.19 72920675.04 58149687.42 15886052.89 58537913.12 37033171.58 58032403.14 31980696.38 49782019.81 22901097.88 52527739.99 43104418.57 11926579.73 12228050.87 69849231.48 46719199.53 10987207.62 9834503.116 60569774.23 62305580.14
Sulfamic acid 3603786.411 4843764.497 3332485.614 4611729.767 4341309.319 6703873.399 1185947.604 2464945.036 5979117.915 3914107.441 7076440.293 3981309.354 3975466.365 7635908.646 4014609.963 13059059.2 10273779.14 9374345.195 6756821.119 7824701.013 14274456.23 7895988.79 10210801.65 7775514.526 4803280.745 4941678.526 4365550.496 4041075.38 6137233.594 5143320.607 5076733.518 5980397.724 7309876.725 3648047.143 3779267.853 6661244.204 6466753.012 4436136.5 3373165.459 7445713.235 5186828.192 1874664.333 4147474.775 1297827.169 994629.3683 3039146.608 7121410.397 6704911.168 4469169.82 4169322.376 6104802.924 3652161.272 4512889.69 4522048.75 10639353.2 6068111.873 8882425.352 5277708.276 3102633.435 5856518.219 6606961.987 8889354.732 4953495.198 4087797.847 21284942.76 9914674.472 2582981.98 2846533.786 4880265.291 2070667.253 4594675.769 2159024.98 4822577.299 2111611.528 2190121.259 1407340.245 1341998.067 3835827.063 2509930.08 9188193.55 794385.2303 2430866.444 2658943.84 3523366.808 1990600.351 2057469.986 2062042.364 4716524.384 223882.554 1981215.211 1741955.207 13595496.63 1281022.628 1820955.441 1443211.961 1975608.329
Sulfolithocholic acid 8530699.876 6690573.034 8634534.143 7173678.894 9856613.243 5378284.472 5420247.488 10110390.32 7876090.847 7086671.809 9613382.656 8347989.235 4235727.645 5748962.822 4568206.898 3736134.845 7781847.25 6279379.757 5418275.767 10900695.89 7649298.901 6219201.548 4692269.934 9112100.524 9023445.748 5951978.217 8230841.853 11879159.09 9018128.712 13064194.73 8956839.382 2043973.105 10353921.37 7811395.691 6473705.342 17079463.85 6650995.905 3454176.226 3481761.402 8539674.039 9451444.45 6668047.443 8602509.179 6211037.883 779215.9343 7984666.727 8004520.457 8928620.848 7739070.857 7715275.132 4160130.088 6760157.7 8972874.655 7014942.815 6829078.381 2971969.289 6538936.621 9579118.281 7501952.266 6874348.333 7513987.911 3255288.258 4230621.853 8148362.646 11440036.89 7679630.804 6902406.518 16377664.14 6142694.006 5486847.17 5648961.627 9045059.532 7950092.263 6843792.135 9778058.827 4369802.943 12905516.94 8534466.451 7767842.012 3879107.581 6687771.121 4988614.187 7227093.36 7053863.003 6273773.221 7890415.053 7954031.758 11172859.17 152540.6419 3210390.871 7184858.086 4173209.46 1629619.668 6586775.102 9856318.045 10182659.44
symphytine 46278.10781 45842.94393 51030.8922 56018.30418 53926.69793 49854.45489 689121.4612 570358.3425 1048798.931 811385.4021 746911.7103 1403394.695 3364904.458 2809990.507 3894619.773 3374854.464 3365138.951 3760342.761 7819015.77 5322861.48 6679113.535 6438640.038 6821958.464 7179640.987 5360330.571 4967484.514 5496218.127 4994351.269 5856981.807 6391090.757 5304008.445 5379347.875 7366296.742 6599984.826 5734434.047 5657813.887 52908.33814 43611.94463 53993.91884 53789.24296 51688.70764 827343.4643 250808.0436 453980.335 346407.7554 663203.3114 2168298.032 768105.1971 933807.6536 3430164.181 2144783.125 4606152.942 2297549.487 1886375.995 5369624.556 4769198.578 4838173.814 2624139.927 2961981.073 5117945.099 4800293.522 2736676.128 1470403.889 2265031.101 3552213.178 4407415.371 343107.5355 470495.4683 461280.584 57679.0772 56724.44277 2647128.758 2423610.444 2754204.798 1601354.184 1594325.932 6257527.135 5339613.311 5663055.892 3131088.417 5519015.425 7372958.335 6211061.176 9417228.613 7259922.408 5528734.677 8813900.178 5331334.04 703560.0375 5823596.278 7327585.191 8651553.838 2846640.232 6720491.281 5924832.246 7072949.222
Taurine 260271500.6 251297721.6 201391996.2 205097647.1 284621515 277609706.8 189841257.6 236719114 263837669.3 202642295.5 344859309.9 293365589.8 214058113.9 231786005.5 252510519 203548311 367945730.4 305962175.1 241501643.7 240591954.7 246505226.4 221490789 345265959 304875853.7 217839884.4 256420712.2 260362997.6 192121013.7 288583285.8 296120847.2 221671463.2 189648809.3 234018225.3 157147324.1 227252771.7 235592200.1 227863012.8 227671363 211267263 237719292.6 244066522.1 267812478.7 380737867.8 190535267.5 449864788.1 327896884.3 212452140.5 335706173 210008347 293379422.9 327674509 220435488.3 285534198 195302598.5 283405453.1 309937799.5 219983572.4 198357216.6 182500477.9 227750517.5 345756057.7 184386810.8 212943666 180456498 169066390.1 240217298.4 304695258.3 326125705.8 319119342.8 284116745.6 285618975.8 288603675.8 297221303.5 330695879.7 248409775.5 267366859.8 267607006.9 277433085.5 285227721.5 254733109.1 261538371.1 275574540.3 307621999.6 313003938.4 243980934 243732882.8 279810068.6 311883452.4 261356805.4 229281703.4 247864565.6 264230731.7 366721284.8 228469495.7 248079079.1 229193195.3
TBHQ 3159293.487 4275359.736 2373332.529 3676901.028 2483903.093 4529401.487 2842797.259 3494456.244 2008248.135 4034205.137 3486232.498 4899468.342 4999723.418 3968755.631 2345241.249 3116306.757 3056178.82 5249336.161 3718396.917 3580411.055 2845500.284 5338024.292 3496830.209 5719388.919 3641294.394 3425834.797 2336303.092 3659936.822 3013127.278 4595752.849 3600316.623 4145499.345 2108653.389 3141812.153 2119749.222 5563026.635 3654333.314 3600443.104 2684312.218 5753177.925 5508937.34 3206507.532 7864593.849 2768586.874 766021.2141 4813878.847 3957292.92 8874189.198 3214223.22 5574386.789 5754011.586 3137276.823 6433291.061 2691425.627 5709063.193 6016040.572 3452060.896 6448773.02 2588621.3 5059361.63 5068841.34 2871574.08 3578048.759 3388737.121 5441257.787 5422025.077 3443958.748 2945150.746 2823347.243 7087310.138 3635217.325 3224166.068 2688340.706 2184228.871 10380402.94 2475931.863 3199827.691 3185213.101 2634485.242 3616272.441 2832308.91 2594652.555 3212211.757 2855699.653 8501855.973 2125354.396 3092804.022 2983415.857 300336.2338 4548897.398 3335503.72 2620442.302 671633.7737 1928797.213 8342587.381 3421936.092
Testosterone diacetate 3399582.958 4580872.839 2850208.952 3893127.134 3000766.269 4967831.221 9047808.24 6252087.884 5587528.462 10143296.96 7418733.316 14410755.37 12106685.84 9267122.762 8836303.171 14574215.53 11175037.22 15275811.76 12122694.39 14240518.92 9020513.992 17147101.66 15085956.01 22626828.5 13939830.04 12212876.95 10462580.09 11187953.35 12729396.58 20359129.04 12620811.8 13278473.8 10672716.43 15601745.74 9248547.472 13931200.08 4031164.723 1768948.569 2602286.545 1800592.772 2512695.578 5965789.524 5266165.787 5315147.846 476346.3177 3723059.079 6457288.834 6420125.067 7629286.938 4248457.47 5826215.268 8345527.479 7448070.864 7672830.494 5813975.913 6562641.976 12654100.74 8558820.781 9560931.908 5301472.049 8747749.16 8001266.342 6226468.23 9940986.702 4376600.693 9119253.4 5987830.938 6023201.234 5614945.834 2465226.017 2934459.407 8829176.11 11186601.84 9193055.91 10624967.33 8303033.259 8298516.733 11630541.73 11432131.57 7105825.177 9419654.959 13591312.41 19129301.41 17864805.86 11801155.12 13287152.66 16115795.26 17816270.83 1967183.353 16503536.92 15747204.07 14693221.4 8176085.542 12635325.52 13610898.4 15052255.18
Tetradecanedioic acid 12403122.73 15768997.51 5333724.791 22456239.72 20640921.62 45955038.42 17098860 15607255.68 5462998.806 28664019.15 35943876.28 56711284.86 22952424.51 18966292.03 5344388.752 25807356.98 38097591.66 73675489.23 16961954.37 24584327.55 7455144.136 40369962.71 37865319.38 62236484.8 19033600.97 16696767.48 5610538.513 23035543.58 29240597.64 56891253.68 17626125.07 21257055.48 7171811.21 24692260.64 19018461.72 47884032.03 13666063.76 6137100.177 15363438.22 6759723.627 10081014.94 17048564.6 11365106.97 14762167.83 1928915.413 8414762.12 20930167.13 8650384.335 18979401.65 9542608.639 6332099.798 15104857.83 7146540.245 17006955.99 8683155.103 11140578.8 17280358.23 9434363.413 16123334.42 6998555.959 11667484.01 13167510.62 5328251.062 16932736.21 7448270.803 12361923.06 4892353.662 7093656.331 4949118.953 5128083.737 5085128.788 7414072.221 5678950.997 4370959.841 5753961.64 4610407.47 7640304.976 5877107.156 4712457.324 4629258.025 3583384.293 4443338.649 4503527.321 5375921.068 6742811.993 3768182.739 4782463.63 5413213.978 1097454.798 3718702.083 5329386.561 6064040.284 1097277.448 3574355.013 6528977.739 5146560.196
tetrahydrocortisol 88400.80109 359444.5142 87281.66711 378602.2246 13065388.31 26077507.54 79891.34614 393861.2113 79015.08597 342279.0088 27651450.65 36726072.44 159577.0895 122746.9059 99859.88728 264397.8172 24044466.72 40490601.88 287566.8743 393646.6548 178592.5463 613839.3094 22938081.63 35176698.97 960195.7327 553972.9743 270258.5245 631829.7117 16451573.8 29192788.17 1687618.36 741264.7411 499272.0253 756521.6236 9244495.474 28023119.53 77187.4145 77748.57177 74054.64289 79144.9552 86494.51595 120156.9858 84185.63633 80823.41468 58679.98445 79026.77701 161720.9051 97066.99037 70254.93352 162315.7032 91348.6755 205508.2768 88169.23953 135397.6685 188999.5089 222339.0723 417808.4394 470312.7677 386144.7043 215124.6656 185784.4915 1261557.715 214894.5675 1000212.055 292701.9239 312813.635 6296065.97 4575997.833 5774827.43 8422553.684 7792782.01 6810532.585 5085438.48 4967430.963 11493062.54 6909369.95 6223961.78 5701493.598 5637611.73 4761907.127 6930725.404 5960849.666 5047540.289 5402045.347 9455580.504 4752563.201 5851366.121 4224967.993 183495.0891 5806303.958 6494484.602 6158896.054 961962.363 4015557.291 9226900.029 6890409.021
thiamine pyrophosphate 5421349.044 1884264.637 3990624.087 3059114.507 2266860.762 2718199.318 3988124.126 3916490.948 6094363.043 4705110.708 374123.839 2499455.261 1525373.307 1839923.359 4191098.315 1402916.942 583219.3795 1947812.094 2060179.219 4296589.954 3396208.623 2994455.032 2941031.717 2648700.039 2258329.771 9481572.684 6086572.492 5270689.168 1550319.993 3959684.627 1926865.082 5288866.135 3665043.668 3799579.402 4031107.537 7520733.536 5422016.052 1269074.851 6720070.558 8718473.862 1100689.199 474391.4506 1185086.412 7129977.436 277691.4446 4259911.003 2669011.397 805362.4588 2693816.929 7835175.597 2879309.989 7682605.562 2570804.579 7494994.402 6483502.238 5389436.719 2993772.24 2477435.907 4776601.018 7796070.461 2961526.74 5153269.053 3886778.266 3447037.381 4007244.792 4455851.058 614738.8876 922499.4306 346713.3529 368050.7069 603798.8821 381225.2268 346780.0111 263788.1906 302597.8671 266810.6531 823041.2093 329620.2063 277892.3965 186519.8208 760087.3404 2168257.939 1318287.632 1030307.796 1416581.909 1864592.721 1636216.387 2127191.283 85019.07487 1876709.263 1620495.818 4570140.581 206738.6692 1488062.742 1216935.88 3381556.301
Threonylglutamine 139324.9983 216714.7614 158381.1721 180713.0705 166744.4565 199884.8615 121837.9216 176809.3744 149369.8339 124966.2822 168985.9705 152526.6072 152935.715 194533.8328 308801.2629 242681.7142 170030.2465 219719.9892 395788.4627 353318.7963 657601.814 618946.9377 167832.3212 218242.9847 488717.6684 235988.9108 335877.9885 435881.7788 214288.273 198098.6136 417511.1659 525501.3434 749341.9332 741828.1151 473709.0245 375559.0271 467447.6559 158267.6333 159546.636 463539.2099 212002.4723 191073.4823 125699.3444 143055.28 133452.444 447671.3152 487379.964 467056.6096 175596.0341 1072373.173 910441.4498 511904.6558 631422.2402 245225.7086 1561263.347 1213266.945 578528.719 897796.2094 221810.0802 1709540.982 1322819.891 1423225.107 949201.848 376943.8699 3116193.159 2614218.099 165221.5003 189544.3007 232400.731 174912.6322 143744.7764 1165494.18 1111576.31 531318.7673 380175.5199 635817.5877 1220237.5 1625869.657 956798.4548 423573.9506 955244.0083 1346316.609 1612362.407 1163074.677 682410.2879 970555.1867 1231087.682 1771975.2 171696.438 727938.3962 1146086.306 1702230.402 526615.1582 1080820.227 883066.3297 1363514.392
Thromboxane B2 492994.8233 2025534.798 660671.7709 843879.8741 578028.7171 913726.6291 4345128.273 8200469.35 9675067.895 8254278.814 6279169.918 8484635.338 34773001.25 19965718.79 33978829.83 27361333.65 24972884.4 20545985.31 65123910.02 43638651.49 50948710.73 90627686.25 50610130.1 53960733.25 159387001.5 68378194.12 58703870.97 64288181.86 57511394.5 63800305.78 302570242.5 127674810.4 102273059 145644499.1 129288941.5 121707301.5 405879.9666 378111.363 850559.2132 5216521.129 1675486.07 4627383.37 2794219.113 3547717.779 2885367.099 9189293.994 12221752.33 7495920.821 7448245.992 20007288.6 18159592.34 54955107.71 19125731.24 17429890.74 43394845.55 51871702.28 72738388.76 62973123.19 53843195.15 46418334.83 41068271.62 139837813.2 120591020 176668845.2 67453637.33 61494346.59 10182127.69 6017561.917 8077049.521 1934128.226 2509168.359 40150163.69 46831857.69 33430280.96 38517269.89 22383309.92 58135445.73 75769552.61 86984013.55 25078214.99 58725637.01 103218734.1 118146530.1 135153752.3 125344794.9 61197838.73 96510337.8 107616479.2 5045304.383 82733908.04 100457629.8 116750984.7 24447954.24 103888291.6 94346134.76 149448940.6
TI1090000 272966.9675 250276.1856 265571.61 281454.3706 507457.7126 264868.0155 258576.1775 272352.1708 441234.8659 564900.6945 1416515.019 667669.0193 724083.0674 337214.5187 1202751.011 507583.5196 1593779.087 1242488.956 1159769.849 636738.3424 1953657.661 2374232.59 2174269.978 1711417.117 2123334.685 754915.515 3800603.341 2940176.608 2685880.534 3322238.822 4783331.704 2810378.877 2422616.508 3230752.739 3217339.133 4790264.822 817878.3517 208337.0931 652340.195 248692.6117 261351.7001 815323.9458 503621.3449 926457.3216 153614.4777 643392.4417 1296818.879 311989.6613 990745.6643 2745266.157 792981.9311 1170330.442 1083312.988 576674.0512 2620268.352 1688809.867 1659493.971 2528282.439 2138450.471 3650341.735 1762628.604 4681137.622 2305009.226 3361727.737 3832274.691 1976163.886 253395.3664 258430.9779 264894.1939 252550.4785 262976.2208 1504732.238 1497320.627 1537981.267 1649920.148 1175675.19 2329366.197 1973117.57 2956263.296 1427646.398 3449121.387 4048715.978 5695574.765 8505292.623 8460820.735 4430847.966 4176150.197 4337761.754 241111.022 3739855.56 9255059.967 3940587.442 1573064.27 7984665.67 8603257.352 9993835.446
Timonacic 3819864.049 6051699.702 6132978.695 3276788.05 5441602.274 6818453.974 4366201.219 7255867.051 6184974.798 3974424.417 5145478.881 7392704.289 7482615.615 10912960.46 9826801.017 5769506.327 6550891.315 9423445.335 7963935.648 5968928.088 9516879.464 6363273.623 14481701.01 9539803.604 6560085.093 6253607.182 6008138.267 4900638.733 6671303.464 7786943.119 8124499.013 3435013.838 6977811.492 3683832.647 3874602.191 7231937.234 5707832.599 5058996.968 4617569.588 5693738.166 6166415.52 2343630.732 5353125.659 6664438.438 3737015.824 5898259.672 10775175.48 7941418.801 5780893.995 7610475.889 7732691.594 7514036.732 6583109.643 5726717.241 7658009.34 8016721.345 5641628.508 5747194.352 6254983.283 4435619.739 4857183.66 2718433.703 2971422.617 4398468.575 6818797.481 3621196.118 3330623.037 3106454.422 3808873.17 2522849.043 3011651.252 3246743.881 2304854.026 5327784.684 5609016.646 3782013.611 3430698.61 2790764.474 3264881.731 3164152.221 2912894.624 2559944.33 2540819.07 3201587.091 2478686.6 1693719.301 2520828.709 3226339.099 899794.5968 2693761.62 2408586.444 2064557.038 1094792.26 2387232.326 2537819.164 2510461.229
tinoridine 7577799.093 5456194.144 31105645.77 13150208.48 51981780.55 86635039.71 9765757.39 6705380.953 24865184.21 10970044.54 46499209.47 45916533.82 12631408.94 2002105.042 26265575.93 10217574.56 37418444.71 55180740.03 8802923.988 2282717.368 22957973.58 12916983.45 39365064.57 55876343.41 7840415.245 1781355.268 13958981.71 7141618.765 47430558.13 60825306.46 9623518.89 2230818.502 15623404.08 8545058.993 32384453.47 64865636.08 2879741.95 2114177.422 2495766.448 2327171.082 3749705.662 137129.8904 843561.9878 2964666.724 390122.5988 1378536.744 2454195.74 2109955.837 3600143.104 2616180.565 3950321.556 2038057.731 197450.0845 3113828.665 2508137.851 2981975.719 2653407.599 2426666.749 2513597.208 2101878.082 3744610.937 2487569.478 1612570.972 3288007.478 3237347.819 3826460.05 2984586.798 2895998.605 3424445.619 1918162.21 4146309.434 3829021.517 2991969.26 2885628.975 2899795.58 2910862.669 3290247.597 3975338.058 3072414.742 997126.2807 2140009.198 2403581.982 2832646.037 3229202.712 2552183.441 1394756.254 2734607.095 2973957.257 67263.99254 1220892.827 2168575.34 3138181.487 640328.6985 2359421.563 2396566.503 2484137.737
Toloxatone 15450952.55 90510321.89 33214647.81 36405002.66 10301365.18 12529242.24 16243974.11 86607844.03 23832069.72 34266353.52 8764314.328 12824990.09 19518557.43 91169675.55 26308478.13 29925952.29 8817678.282 15043350.52 18160806.62 86552398.36 33552667.5 48768377.65 9309900.51 13087372.92 13025409.35 60451413.67 27248729.52 32246662.17 9548873.508 9686585.983 13081442.56 69275744.11 27585023.97 33093899.8 11080252.29 17234413.46 74766135.5 22976587.51 34688976.75 46548764.84 82736595.55 68187144.96 39509724.34 38676241.97 8499805.13 72985172.44 81687671.78 42818300.05 38559246.39 47475281.87 73766747.71 57359831.88 31535693.91 32011161.79 45939574.38 72417612.53 58323935.74 32676716.95 30050301.7 37618401.88 71483811.92 48796386.29 19079435.46 25558669.41 39316047.76 57844883.82 12334888.26 14353317.06 24328732.7 23491389.84 19486884.59 20245303.34 20900898.11 19289101.84 34158102.35 20159382.05 13663233.5 16864807.73 21263942.26 13875534.89 14297586.73 16527082.67 14167882.88 21099683.82 28770173.9 9258704.145 11170936.11 18412278.48 1201856.925 14080729.89 13122837.8 15354034.12 3522345.874 14837231.57 24454402.24 19944241.16
Tomelukast 84398.38769 28267.22394 29150.89403 88964.55491 28683.1647 89165.55216 27365.25825 25959.88602 134321.4133 65794.75608 30487.44152 28416.80251 26434.48465 28906.65123 100884.9773 29902.15404 42003.6773 38370.3343 175242.8474 149985.7609 93782.0007 89602.64454 146171.1019 109070.2184 1029087.133 518289.4478 371112.8761 343031.3164 185811.0803 277751.8048 174595.0472 114647.9861 108955.7783 82884.84189 289953.6391 172723.0135 26339.05351 25436.20448 60389.67817 26542.91509 86403.47496 71178.85548 47888.48813 57854.5428 20787.72929 82779.99423 46201.39507 28147.84539 141184.4105 69826.82137 79866.256 89406.77702 71238.39017 87167.93016 136034.7791 172070.3449 626203.4365 1017177.855 500797.5535 208252.7769 493500.6189 202377.0698 100748.8418 286079.9843 90193.10818 210505.4472 104698.8558 105942.1293 98323.19066 105132.0524 130034.3265 34657.02716 56870.87108 74760.07932 52578.07276 26092.37485 35130.09255 72603.75559 122016.8244 38288.58464 40129.31149 150957.2025 145658.4678 166787.1028 60742.33292 65767.20355 243949.3633 265489.5118 76698.34936 466104.4034 378599.2578 452335.435 93324.69455 127055.6009 398295.4757 428672.3348
Traumatic Acid 18562659.05 23935220.42 15954565.02 30310898.43 19432321.47 23909844.75 16064061.25 21879289.14 11091591.38 29803303.48 24766688.58 28182307.3 21938703.9 20259336.52 10837861.73 21286672.05 25974092.4 34107197.55 21547137.76 24224721.62 9783764.224 41745815.59 25973696.26 33048357.07 21628196.3 12471784.89 12657419.67 26228500.38 23894388.28 30409397.65 14380458.61 22247678.83 19559922.23 26364647.95 20269053.58 30808724.3 17048914.21 14168227.21 34312813.19 19580768.79 24703620.72 12871382.23 19753553.51 30138241.16 4587689.265 19856049.39 15295879.78 20853146.89 32101858.99 18611922.12 18289820.76 22441398.29 19825076.69 26771386.88 21661029.59 13673236.81 30324972.74 23989891.3 27008841.66 15152541.58 20318039.18 22538496.96 16203146.3 28835098.51 21380823.92 17485990.69 10200164.27 9179588.993 10361227.89 8015901.584 11299035.1 8462074.157 6454095.022 8273005.545 14038160.35 7701593.918 10442773.51 16453044.22 9220575.759 12577290.12 11652663.21 11311191.43 11743353.73 10309017.81 10851840.76 9967275.093 9439736.355 10731098.88 5496590.345 9763911.274 11827566.85 16219873.43 7208401.582 11283023.64 10816363.36 13465187.59
Traumatin 1875979.895 1557635.332 1595356.144 1670074.021 1645404.27 1725541.68 1533869.483 1510372.638 1663777.056 1571820.996 1563278.028 1586980.54 1417740.661 1505277.281 1415067.167 1193678.33 1763716.6 1597155.05 1564453.288 1713702.897 1739758.442 1619516.377 1408138.281 1739760.873 2726739.813 1752516.648 1721697.238 2089079.199 1856065.577 1860144.148 5281226.246 3266132.105 2194941.885 1998878.404 1933217.674 2846964.388 1508975.403 1030229.665 1384004.976 1496188.312 1600545.152 1575832.438 1488189.081 1632489.801 748185.6602 1582797.831 1607521.188 1652727.539 1843785.989 1761121.824 1427181.037 1535043.137 1575782.107 1561528.08 1672577.07 1530397.999 1638240.427 1803486.451 1739686.915 1755518.822 1678755.463 6178778.779 3208836.24 2735301.436 1870045.201 1793950.261 1519214.773 2043277.262 1404241.223 1324793.173 1524488.886 1689924.789 1635565.639 1443228.294 1730616.391 1373386.518 1944011.638 1758277.328 1580133.121 1529089.189 1462566.115 1652902.241 1669949.088 1775981.36 1736838.146 1839803.597 1827382.74 2033932.613 781478.6652 1285557.722 2325033.498 4174517.906 1288709.137 2264971.205 2306834.099 2558375.88
Tretinoin 526917.34 799321.3906 415652.293 711999.6838 343059.8046 596519.5805 4839735.709 5414412.869 5525763.318 7811276.626 5793081.045 6252883.429 30621761.03 19894921.63 16317381.61 19129413.59 13535218.1 10780906.59 35378912.77 20001966.62 23363987.79 39564743.52 26955813.56 14972848.76 42714684.65 22719016.71 22021486.92 21561186.7 18825745.67 13174368.41 42188977.16 28926401.35 23971510.42 27189505.11 18394990.04 27624265.46 617798.1135 245784.6392 495513.1528 1156174.408 560491.8482 7310878.757 3319792.896 2902744.511 1831115.907 6493474.29 14066886.33 10337835.89 6603567.333 20256773.87 16628934.52 16074225.12 16286966.31 11448000.11 28290672.42 20510335.27 15173487.81 19778420.87 10543546.28 28118812.86 22745913.85 11809389.16 10920442.16 12152638.84 16750027.96 21847366.36 6446128.45 5000560.004 6183339.707 1127369.079 1367397.947 26876879.76 22714347.74 21304221.01 24238934.79 14679990.24 43367985.35 45428466.4 41919929.76 21628439.2 40395277.25 45870644.43 47938476.06 56856343.47 68611246.82 31505166.94 54184097.86 42917159.02 2608104.893 34201686.73 39105823.09 48266802.33 11646360.03 42111984.77 72856227.11 61345045.8
Trifluoroacetic acid 522162379.2 471526393.2 498454928.5 488480905 510545127.1 453638428.1 583059838.1 480324500.4 475018210.9 535784500.8 505337652 564503987.2 515705281.1 480034385.7 474080473.6 511902810.6 509830397.7 470635393.5 500392052.2 474527910.4 466435658.8 471310465.9 502358378.1 495086413.4 489870855 480042861 484043230.1 457705822.8 478871548.4 452827073.5 483957173.9 488703287 449007909.2 469198022.2 462019686.6 424537933.2 490707339.6 517873119.1 492290613.2 489984306.7 494990187.1 538994102.1 559038703.5 495267320.8 436505570.9 494244332.7 487027809.4 522654483 467906988 499444787.6 472458524.7 494255852.6 492714059.9 477510815.4 469110643.6 454045110.1 473808768.7 471444607.8 474520398.4 470820979.5 481943778 473570908.8 502116024 474544513.8 434237376.4 467105968.5 488263796 483582038.2 478149647.4 488139692.1 501439791.3 485836664.5 466478942.5 499265839.6 495776423.9 494575041 480660962.4 457458647.7 465870380.1 503808243.7 481148578.2 475713809.4 475003236.6 486280447.3 473916522.9 527308287.6 489123728.6 502258634.2 252415247.8 518879298.6 499410240.4 486024183.7 402272859.8 461023702.7 490772219 482829133.7
trimethadione 3862266.56 4344935.742 2310159.234 5485945.175 6615518.779 7880451.571 3655155.346 3481152.227 2988825.813 11175100.74 10740827.68 5326996.053 3732312.876 2608564.421 3010901.611 6780286.744 12106750.29 12181302.98 4479301.623 5045015.847 3070399.502 7908917.535 21273907.55 14866364.53 3290225.458 3167245.073 2925835.092 10853154.1 9972919.166 7822107.819 3005295.917 4001766.565 3385345.043 4720931.976 7508685.086 8571923.193 3186398.557 2519925.548 9969502.471 2491478.191 3575434.764 5653362.989 2875437.784 10669016.46 870613.0999 2440581.439 4515860.189 3882592.497 8361545.806 2481752.016 2961909.162 3694402.821 2394809.156 11555972.25 2135241.582 2347203.297 4977140.961 2261332.043 9366781.106 2114103.128 2093422.816 2767544.145 1875542.828 7583536.248 2523591.546 2181491.959 1396827.776 3719286.615 512696.8486 2036760.768 509509.6687 1421759.751 843647.9681 207612.3448 2230957.589 416511.417 1088307.775 888461.4047 3445666.221 1154966.373 571872.6716 1081813.384 1030866.986 529334.5791 1330684.866 3017471.337 1057694.104 864005.9618 2655804.919 1328731.883 551990.3091 834330.5982 2645470.289 166439.9357 1470013.754 438706.1035
Trolox 6708416.998 5248207.884 3192611.36 3606582.884 4759338.916 3946591.449 6545912.45 4674739.272 6689984.922 6226923.47 5155591.689 7540132.72 11398355.11 7103480.781 11187795.56 7788788.076 10233612.9 10650915.82 19212365.37 10388223.53 15465789.12 22133006 15833993.45 22003193.78 17700591.21 12119594.89 16768567.67 15990280.81 14522198.58 21579963.07 17850727.54 9851539.063 17830861.04 15322595.75 13905769.59 29413077.36 5951181.558 2339192.51 8816635.147 4104856.607 3839857.066 6612856.05 3995812.862 6851212.715 2295365.65 6271083.51 9068675.716 6806459.516 5883440.817 12189577.86 8863016.467 10941092.69 7798955.457 6069736.678 13290854.54 8742841.36 12770010.34 9849025.394 7082362.344 14043806.11 9735069.431 10289019.02 5656457.51 7418107.338 11093136.06 10594167.8 4768226.475 8495556.611 6174765.329 3168176.393 4768874.968 12892873.18 12166025.29 14039620.53 8851914.95 7233402.72 27215461.12 16637949.05 26449919.13 10381747.13 31066083.3 42261964.07 37844350.57 59265490.18 62355914.55 50317260.87 42283990.93 35678605.97 2955045.148 41666213.14 62689363.93 41460690.19 7649779.104 41730322.19 64963120.78 68559291.68
tyr-glu 4446138.981 11084060.76 26091049.06 7324479.07 6701475.786 8064765.288 5165103.138 11045178.62 22139631.98 8589733.107 17593212.07 11599864.62 6039197.517 11046640.39 23321185.67 12076178.89 13536106.36 12319173.69 6520722.377 9776374.395 21371027.68 15305140.86 13130131.03 11987710.7 4662119.029 7303589.609 16441648.33 5353545.643 9300412.515 8382537.795 2512794.301 9291982.842 12539690.24 4207119.089 3155425.296 6347879.619 16414380.17 8419890.963 4318629.171 12621151.31 15548013.81 20416095.39 12728075.03 3556437.185 3690067.14 13853847.36 24826710.81 10955550.56 4322743.891 16641530.09 13352808.66 20396292.61 8593674.32 2923518.285 13873387.02 10411352.89 16720797.61 7645047.861 2412455.986 8909870.332 11457463.03 12410130.23 5763903.554 2223047.941 9400791.099 10764268.74 7355419.101 11662814.92 14465747.36 8923644.552 9955413.222 6195999.35 8502345.047 7985817.309 5448451.823 6027180.672 5227493.985 8283842.637 8541611.216 2293294.844 4631524.986 2764577.766 6184926.426 4308585.025 2709328.832 3004451.337 2732537.537 4624663.9 293847.3114 2521482.516 2898059.405 3079700.708 982587.6098 3237733.316 2099542.224 1917541.882
UNII:V9Q7UUZ15U 466472.0483 731558.5927 242191.5877 1075253.181 1716897.152 2356897.242 794420.6525 359574.4226 294231.8056 1927460.083 4195268.973 4217019.399 1129727.863 597637.8189 260458.3293 1563522.319 3795702.85 5389944.502 898307.8125 621025.6481 282133.9697 2991964.991 3564272.431 4694898.494 1383557.069 616997.0369 338158.0876 1006296.817 2583230.95 2924138.884 806851.4179 421386.2002 245883.5691 1162808.761 1444268.29 2552166.571 767631.1892 345640.7893 1370713.006 301914.788 539410.089 984013.3589 647337.7551 1211300.176 119338.4932 391975.2804 1368085.012 852433.204 1244908.642 537258.206 709115.341 834959.0132 788759.2562 1255416.433 608384.0058 601131.366 649770.1608 842738.6517 983025.8143 686812.4685 401769.2899 368922.0146 291031.4235 1144280.09 501628.0536 650144.0763 134904.5022 269476.9948 152904.947 74070.94656 176068.9504 142251.8641 241418.7681 313179.407 108069.5935 176794.8849 278595.7366 360614.3915 241195.1903 147350.2888 259674.5631 266610.1455 132590.2842 83822.16362 191534.5401 76160.79455 253377.5043 253076.4265 51526.23666 1147822.495 177859.7976 178184.2814 51052.96554 282619.6754 353390.6941 341239.3332
UNII:Z5JO63XGNK 557755.7359 535561.9587 947237.1068 590401.4289 476328.5862 460232.1928 960122.1164 459723.528 560913.4708 436602.8449 641232.4493 1141140.854 1968621.386 1498506.368 1413145.754 1634342.023 865660.7368 3456098.749 2180038.923 1519319.753 1444196.387 3137894.631 1659806.403 2706161.208 4190851.194 4636426.616 2092429.12 2328881.619 2333471.997 5421989.892 21082725.66 4012073.02 3621401.848 7133773.654 6656597.003 15433056.96 688669.4251 494016.8935 911821.3031 621218.0423 1031474.36 632723.838 669399.1437 545256.8712 285760.2541 1120257.305 1063280.696 1020606.012 1257536.988 821415.053 2143530.662 2382541.69 920537.6755 1020072.493 1138553.767 1256202.118 3330461.251 2810427.386 792079.2048 936646.0269 1482237.321 5178931.582 4686332.159 5688582.446 994235.6095 1658103.658 724467.4184 1121288.556 881479.3844 640945.3909 598615.3843 1679841.757 1025506.819 839709.1806 2071392.419 726520.0482 1145110.707 2051018.123 1959947.578 561336.7989 1872302.084 1900135.656 3432048.831 3075316.249 3612608.921 2020900.184 2585529.349 2986086.164 280947.9058 2289774.841 8706336.72 3886476.032 890195.1182 2374001.433 4199955.303 5116442.434
Uracil 4932055.055 8072977.625 12938942.8 4018808.516 2569370.797 5703192.096 5161504.027 11109244.53 7091653.842 7818257.793 5850052.293 9307105.321 17851034.69 13046027.5 13094339.66 11037905.28 15011434.34 16942196.17 8969951.042 18651276.86 9995791.394 16024882.82 7502739.867 12785840.25 10674463.49 14153632.48 16797162.56 10573097.3 10075656.94 13109520.33 13987151.57 13934908.15 13851003.89 14410696.18 9612567.374 18284341.67 5255354.676 1673073.627 2983013.124 4026054.626 2453535.497 8564700.908 5737799.907 12115720.14 10563971.35 10608313.74 9050369.68 10600791.2 4036996.914 6069891.868 4546104.344 6551060.562 12862552.21 5387622.18 6338018.22 5916435.395 7281569.147 5791698.101 7422389.625 6567387.407 6594691.823 9962999.331 14121358.79 9471962.279 8206920.833 6420196.471 2703353.771 9157971.54 8857934.066 8309615.409 2840777.191 6318658.864 4667611.605 3223019.163 3632090.828 3003748.161 9846404.334 9048558.834 6325559.606 2692581.275 7596132.874 11651568.9 12544956.91 11181568.6 10505886.78 12206360.21 11188641.98 10706128.05 7586756.179 8696351.19 13689634.33 11344726.16 8565367.128 9152387.848 15867893.05 17234675.83
Uric acid 78076798.4 185506149.7 99429403.87 88409101.07 48497451.37 88116465.37 170240406.2 254279476.4 201335832.4 248445529.5 344283739.9 241237169.9 341029436 363111173.4 296386424.6 343423194.8 593601080.7 274134101.5 396091271.4 467402136.4 472826133.1 526833396.9 574539062.6 296599497.8 410214024.3 583176562 420505035.1 373717670.7 530227098.2 290637314.1 608463904.6 575971223.4 670413169.4 434126865.1 357967278.2 281064067 124672657 23070639.79 53761004.64 54004105.37 25208753.89 345630555.1 180230721.4 111251495 18925275.81 66716043.84 426321281.6 143014345.4 138078645.9 207912509.2 139422473 304903980.7 136590708 133476195.6 205216415.8 183689413.2 321476086.9 205189930.9 232021877.8 217633912.4 161327247 223383459.8 209420502.1 343865588.1 170450209.6 231651936.9 28174055.95 34719607.26 37475541.4 19808198.07 24857876.93 30408592.38 55419409.11 30048996.71 58149719.22 87581716.41 56961637.54 93904987.23 64584281.8 41829150.87 143314233.8 150663447.7 247464559.9 143279646 216728519.4 366613057.6 176923248.9 225002361.2 927551.6582 203404854.5 614149938.2 302015291.3 109996575.5 178927335.2 473526100.1 1225284918
Uridine 62667463.98 149625676.3 10832291.11 111723738.6 23026184.04 62298825.64 8850538.82 32047224.65 9105111.854 14444430.59 15184126.73 9270282.161 20011152.12 28023866.25 9830183.849 18989060.1 24409903.83 16027760.8 30686414.44 39239329.6 16457014.14 44268466.87 58245822.71 37794716.07 104557618.5 48142468.62 55750252.4 110739097.2 171068860.3 111947419.5 107833158.5 72358417.99 86113430.9 133379895.6 163990029.3 175527948.3 72791152.25 25687463.48 57647711.93 48847188.64 36777530.49 20435763.08 10061611.85 14727601 14094718.15 24084450.77 24246200.54 9432893.137 15942767.12 24411474.36 21085219.61 23879599.27 13458637.41 19305760.59 26934284.67 27823690.99 27927473.68 61640596.37 91213745.24 27728753.2 32849816.59 59559369.39 97712480.06 140113563.8 57839205.13 34994066.28 27363174.1 26426261.52 37253592.26 14397914.45 26772829.94 90062337.24 72163549.87 172899550.4 161908371.4 65584503.72 140941382.7 209830574.3 123019975.3 47958921.12 79553125.63 114977288.2 141600009.1 183738489.2 123702095.9 56863716.26 121528758.1 171561797.2 13556539.17 143139063.2 83302308.73 150267392.7 85208238.7 174878566.5 196879797.9 157563658.2
Valeroidine 2722380.862 3693437.414 1370413.698 3634869.3 7265037.327 13951370.88 3957392.145 3699713.237 1368511.523 4446216.7 11872883.93 20207633.84 4842297.803 4165034.219 1434510.829 3035658.858 11209696.24 21164890.55 3831145.537 3815841.493 1605190.01 4898176.476 9043635.126 18488269.81 3565547.432 3290878.892 1330462.119 3184144.319 8546989.086 14480949.72 3357822.543 3692968.927 1408661.904 2730746.276 4592429.421 14878346.44 3062043.389 3345323.241 3684154.675 2039267.065 3607687.825 3504632.623 8350984.094 3375675.413 351952.3325 3120363.582 3813963.515 8057082.847 4221084.75 2796912.035 3694203.418 2953680.454 5439706.531 3127276.817 2716901.001 3156492.361 3107372.742 5539771.054 2998217.284 2190193.387 2842281.975 2227920.704 3128084.403 2942101.671 1799087.782 2957223.901 3372963.035 2385788.548 2442634.877 3621939.37 3184716.963 3346273.02 2487923.778 1988193.985 4661987.337 2537167.313 3302468.485 2824849.796 2401628.353 1635455.959 2337245.622 3117700.589 2516029.717 2188986.176 3974925.374 1402185.749 2828240.093 2013830.929 103246.34 2441078.52 2327705.713 2959695.341 278299.4368 1780246.723 3508099.457 3114597.21
Valerophenone 13334238.82 5584435.405 9001912.574 10663373.08 7025809.754 7465277.334 5186142.95 7344377.072 10535990.06 8891097.955 9203252.625 5624446.532 9248281.157 10507580.24 8916520.341 6563852.613 5711867.197 8543123.361 7762834.467 6970510.872 8232329.891 8112482.127 8576392.084 9032660.711 15225845.4 9635006.499 7884688.798 13451677.09 10283835.59 14043462.46 2924009.554 3633501.129 5752093.555 3871655.736 4107656.628 4807040.739 7788271.126 6043789.971 11839064.55 8890341.208 7448106.258 6733030.047 9534596.643 7171423.58 1693841.039 11684658.66 6592951.131 11778221.42 9124998.128 5781342.675 7641098.122 6010684.426 4814091.26 7980316.135 6706337.284 8190266.867 5407547.607 11012922.37 9843265.277 13312893.51 8445118.507 4839828.147 2138048.666 4391152.203 4440189.038 3540367.839 8696559.839 10428180.43 8341765.544 9712349.412 8387403.94 7121943.319 13109139.19 12015868.37 9892277.74 5582930.927 11784208.42 7208279.15 8826156.837 4525853.712 7011051.717 16463182.3 15837204.3 17513270.68 15645897.58 13815307.5 18857562.66 13793590.6 423864.8262 10200488.08 10607789.78 10027379.43 2558891.947 9928438.478 9935823.847 12512928.28
Valproic acid beta-D-glucuronide 3601850.863 2626166.025 3987203.17 6084634.569 761595.8504 1153871.228 4066982.163 2581202.7 3863832.629 7436582.489 1443602.262 1145672.754 5150648.836 2813873.789 4247215.621 5730379.791 1351687.414 1459251.704 4756730.275 2769584.048 3732122.822 9252024.511 1318473.837 1581758.86 3872141.892 2258312.727 3313953.614 5211246.966 1004513.79 1067235.489 3555717.869 2311427.814 3451851.67 4484213.13 862292.5097 1175431.973 3647588.202 968399.2585 1774296.132 3127194.36 1910557.756 4561953.042 2307238.172 1553513.682 525437.359 1643160.637 4857719.922 2203189.448 1869452.103 4003250.187 1988153.004 3792369.147 1765188.438 1682294.644 3512357.061 1676870.921 4054619.504 1733748.43 1706525.527 3037824.517 1747529.19 2784856.418 915824.9166 1390276.912 2906492.103 1638141.609 505395.8314 557897.6875 699124.7113 378369.233 1055439.046 566582.9113 529180.702 688118.2615 508454.7304 807597.8191 394061.3484 750920.4797 711718.1682 174583.4977 901533.4808 422411.9609 533241.6456 880472.1515 396741.8859 663928.8895 537077.2829 500336.6981 35965.90546 293079.4531 821866.7365 506167.2008 116187.6035 441797.2132 533484.1623 937312.5378
Vigabatrin 276463213.9 276331838.3 406821500.6 267767442.7 305565670.2 471872017.1 285184869.2 289823370.6 369030466 238884917.8 349907975.2 408351443.8 387790001.4 370046852.7 395533195 259402438.5 340732889.2 553121283.8 398801894.6 395287896.5 475478795.8 387886354.5 440926438.3 560822242 436935501.5 369908591 413368138.8 421336940.7 488907351.5 689920426 529926896.8 462208912.4 568312430.8 473339275.8 489793376.3 762310210.9 371344803.5 392034180.4 294253043.2 446295747.8 487224491.8 325114113.2 540085539.9 360263150.7 268149234.6 472775403.9 416063767.4 569059094 374379120.7 513005675.1 605849682.1 400532275.7 560352497.3 362626409.5 627748483.7 637211994.3 709658121.8 584058452.1 424725414.2 602581143.6 677269537.8 461996541.1 529613009.1 748132390.8 671574613.8 686985769.5 358455095.7 363034581.4 732516409.6 294072180.1 419578000.4 429750664.1 437814990.8 450939482.5 506679651.4 470617917.6 453101244.4 538060451.6 525885809.4 293047912.8 463557793.1 510975946.9 508717133.4 569316487.4 461332433.7 444851369.8 451602200.9 482153472.2 147002158 312413107.5 521681206.6 522098047.5 227927767 394499473.3 512734038.3 579095040.2
Vitamin C 1075980.489 4000483.515 979509.5043 4910102.625 2434757.773 1753594.179 585048.7768 2428011.759 1165970.336 3170359.778 2218291.189 1836060.736 2049905.571 2781458.428 1480365.342 4416109.872 2638182.334 2555423.493 1562449.73 2613702.091 1432785.818 7881233.147 2302825.729 3028065.71 1464413.874 2469801.438 1187963.884 2373866.243 2500724.573 5515835.524 821124.3064 4763823.939 2147395.424 1928732.6 978484.5284 26538274.01 9478653.6 1476088.873 1823593.049 6057748.017 1553539.336 4852558.419 1513549.275 1105450.788 506330.8877 942717.8424 11870924.24 2432504.398 1985849.004 8048403.571 1586471.776 5379380.881 1415243.445 711804.1093 6691772.507 427221.1085 8312222.293 1742855.292 826144.0275 4184002.581 1361352.283 4746845.925 6237555.706 1182797.918 5421479.249 3770298.318 1318093.266 1573126.798 1941281.562 3352003.117 4086549.443 1051865.333 935668.174 574235.2279 2611657.552 1734114.532 763390.0283 1260608.661 503749.9169 687671.8538 864399.0065 580413.0555 847477.7618 805839.2087 1689150.006 824040.3052 2507875.373 1796840.534 485856.0279 1254571.687 2713621.111 8890733.766 883101.1745 4862620.137 5580548.839 12193160.03
VS1150000 1744353.858 2608361.04 1262571.119 3362764.141 11908484.04 10177668.46 1406703.662 2461117.642 753200.1021 2524627.161 23311494.75 10597535.87 2533591.218 2335067.691 577272.464 2023119.456 16718069.28 12636399.28 1139293.387 2104294.388 988410.4527 2918537.488 16214232.61 10582605.7 1098598.684 1642261.199 338775.9419 1407824.732 13347973.25 8389869.521 1010156.251 1742551.573 820717.4016 1952589.649 6226732.733 6625491.119 2860274.971 2279111.94 5227817.78 1403647.609 3587806.097 3167782.037 4247085.728 4454920.53 378200.0065 2517196.802 3040851.457 4134500.316 4594381.747 1560169.082 2689338.646 2006414.708 2744269.939 3282620.346 1540508.216 2354031.996 2251619.466 2641756.868 3645378.235 1265144.999 1964110.766 1556491.64 1336536.562 3869544.93 1169383.396 1992990.155 1866016.964 1277909.283 1218678.684 757886.6346 826602.2477 1026715.939 611406.4881 633461.114 778067.9034 398295.27 1188250.375 703471.8007 992850.7328 1042491.84 769254.5904 526500.409 665994.6373 802322.231 416298.7013 328717.4703 976975.5856 366298.0978 78499.19592 347047.6707 357584.9151 436557.0927 198392.0507 386954.0971 979166.5831 412745.4583
Xanthine 38882433.88 299339779.9 141419389.8 101269271.6 49898423.29 57610663.88 2908298.096 550456102.4 226786461.4 116813891.3 469231765.4 38648188.29 132603444.7 574523748.9 74244570.75 116270976.3 373610559.9 42175398.42 96175490.09 226233225.1 26028689.39 172105696.2 263586038 141099001.9 407475658.5 274100720.2 428068450.5 649657499.1 703866186.3 720846449.6 1001071872 519390456.8 1320625105 1703398003 1472833667 2013383408 225579264.6 102223178.3 157327830.9 159052701.4 147703286.8 144346280.8 1457402 167361404.7 117789099.1 258427088.5 23783118.52 13780264.58 52076390.23 1520024.283 8126005.86 14717147.24 1788905.422 2232157.884 2620842.652 31401266.26 16370351.14 171986646.5 259761419 19343196.55 7722671.699 132577831.2 338629802.5 446710127.4 198571728.8 57107786.73 117901761.7 131755876.9 161021990.5 20852956.05 54723330.32 1264240628 1119623364 966346902.5 518841153.6 967181073.1 2174569927 2741575198 1977106677 1027962402 1985246264 3253284696 3423953089 3363897555 2944069057 2342880704 3309530223 3256419621 393646062 2629433587 2767189889 4289349335 1560309699 3826033040 3080311854 968496997
Xanthosine 1979280.969 24248968.56 9676574.663 5652524.393 3451853.241 4598616.037 2657266.912 71080415.77 31220738.32 14264359.81 47871375.28 8500194.801 23467482.66 76675130.46 19547835.75 24769086.71 94029773.67 11582883.99 6817295.047 28767499.89 4681638.107 10830100.99 80209350.82 14050652.12 8431840.641 20936788.26 7707932.685 17535915.93 88875940.94 30056689.87 17147121.86 31329055.49 18701555.14 25887777.72 78239437.3 75872279.7 16176981.51 4987853.416 10304746.94 7165238.567 5374705.633 14757994.89 3141352.632 22179945.79 5710864.711 18768494.01 7082832.652 2573424.907 5999034.848 3361479.718 4051234.161 1927196.23 2052063.231 1974674.486 2254742.895 4402922.716 2284764.493 4830841.219 6009356.527 2139016.067 2535189.984 3132033.986 9846645.579 14917551.25 5068105.974 3246856.482 7686734.347 6209525.092 9612808.945 2398468.22 3491392.918 213537448.7 169739375.6 217205383.5 452764649.2 324536572.1 196500333 269209170.1 299713822.3 382493127.2 424941124.9 217043395.8 247443518.9 405424270.9 526044049.6 329500833.5 233036746.6 261690034.7 23841816.97 525218026.9 380246564.4 304068946.9 86980064.39 311850114.8 508246445 289346249.2
zidometacin 5480948.959 2309426.305 4067229.048 2253330.476 2969394.908 3402508.459 2455621.335 3139495.142 2955489.409 2578645.219 2823907.404 2141471.642 1932569.218 1981008.455 2146652.142 1148433.363 2762084.581 3241590.613 2465104.068 2246070.958 3331438.389 2112577.501 1460616.766 2762916.166 3071508.198 1900094.192 2475071.836 3900900.352 2870149.264 3329232.241 2410680.519 957845.051 3395483.886 3136207.48 3653268.397 8709658.782 1997341.107 1199840.3 2032950.788 2193328.788 3625954.004 2021768.262 2892796.011 1351354.258 473920.3139 2232266.36 3097328.816 4076402.926 2967418.435 3028699.718 2168868.011 2782474.232 1869671.314 2634797.531 3325206.576 1801521.48 2559823.672 2827829.72 2370820.872 3375553.562 1489730.212 1661746.51 1294562.928 5932070.541 3356623.704 2782603.265 3391357.381 5752952.558 2395859.046 2542566.796 2933887.816 4909181.801 3088197.203 2348928.688 2580262.644 1293165.034 3932725.801 2692902.258 2406913.441 1492284.272 2503189.341 2393948.254 1842493.123 3566046.543 1770140.91 2526615.983 2403464.482 3297648.415 168288.9031 1131882.267 2449409.042 2690959.833 478332.8065 3044562.99 3715018.324 3258635.524
α-D-Mannose 1-phosphate 50500963.79 41779363.29 46466756.25 45641792.19 39047076.51 50523736.82 39255858.8 54137763.3 60221846.89 57037238.27 46455208.66 66140563.93 68786874.17 74069914.65 73847698.18 57726320.46 55575214.35 67345911.83 130761074.1 136374656.8 96964562.76 73242692.57 81179595.66 49230234.18 121271452.5 85548974.98 104073257 72562487.83 116227951.1 82204236.71 261950405.7 99131514.16 156483345.3 106903083.5 140896196.5 83535241.85 66615188.44 48230509.27 53621544.85 64808318.26 41590736.1 69929486.6 49687073.2 69278991.12 62590948.12 61562564.85 92142306.24 59425981.07 79775281.76 89304813.11 82933995.57 128755365.9 106459470.1 110472656.4 103840200.6 124846829.9 106216139 63824535.81 78024258.27 80632396.02 100086777.9 113324492.7 39512021.97 62740558.94 219533380 49191282.28 40259122 36238127.41 40754636.2 36303732.96 33045285.44 100231038.3 83516759.68 149159019.7 148439474.1 101172711.6 88290013.58 72626704.65 170622574.2 126887613.4 88906286.31 47022051.71 55021790.76 109065651.3 111209422.2 57974452.19 48458946.02 59931021.71 38055411.16 138675028.4 64946821.86 38128102.26 80268554.29 108343785.8 127368478.3 97094841.02
δ-Gluconic acid δ-lactone 48974371.08 26869911.62 32138955.64 20173763.59 21696994.54 24869154.98 12822341.98 26354818.99 24954833.81 21537269.28 48424401.21 7253138.788 23476378.71 12056761.84 25029012.38 16692332.5 33454222.52 30493405.1 28570420.58 8209393.493 33125072.45 43598191.64 38694904.47 40605733.25 23936147.32 37687019.96 46404564.89 34747426.85 42034150.58 39406537.45 14889632.12 30370287.83 57410620.45 43357280.93 37867561.5 82241918.72 32389191.31 9738678.412 17316494.76 9238695.064 41730801.57 6752330.359 10745446.14 11679287.7 5926226.637 36224053.92 27754708.31 12687540.31 44152199.17 29468952.75 32883764.58 24851447.91 40380041.2 29801293.34 16179361.35 15303626.36 17373650.46 44584515.85 19817218.96 23559559.41 30745922.91 28679543.66 40679081.57 37329991.02 38774544.47 55998594.26 27679524.63 36500013.62 37024576.97 24012475.51 23230741.65 34402638.16 20691569.9 29743339.83 13024680.39 29978362.01 30898508.32 34818417.21 38488104.84 18664811.8 28234698.5 35779640.05 15771796.41 43141647.31 51025370.82 32204844.32 17159166.28 67943222.63 1631257.106 28526605.19 52760589.35 90618129.14 11075384.64 34499827.02 58676536.85 54619329.98
δ-Ribono-1,4-lactone 9565421.057 7473140.029 16353970.13 13782593.86 11525378.3 25732991.58 9514388.236 16316694.04 33787458.08 24646842.52 17619344.43 24549365.03 25440686.89 31313771.52 50216695.9 17987206.63 19260870.37 37781730.93 36665348.68 36027056.4 62836151.05 66517318.25 37831559.07 51291877.05 68299474.38 44946166.61 72741571.24 61752599.81 78987877.82 80426027.57 54566733.15 50409578.68 80793835.79 77813505.62 84531951.73 92937447.03 24651240.66 7046745.991 7780932.243 13217633.9 10187618.06 11058732.3 11118293.52 31577580.11 3915140.44 17530501.36 41509751.37 41628831.91 45623121.49 31661888.81 36393673.75 45333881.92 49464719.08 63261249.81 49262299.31 55404668.88 58782221.35 101766672.8 89490787.06 49000883.93 64594248.06 71451713.61 61828132.47 79452341.28 73800791.72 59106652.92 10795566.27 9806351.599 13189838.01 14487165.68 14481019.48 17768743.81 12880244.85 8397579.045 20655457.62 14327636.5 22226830.48 14524888.21 10874625.42 5584805.711 16112570.77 33029360.85 36843822.28 32370124.83 43805727.28 14257202.31 17498978.56 33617828.37 2472814.009 12539226.76 24839386.24 40635507.95 4443283.291 10979104.87 38520076.14 21565970.38
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name Molecular Weight RT [min] mzCloud Best Match MS2
Phenotype 1 1 1
Time 2 2 2
(-)-Camphanic acid 198.0894 9.823 65.4 DDA for preferred ion
(-)-citrinin 250.08443 10.99 No MS2
(−)-nabilone 372.26673 11.699 No MS2
(-)-Prostaglandin E2 352.22569 11.509 No MS2
(-)-secoisolariciresinol 362.17325 11.425 No MS2
(−)-trans-Methyl dihydrojasmonate 226.15715 11.134 No MS2
({5-[(2S)-2-Carboxy-2-(trimethylammonio)ethyl]-1H-imidazol-2-yl}sulfanyl)oxidanide 245.08296 0.652 No MS2
(+)-10-Deoxymethynolide 296.19909 12.005 DDA for preferred ion
(+)-abscisic acid beta-D-glucopyranosyl ester 426.19001 11.268 DDA for preferred ion
(+)-calycanthidine 360.2306 12.522 No MS2
(+)-castanospermine 189.10035 5.819 DDA for preferred ion
(+/-)12(13)-DiHOME 314.24625 12.269 91.6 DDA for preferred ion
(+/-)12-HpETE 318.21972 13.286 89 DDA for preferred ion
(+/-)9,10-dihydroxy-12Z-octadecenoic acid 296.23539 12.733 81.5 DDA for preferred ion
(+/-)-Metanephrine 197.1055 1.769 No MS2
(±)9-HpODE 294.21985 13.171 81.6 DDA for preferred ion
(10S)-Juvenile hormone III diol 284.19917 12.245 DDA for preferred ion
(12Z)-9,10,11-trihydroxyoctadec-12-enoic acid 347.26746 11.041 87.2 DDA for preferred ion
(14R)-20-Amino-1-(3,4-dimethyl-5-propyl-2-furyl)-17-hydroxy-17-oxido-11-oxo-12,16,18-trioxa-17lambda~5~-phosphaicosan-14-yl 13-(3,4-dimethyl-5-pentyl-2-furyl)tridecanoate 879.60045 9.401 No MS2
(14R)-3beta,5,6beta,10,16-pentahydroxygrayanotoxan-14-yl acetate 412.24701 11.432 DDA for other ion
(15Z)-9,12,13-Trihydroxy-15-octadecenoic acid 330.24113 11.041 88 DDA for preferred ion
(1E)-5-Oxo-1,7-diphenyl-1-hepten-3-yl hydrogen sulfate 360.10351 7.304 No MS2
(1E,2Z)-3-hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oic acid 348.15762 10.396 DDA for other ion
(1R,2R,3S,6S,7R,9S,10S,11S,13R,14R)-11-(1-Hydroxy-2-propanyl)-3,7,10-trimethyl-15-oxapentacyclo[7.5.1.0~1,6~.0~7,13~.0~10,14~]pentadecane-2,6,9,11,13,14-hexol 400.21027 10.592 No MS2
(1R,5R)-3,3,5-Trimethylcyclohexyl 5-oxo-L-prolinate 253.16816 11.797 No MS2
(1S)-1,5-Anhydro-1-benzyl-D-galactitol 254.11601 10.463 DDA for preferred ion
(1S,2R,5S)-2-Isopropyl-5-methylcyclohexyl 3-oxobutanoate 240.17278 10.646 No MS2
(1S,3R,4R,5R)-1,3-Dihydroxy-7-oxo-6-oxabicyclo[3.2.1]oct-4-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)acrylate 350.10073 10.099 DDA for preferred ion
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (11Z)-11-icosenoate 507.33284 12.76 No MS2
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoate 499.27059 12.261 DDA for preferred ion
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (7Z,10Z,13Z,16Z)-7,10,13,16-docosatetraenoate 529.31778 12.645 DDA for other ion
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (8Z,11Z,14Z)-8,11,14-icosatrienoate 503.30197 12.865 DDA for preferred ion
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-hydroxypropyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate 475.27025 12.244 DDA for preferred ion
(2R)-3-Hydroxy-2-[(9Z,12E)-9,12-octadecadienoyloxy]propyl 2-(trimethylammonio)ethyl phosphate 519.33308 12.525 DDA for preferred ion
(2R,3R,4R)-2-Amino-3,4-dihydroxyoctadecyl dihydrogen phosphate 397.25981 11.296 No MS2
(2S)-3-Hydroxy-1,2-propanediyl dibutanoate 232.13123 9.952 DDA for preferred ion
(2S)-4-Methyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)pentanoic acid (non-preferred name) 293.14772 7.296 DDA for preferred ion
(2S,4S)-4-Amino-2-hydroxy-2-methylpentanedioic acid 177.06386 0.922 No MS2
(2xi)-D-gluco-heptonic acid 226.06926 0.84 DDA for preferred ion
(2Z)-3,7-Dimethyl-2,6-octadien-1-yl 3-oxobutanoate 238.15718 11.395 DDA for preferred ion
(3alpha,7alpha,12alpha)-3,7,12,26-Tetrahydroxycholestan-27-yl hydrogen sulfate 532.30959 11.376 No MS2
(3beta,5alpha,22beta)-Solanidan-3-yl beta-D-glucopyranosyl-(1->2)-[beta-D-xylopyranosyl-(1->3)]-beta-D-glucopyranosyl-(1->4)-beta-D-galactopyranoside 1017.5521 11.875 No MS2
(3E)-4-(2,3-Dihydroxy-2,5,5,8a-tetramethyldecahydro-1-naphthalenyl)-3-buten-2-one 294.21999 12.053 DDA for preferred ion
(3S,5R,10R,12S,14S,15R,16R)-3,5,10,14,15-Pentahydroxy-12,16-dimethyl-2-icosanone 404.31442 15.343 DDA for preferred ion
(4R,5S,9S,10R,12S,13S)-1,5,9-Trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.0~4,13~.0~8,13~]hexadecan-10-ol 284.16286 11.125 DDA for preferred ion
(4S)-4-[(2E)-2-Octenoyloxy]-4-(trimethylammonio)butanoate 285.19417 11.389 No MS2
(4S)-4-[(9Z,12Z,15Z)-9,12,15-Octadecatrienoyloxy]-4-(trimethylammonio)butanoate 421.31968 11.884 No MS2
(4S)-4-{[(9Z)-3-Hydroxy-9-octadecenoyl]oxy}-4-(trimethylammonio)butanoate 441.34604 11.938 DDA for preferred ion
(5R)-5-[(1R)-1,2-Dihydroxyethyl]-4-hydroxy-2-oxo-2,5-dihydro-3-furanyl hydrogen sulfate 255.98939 0.931 No MS2
(5R)-5-[(1S)-1,2-Dihydroxyethyl]-alpha-D-lyxopyranose 210.07422 0.871 DDA for preferred ion
(5xi,8alpha,9xi,10alpha,13alpha)-13-(beta-D-Glucopyranosyloxy)kaur-16-en-18-oic acid 480.27378 9.888 No MS2
(5ξ,9ξ)-17-Hydroxykaur-15-en-19-oic acid 364.22578 11.132 70.2 DDA for preferred ion
(6R,8Z)-6-Hydroxy-3-oxo-8-tetradecenoic acid 256.16789 11.67 DDA for preferred ion
(9Z)-9-Octadecenamide 281.27211 11.759 No MS2
(betaR)-beta-Hydroxy-L-tyrosine 197.06902 6.316 DDA for preferred ion
(DL)-3-O-Methyldopa 211.08467 9.707 DDA for preferred ion
(E)-p-coumaric acid 164.04762 0.953 No MS2
(Hydroxyethyl)methacrylate 130.06314 7.318 DDA for preferred ion
(R)-3-hydroxy-2-oxo-4-phosphonooxybutanoic acid 213.9882 1.286 No MS2
(R)-3-hydroxybutyrylcarnitine 247.14219 1.82 No MS2
.alpha.-Aminoadipic acid 161.06897 1.654 No MS2
[3-(Hydroxymethyl)-3-methyl-2-oxobicyclo[2.2.1]hept-1-yl]methyl hexopyranoside 346.16329 11.193 DDA for preferred ion
{(1R,2R)-2-[(2Z)-5-(beta-D-Glucopyranosyloxy)-2-penten-1-yl]-3-oxocyclopentyl}acetic acid 388.17423 10.479 No MS2
{4,6-Dihydroxy-3-[(2E)-4-hydroxy-3-methyl-2-buten-1-yl]-2-methoxyphenyl}acetic acid 282.11076 10.09 DDA for preferred ion
{4-Ethyl-6-[(3E)-2-ethyl-3-hexen-1-yl]-6-methyl-1,2-dioxan-3-yl}acetic acid 298.21466 12.015 No MS2
1-(2-Deoxypentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione 242.09076 4.574 DDA for other ion
1-(2-Furylmethyl)-5-oxopyrrolidine-3-carboxylic acid 209.06893 10.981 71 DDA for preferred ion
1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine 567.33309 12.601 DDA for preferred ion
1-(9H-beta-Carbolin-1-yl)-1,4-butanediol 256.12166 10.239 DDA for preferred ion
1,2,3-Trieicosapentaenoyl glycerol 944.68469 16.851 No MS2
1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid 190.04796 1.943 No MS2
1,9b-Dihydroxy-6,6,9a-trimethyl-5,5a,6,7,8,9,9a,9b-octahydronaphtho[1,2-c]furan-3(1H)-one 266.1522 11.761 72.2 DDA for preferred ion
1-[(11Z,14Z)]-icosadienoyl-sn-glycero-3-phosphocholine 547.36427 13.317 DDA for preferred ion
1-[(1Z,9Z)-octadecadienyl]-sn-glycero-3-phosphocholine 505.35432 13.33 No MS2
1-[(8Z,11Z,14Z)-icosatrienoyl]-sn-glycero-3-phosphocholine 545.3486 12.891 DDA for preferred ion
1-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine 493.31744 12.418 DDA for preferred ion
1-[4-(2-{3-[(6-Ethyl-2,4-diimino-1,2,3,4-tetrahydro-5-pyrimidinyl)oxy]propoxy}phenyl)cyclohexyl]ethanone 412.24685 11.737 DDA for preferred ion
10,16-Dihydroxyhexadecanoic acid 288.23065 11.953 No MS2
10-GINGEROL 350.24601 14.372 No MS2
10-HDA 186.12575 11.473 79.9 DDA for preferred ion
10-oxo-8-decenoic acid 184.1102 11.074 DDA for preferred ion
11,12-Epoxy-(5Z,8Z,11Z)-icosatrienoic acid 320.23553 13.184 88.8 DDA for preferred ion
11-Aminoundecanoic acid 201.1732 1.622 No MS2
11-Epiprostaglandin E1 371.26755 11.474 79.8 DDA for preferred ion
12,13-Epoxytrichothec-9-ene-3,7,8,15-tetrol 298.14191 9.896 DDA for other ion
12-epi Leukotriene B4 336.23069 12.204 85.3 DDA for preferred ion
12-HSA 300.26687 14.701 DDA for preferred ion
12-Hydroxydodecanoic acid 216.1726 12.35 66 DDA for preferred ion
13(S)-HOTrE 294.22003 12.704 74.7 DDA for preferred ion
13(S)-HpOTrE 292.20442 12.47 76.2 DDA for preferred ion
13,14-Dihydro-15-keto prostaglandin F2α 336.23027 11.544 86.8 DDA for preferred ion
13,14-Dihydro-19(R)-hydroxy prostaglandin E1 372.25173 10.942 69.3 DDA for preferred ion
13S-hydroxyoctadecadienoic acid 296.23526 12.284 No MS2
14(S)-HDHA 326.22468 13.099 93.4 DDA for preferred ion
14(Z)-Eicosenoic acid 310.28779 16.353 79.7 DDA for preferred ion
15,16-DiHODE 312.2304 11.296 No MS2
15-oxoETE 318.21985 12.716 DDA for preferred ion
16-Heptadecyne-1,2,4-triol 284.23564 13.27 No MS2
16-Hydroxyhexadecanoic acid 272.23563 13.878 75.1 DDA for preferred ion
17(S)-HpDHA 360.2306 12.689 71.9 DDA for preferred ion
19(R)-hydroxy Prostaglandin E2 350.20986 11.706 82 DDA for preferred ion
1a,1b-dihomo Prostaglandin F2? 382.27252 11.868 64.2 DDA for preferred ion
1-arachidonoyl-sn-glycero-3-phosphoethanolamine 501.2862 12.608 DDA for preferred ion
1-heptadecanoyl-sn-glycero-3-phosphocholine 509.34896 13.227 DDA for preferred ion
1-Linoleoyl-2-Hydroxy-sn-glycero-3-PC 519.33306 12.642 DDA for preferred ion
1-linoleoyl-sn-glycero-3-phosphoethanolamine 477.2861 12.603 DDA for preferred ion
1-Methylhistamine 125.09549 0.714 No MS2
1-O-[(2-{4-[(1E)-1-(4-Hydroxyphenyl)-2-phenyl-1-buten-1-yl]phenoxy}ethyl)amino]-alpha-L-glucopyranuronic acid 551.21754 12.876 No MS2
1-Oleoyl-2-hydroxy-sn-glycero-3-PE 479.30176 13.078 DDA for preferred ion
1-Pentofuranosyl-2,4(1H,3H)-pyrimidinedione 244.06977 1.394 No MS2
1-Phenyl-1,3-octadecanedione 358.28778 15.24 No MS2
1-Stearoyl-2-hydroxy-sn-glycero-3-PE 481.31784 12.922 DDA for preferred ion
2-((4-Nitrophenoxy)methyl)oxirane 195.05329 5.338 No MS2
2-(1,2-Dihydroxy-2-propanyl)-9-hydroxy-6,10-dimethylspiro[4.5]dec-6-en-8-one 268.16791 11.726 DDA for preferred ion
2-(12-Tridecyn-1-yl)furan 246.19856 12.976 No MS2
2-(2-Acetoxy-2-oxoethyl)-2-hydroxysuccinic acid 234.03736 1.442 No MS2
2-(6-Hydroxyhexyl)-3-methylenesuccinic acid 230.11551 10.351 78.8 DDA for preferred ion
2-(acetylamino)-3-(1H-indol-3-yl)propanoic acid 246.10071 9.737 89.1 DDA for preferred ion
2-(Decanoyloxy)-1,3-propanediyl didodecanoate 610.51849 14.581 No MS2
2-(Diethoxymethyl)furan 170.09442 9.545 No MS2
2-(Ornithylamino)ethanesulfonic acid 239.09297 0.931 No MS2
2,2'-{(19-Amino-18-hydroxy-5,9-dimethyl-6,7-icosanediyl)bis[oxy(2-oxo-2,1-ethanediyl)]}disuccinic acid 689.39982 12.042 DDA for preferred ion
2,4,6-Octatriyn-1-ol 118.04199 1.91 DDA for other ion
2,4-dihydroxyheptadec-16-ynyl acetate 326.24622 14.531 No MS2
2,5-Furandicarboxylic acid 156.00602 1.518 No MS2
2-[(1S)-1-Hydroxyethyl]-4(1H)-quinazolinone 190.07446 4.957 84.3 DDA for preferred ion
2-[(3R,4S)-3-{[5-(Cyclohexylmethyl)-1,2-oxazol-3-yl]methyl}-4-piperidinyl]-1-(4-morpholinyl)ethanone 411.24728 10.374 60.1 DDA for preferred ion
2-[(3R,4S)-3-{[5-(Cyclohexylmethyl)-1,2-oxazol-3-yl]methyl}-4-piperidinyl]-N-isopropylacetamide 397.25036 11.744 65.2 DDA for preferred ion
2-[(carboxymethyl)(methyl)amino]-5-methoxybenzoic acid 239.07969 10.105 65.8 DDA for preferred ion
2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol 256.13118 9.786 No MS2
2-{[5-(tert-Butyl)-4H-1,2,4-triazol-3-yl]thio}-1-(4-nitrophenyl)ethan-1-one 320.09266 10.849 65.1 DDA for preferred ion
2-Acetamidooctanoic acid 201.13676 10.717 DDA for preferred ion
2-Amino-1,3,4-octadecanetriol 317.29323 11.171 74.5 DDA for preferred ion
2-Amino-3-hydroxyoctadecyl dihydrogen phosphate 381.2648 12.273 DDA for preferred ion
2-Amino-9,10-epoxy-8-oxodecanoic acid 215.11604 8.833 DDA for preferred ion
2-Aminoethyl (2R)-3-[(1Z)-1-hexadecen-1-yloxy]-2-hydroxypropyl hydrogen phosphate 437.29108 13.102 DDA for preferred ion
2-Aminooctanedioic acid 189.10035 7.174 62.7 DDA for preferred ion
2-arachidonoylglycerol 378.27785 11.766 No MS2
2-Butoxyacetic acid 132.07875 7.225 71.9 DDA for preferred ion
2-Deoxyhexopyranose 164.06874 3.214 DDA for preferred ion
2-Dodecylbenzenesulfonic acid 326.19116 10.103 No MS2
2-Furoic acid 112.01611 1.522 No MS2
2-Hydroxy-2-methylbutyric acid 118.06307 5.29 80.4 DDA for preferred ion
2-Hydroxy-4-oxo-1,2,4-butanetricarboxylic acid 220.02102 1.742 No MS2
2-Hydroxycaproic acid 132.07875 7.885 92.4 DDA for preferred ion
2-Hydroxycinnamic acid 164.04749 9.066 69.4 DDA for preferred ion
2-hydroxysebacic acid 218.11556 9.653 DDA for preferred ion
2-Isocapryloyl-3R-hydroxymethyl-gamma-butyrolactone 242.15218 11.386 No MS2
2-linoleoyl-sn-glycero-3-phosphoethanolamine 477.28607 12.492 DDA for preferred ion
2-methoxyacetaminophen sulfate 261.03104 2.365 DDA for preferred ion
2-methoxyestrone 3-glucosiduronic acid 476.20505 12.177 DDA for preferred ion
2-Methoxy-N-({(2R,4S,5R)-5-[6-(2-methoxyphenyl)-2-methyl-4-pyrimidinyl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)acetamide 196.10886 11.03 67.7 DDA for other ion
2-Methyl-3-undecyl-1,4-naphthoquinone 326.22503 13.897 DDA for preferred ion
2-methylbutyrylcarnitine 245.16297 7.076 DDA for preferred ion
2-methylcitric acid 206.04271 1.875 No MS2
2-naphthyl beta-D-glucoside 306.11085 10.117 No MS2
2-oleoyl-sn-glycero-3-phosphocholine 521.34855 12.99 DDA for preferred ion
2-Oxobutyric acid 102.03171 1.409 No MS2
2-Oxoglutaric acid 146.02161 1.398 98.9 DDA for preferred ion
2-palmitoyl-sn-glycero-3-phosphocholine 495.33286 12.777 DDA for preferred ion
2-Phenylethyl beta-D-glucopyranosiduronic acid 298.10567 9.991 DDA for preferred ion
2-phosphinomethylmalic acid 212.0088 0.956 No MS2
3-(1H-Imidazol-4-yl)-2-(2-thienylsulfonyl)acrylonitrile 264.99681 11.585 71.9 DDA for preferred ion
3-(2,6-Dioxocyclohexyl)propanenitrile 165.07919 10.976 68.8 DDA for preferred ion
3-(3,4-Dihydroxyphenyl)-N-(3-oxopropyl)propanamide 237.10039 9.669 DDA for preferred ion
3-(3,4-Dimethyl-5-pentyl-2-furyl)propanoic acid 238.15716 12.05 DDA for preferred ion
3-(4-Methoxyphenyl)-5-[(4-nitrophenoxy)methyl]-4,5-dihydroisoxazole 350.08593 10.039 68.6 DDA for preferred ion
3-(METHYLNITROSAMINO)PROPIONITRILE 113.05916 0.928 DDA for other ion
3, 5-Tetradecadiencarnitine 367.27272 11.377 No MS2
3,3',3'',3'''-[3,8,13,17-Tetrakis(carboxymethyl)-8,13,15-trimethyl-7,8,12,13,20,24-hexahydroporphyrin-2,7,12,18-tetrayl]tetrapropanoic acid 878.31981 9.381 No MS2
3,4,5-trimethoxyhydrocinnamic acid 240.10003 9.112 No MS2
3,4-dehydrothiomorpholine-3-carboxylic acid 145.02021 0.937 No MS2
3,4-Methylenesebacic acid 226.12076 9.866 DDA for preferred ion
3,6,9,12-tetraoxatridecan-1-ol 208.13127 6.263 DDA for preferred ion
3,7-Dihydroxy-2-(3-hydroxyphenyl)-5-chromanesulfinic acid 322.05157 10.967 DDA for preferred ion
3,8,9-trihydroxy-10-propyl-3,4,5,8,9,10-hexahydro-2H-oxecin-2-one 244.13126 10.101 72.7 DDA for preferred ion
3-[(3-Hydroxydecanoyl)oxy]-4-(trimethylammonio)butanoate 331.23608 10.362 No MS2
3-[hydroxy(oxido)phosphoranyl]pyruvic acid 151.98793 0.207 No MS2
3225312 388.22307 13.211 No MS2
3477 240.14755 0.935 No MS2
3-Acetyl-2,7-naphthyridine 172.06386 6.924 DDA for preferred ion
3beta,17beta-Diacetoxy-5alpha-androstane 376.26179 14.677 No MS2
3-Hydroxy-5, 8-tetradecadiencarnitine 383.26761 10.966 No MS2
3-Hydroxybutyric acid 104.0474 2.032 95.9 DDA for preferred ion
3-Hydroxydecanoic acid 188.14144 11.521 84.9 DDA for preferred ion
3-Hydroxyheptanoic acid 146.09438 10.172 DDA for preferred ion
3-Hydroxysebacic acid 218.11557 9.22 DDA for preferred ion
3-Hydroxytetradecanedioic acid 274.17862 10.532 DDA for preferred ion
3-Methoxy-4-hydroxyhippuric acid 225.06396 8.818 DDA for preferred ion
3-Methylglutaric acid 146.05802 2.475 84.3 DDA for preferred ion
3-Methylsulfolene 132.02469 1.396 DDA for preferred ion
3-oxo-C12-HSL 297.19441 11.879 No MS2
3-oxolauric acid 214.15708 11.701 No MS2
3-oxopalmitic acid 270.21998 13.419 DDA for preferred ion
3-Oxotetradecanoic acid 242.18848 12.806 DDA for preferred ion
3-Phenyllactic acid 166.06304 9.219 87.3 DDA for preferred ion
3-Phosphoglyceric acid 204.00364 1.267 88.7 DDA for other ion
3-tert-Butyladipic acid 202.12076 10.525 80.8 DDA for preferred ion
4-(1,2-Dihydroxy-2-propanyl)-1-methyl-1,2-cyclohexanediol 204.13643 10.269 No MS2
4-(5,6-Dihydroxy-6-methyl-1-hepten-2-yl)-1-methyl-1,2-cyclohexanediol 272.19925 12.233 No MS2
4-(9H-beta-Carbolin-1-yl)-1,2,4-butanetriol 272.11668 10.649 DDA for preferred ion
4-(Hydroxymethyl)benzenesulfonic acid 188.01455 9.864 DDA for preferred ion
4,15-Diacetoxy-3-hydroxy-12,13-epoxytrichothec-9-en-8-yl 3-hydroxy-3-methylbutanoate 482.21607 10.86 No MS2
4-[(2-Cyclohex-1-enylethyl)amino]-4-oxobut-2-enoic acid 223.12106 11.053 63.5 DDA for preferred ion
4-[(2-Isopropyl-5-methylcyclohexyl)oxy]-4-oxobutanoic acid 256.16789 10.753 DDA for preferred ion
4-[(3S)-7-Hydroxy-3,4-dihydro-2H-chromen-3-yl]phenyl beta-D-glucopyranosiduronic acid 418.12727 9.972 DDA for preferred ion
4-[(Z)-2-Aminovinyl]phenol 135.06866 1.9 DDA for preferred ion
4-Acetamidobenzoic acid 179.05843 10.457 76.3 DDA for preferred ion
4-Aminobenzoic acid 137.04786 0.902 No MS2
4-Ethyl-2-hydroxy-6-methoxyphenyl hydrogen sulfate 248.03429 0.921 No MS2
4-ethylphenylsulfonic acid 202.03021 14.559 No MS2
4-Hydroxyprolyltyrosine 294.12219 6.834 DDA for preferred ion
4-Indolecarbaldehyde 145.05289 9.971 82.2 DDA for preferred ion
4-Methoxyaniline 123.06858 7.986 No MS2
4-Methylene-2-oxoglutarate 158.02074 1.531 No MS2
4-Nitroaniline 138.04308 0.927 No MS2
4-Oxo-4-(3-pyridinebutanal) 163.06349 10.755 DDA for preferred ion
4-oxo-4-[(pyridin-4-ylmethyl)amino]but-2-enoic acid 206.06932 8.953 79 DDA for preferred ion
4-Oxoproline 129.04277 1.62 95.7 DDA for preferred ion
4-Phenolsulfonic acid 173.99872 7.279 78.1 DDA for preferred ion
4-Pyridoxic acid 183.05328 6.745 73.4 DDA for preferred ion
4-tert-Octylphenol monoethoxylate 250.19359 13.617 No MS2
5-({[(2R,4S,5R)-5-(6-Cyclopentyl-2-methyl-4-pyrimidinyl)-1-azabicyclo[2.2.2]oct-2-yl]methyl}amino)-5-oxopentanoic acid 396.25164 13.813 66.4 DDA for preferred ion
5-(2,3-Dihydroxy-3-methylbutyl)-4-[(3,3-dimethyl-2-oxiranyl)acetyl]-3,4-dihydroxy-2-(3-methylbutanoyl)-2-cyclopenten-1-one 412.21055 11.69 No MS2
5-(6-Hydroxy-2,5,7,8-tetramethyl-chroman-2-yl)-2-methyl-pentanoic acid 320.19912 11.978 DDA for preferred ion
5-(N,N-Dimethylcarbamimidamido)-2-oxopentanoic acid 201.1116 1.689 No MS2
5,5-Dimethyl-4-(3-oxobutyl)dihydro-2(3H)-furanone 184.11007 10.156 No MS2
5,7,11-Trihydroxy-7-(methoxymethyl)-2-methyl-10H-spiro[9-oxatricyclo[6.3.1.0~1,5~]dodecane-6,3'-oxetane]-2',10-dione 342.13195 10.101 DDA for preferred ion
5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-1,2,3,4,4a,7,8,8a-octahydro-1-naphthalenyl]-3-methylpentanoic acid 322.25118 13.338 75.3 DDA for preferred ion
5-BETA-D-RIBOFURANOSYLPICOLINAMIDE ADENINE-DINUCLEOTIDE 663.1099 0.941 DDA for preferred ion
5-Chloro-4-oxo-L-norvaline 165.01946 0.974 DDA for other ion
5'-dehydroadenosine 265.08151 1.527 DDA for preferred ion
5-Hexyl-2-oxotetrahydro-3-furancarboxylic acid 214.12091 11.586 No MS2
5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl hydrogen sulfate 350.01021 11.136 No MS2
5-Hydroxy-DL-tryptophan 220.08502 2.601 No MS2
5-hydroxyisouric acid 184.02334 0.97 No MS2
5-Hydroxytryptophan 220.08502 4.417 79.3 DDA for preferred ion
5-Nitro-o-toluidine 152.05877 2.64 No MS2
5-O-methyl embelin 308.19929 12.294 No MS2
5-Pentylresorcinol 180.11522 10.813 DDA for preferred ion
5'-xanthylic acid 364.04264 1.624 DDA for preferred ion
6 beta hydroxy testosterone 304.20431 12.47 No MS2
6-Butyryl-2,2,4,4-tetramethyl-1,3,5-cyclohexanetrione 252.13654 11.399 DDA for preferred ion
6-Hydroxy-4,9a-dimethoxy-3,4a,5-trimethyl-4a,5,6,7,8,8a,9,9a-octahydronaphtho[2,3-b]furan-2(4H)-one 310.17858 12.131 DDA for preferred ion
6-Ketoprostaglandin F1α 392.21785 11.002 76.2 DDA for preferred ion
6-Methoxy-17-methyl-6,7,8,14-tetradehydro-4,5-epoxymorphinan-3-ol 297.13732 12.772 No MS2
6-O-Phosphono-D-gluconic acid 276.02522 1.178 DDA for preferred ion
8,8a-Dimethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydro-2-naphthalenecarbaldehyde 206.13077 11.229 DDA for preferred ion
8,9-DiHETrE 338.24646 11.76 No MS2
8-Hydroxyoctanoic acid 160.11007 10.852 No MS2
8-iso Prostaglandin F1? 356.25682 11.858 73.3 DDA for preferred ion
8-iso-13,14-dihydro-15-keto Prostaglandin F2? 336.23057 12.524 82.6 DDA for preferred ion
9(S)-HpOTrE 310.21485 11.914 DDA for preferred ion
9(Z),11(E)-Conjugated linoleic acid 280.24061 14.531 87.2 DDA for preferred ion
9,10-DiHODE 312.23044 11.575 DDA for preferred ion
9,10-Dihydroxystearic acid 316.26161 12.659 No MS2
9-Decenoylcarnitine 313.22562 11.929 No MS2
9-Oxononanoic acid 172.11017 11.092 DDA for preferred ion
9-Pentofuranosyl-3,9-dihydro-1H-purine-2,6-dione 284.07606 0.957 DDA for preferred ion
9-riburonosyladenine 281.07649 1.638 DDA for preferred ion
9S,13R-12-Oxophytodienoic acid 260.17807 11.917 78 DDA for other ion
A-12(13)-EpODE 294.21967 12.299 No MS2
AC 45594 208.14658 11.388 No MS2
Aceglutamide 188.07988 1.619 No MS2
Acetanilide 135.06851 0.954 No MS2
Aceturic acid 117.04266 0.925 No MS2
Acetyl-L-carnitine 203.11603 0.937 94 DDA for preferred ion
Acetyl-L-methionine 191.06186 6.227 DDA for preferred ion
acetyltaurine 167.02527 1.288 No MS2
ACPC 101.04768 1.397 No MS2
Adenosine 5'-monophosphate 306.03687 0.934 94.5 DDA for other ion
Adenosine diphosphate ribose 559.07268 1.392 83.6 DDA for preferred ion
Aderbasib 416.20553 10.463 DDA for preferred ion
Adrenic acid 332.27209 14.995 84.4 DDA for preferred ion
afegostat 147.08979 1.393 No MS2
Allantoic acid 176.05402 0.752 No MS2
Allantoin 158.04408 0.9 DDA for preferred ion
all-cis-4,7,10,13,16-Docosapentaenoic acid 330.25641 14.486 83 DDA for preferred ion
alpha-ketoadipic acid 160.03727 1.669 No MS2
alpha-Ketoglutaric acid 146.0217 0.941 DDA for preferred ion
anacardic acid 348.26693 13.577 DDA for preferred ion
Ancymidol 256.12165 10.373 DDA for preferred ion
Aniracetam 219.08963 9.619 No MS2
Ansatrienin A 636.34179 11.399 No MS2
Apigetrin 432.10627 9.13 No MS2
apronalide 184.12144 5.488 No MS2
Arabinosylhypoxanthine 268.08113 2.951 DDA for preferred ion
Arachidonic acid 304.24069 14.385 89.9 DDA for preferred ion
Arg-pro 271.16337 5.496 DDA for other ion
Artemisinin 282.14722 10.71 DDA for preferred ion
Ascorbic acid 176.03215 1.576 72.7 DDA for preferred ion
asn-val 231.12216 2.394 DDA for preferred ion
Astilbin 450.11724 10.165 DDA for preferred ion
Azelaic acid 188.10506 10.073 93.8 DDA for preferred ion
Azodolen 309.14723 13.135 No MS2
Bafetinib 576.25528 12.524 No MS2
Bardoxolone methyl 505.31786 13.261 No MS2
Benzoic acid 122.03689 1.91 DDA for preferred ion
Benzoyl cyanide 131.03727 6.347 No MS2
beta-L-fucose 1-phosphate 244.03497 1.027 No MS2
Bis(2-ethylhexyl) phthalate 390.27755 11.7 No MS2
Boschnaloside 344.14763 9.896 DDA for preferred ion
Bucillamine 223.03391 7.829 DDA for preferred ion
Butopyronoxyl 226.1208 10.842 DDA for preferred ion
butyl acrylate 128.08391 8.655 No MS2
Butylparaben 194.09446 12.537 No MS2
Butyryl-L-homoserine lactone 171.08969 6.978 DDA for preferred ion
C16 Phytoceramide (t18:0/16:0) 555.52331 13.674 No MS2
Cadmium 113.9031 0.886 DDA for preferred ion
CALYCANTHINE 346.21472 11.206 No MS2
cannabidiolic acid 358.21494 12.12 No MS2
Canrenone 340.20412 12.117 DDA for preferred ion
Carapanaubine 428.19585 10.161 No MS2
Carbocysteine 179.02541 1.398 No MS2
caroxazone 206.06931 5.742 DDA for preferred ion
Cedefingol 343.30895 11.25 No MS2
Cervonoyl ethanolamide 372.26696 13.474 DDA for preferred ion
Chlorpromazine 318.09613 10.843 94.9 DDA for preferred ion
Cholic acid 408.28848 11.698 93.4 DDA for preferred ion
Choline 103.09981 0.843 90.3 DDA for preferred ion
Cinnamoylglycine 205.07401 9.975 87.2 DDA for preferred ion
cis-2-Carboxycyclohexyl-acetic acid 186.08938 9.827 No MS2
cis-4-Decenedioic acid 200.10509 10.319 DDA for preferred ion
cis-5-Tetradecenoylcarnitine 369.28834 11.617 DDA for preferred ion
Citraconic acid 130.0268 0.941 95.7 DDA for preferred ion
Citric acid 192.02724 1.52 94.6 DDA for preferred ion
Clozapine 163.06506 10.034 96.1 DDA for other ion
Corchorifatty acid F 328.22546 11.209 84.8 DDA for preferred ion
Corticosterone 392.22072 11.205 85.2 DDA for preferred ion
Coumarone 118.04193 0.948 No MS2
Creatine 131.06964 1.063 88.6 DDA for preferred ion
Cyclic ADP-ribose 541.06229 1.392 66.5 DDA for preferred ion
CYCLO(-SER-TYR) 250.09564 8.786 DDA for preferred ion
cycloxazoline 546.31642 11.04 No MS2
Cytidine 243.08574 1.394 No MS2
Cytosine 111.04364 0.933 No MS2
D-(−)-Erythrose 120.04234 1.402 No MS2
D-(+)-Malic acid 134.02166 1.28 93.7 DDA for preferred ion
D-(+)-Proline 115.06346 0.913 90.1 DDA for preferred ion
D-4-PHOSPHOERYTHRONIC ACID 216.0039 1.318 No MS2
dacisteine 205.04113 1.772 DDA for preferred ion
Daidzein 254.05826 10.437 90 DDA for preferred ion
Daidzein-7-O-glucuronide 430.09073 9.48 No MS2
Dambonitol 208.0949 4.951 DDA for preferred ion
Deferiprone 139.06345 6.745 DDA for preferred ion
DEHYDROASCORBIC ACID 174.01641 0.93 No MS2
DEMETHYLCHLORPROMAZINE 304.08047 10.793 No MS2
Deprodone propionate (JAN) 400.22313 11.822 No MS2
D-Erythrose 4-phosphate 200.00877 1.272 DDA for preferred ion
D-Erythro-sphingosine 1-phosphate 379.2492 12.123 89.2 DDA for preferred ion
Desmeninol 150.03511 5.418 No MS2
Desthiobiotin 214.13198 4.124 No MS2
D-Gluconic acid 196.05853 0.862 DDA for preferred ion
D-Glucono-delta-lactone 178.04786 0.976 No MS2
D-Glucopyranuronic acid 194.04286 1.295 No MS2
DHK-OH 320.09004 10.373 DDA for preferred ion
Diafenthiuron 384.22441 13.247 No MS2
Dibutyl malate 246.14698 10.322 No MS2
Diethyl (2R,3R)-2-hydroxy-3-methylsuccinate 204.09997 8.318 No MS2
Diethyl malonate 160.07358 8.7 No MS2
Diethylpyrocarbonate 162.05301 2.131 DDA for preferred ion
dihydroxyphenylalanine 197.06908 7.808 No MS2
Dimethyl (3-oxocyclohexyl)malonate 228.10016 9.797 No MS2
Dioctanoin 344.25649 13.258 DDA for preferred ion
Diphenol glucuronide 286.06935 2.017 No MS2
Diprogulic Acid 274.10581 5.839 DDA for preferred ion
DL-4-Hydroxyphenyllactic acid 182.05815 6.027 84.7 DDA for preferred ion
DL-Arginine 174.112 0.978 94.4 DDA for preferred ion
DL-Carnitine 161.10537 0.87 89.1 DDA for preferred ion
DL-Cerulenin 223.12109 10.889 No MS2
DL-Citrulline 175.09594 0.865 DDA for preferred ion
DL-Cycloserine 102.04312 0.692 No MS2
DL-Glyceric acid 106.02664 1.29 DDA for preferred ion
DL-Histidine 155.06971 0.782 DDA for preferred ion
DL-Lysine 146.1057 0.728 86.4 DDA for preferred ion
DL-Mandelic acid 152.04751 8.467 79.7 DDA for preferred ion
DL-Mevalonic acid 148.07372 2.051 DDA for preferred ion
DL-Tryptophan 204.09013 5.822 95.9 DDA for preferred ion
DL-TYROSINE 181.07415 0.952 No MS2
D-lysopine 218.12691 4.323 DDA for preferred ion
Docosahexaenoic acid 328.24074 14.222 87.5 DDA for preferred ion
Dodecanedioic acid 230.15196 11.214 87.9 DDA for preferred ion
D-Ribofuranose 150.05296 0.901 DDA for other ion
D-Ribulose 5-phosphate 230.01953 0.971 83.4 DDA for preferred ion
D-Sedoheptulose 7-phosphate 290.04079 0.956 87.9 DDA for preferred ion
D-α-Hydroxyglutaric acid 148.0373 1.44 93.6 DDA for preferred ion
Ecgonine 185.10536 9.222 61.4 DDA for preferred ion
Eicosapentaenoic acid 302.22454 13.184 89.4 DDA for preferred ion
elpamotide 1072.57854 11.062 No MS2
Epiguanine 165.06528 1.509 DDA for preferred ion
epi-jasmonic acid 210.12586 10.806 No MS2
Erucamide 337.33464 16.85 96.2 DDA for preferred ion
Eslicarbazepine 254.10581 10.646 No MS2
Ethanal tetramer 176.10496 9.494 DDA for preferred ion
Ethyl eicosapentaenoic acid 330.25589 13.578 No MS2
Etoglucid 262.14197 6.309 No MS2
Etonogestrel 324.20934 11.525 No MS2
Falecalcitriol 524.27391 11.57 No MS2
felbamate 238.09557 7.961 DDA for preferred ion
Fexofenadine 501.29036 11.42 No MS2
Formiminoglutamic Acid 174.06415 1.576 No MS2
Formylanthranilic acid 165.04276 9.484 DDA for preferred ion
Forskolin 410.23132 10.494 DDA for preferred ion
fosfocreatinine 193.02568 0.808 DDA for preferred ion
Fruticosonine 312.22048 10.793 No MS2
Fumaric acid 116.01101 1.832 95.6 DDA for preferred ion
Gabapentin 171.12611 9.236 No MS2
Galactosylsphingosine 461.33659 11.801 No MS2
gamma-Aminobutyric acid 103.06348 0.891 DDA for preferred ion
gamma-thiomethyl glutamate 193.04119 0.922 DDA for preferred ion
g-Butyrobetaine 145.11044 0.908 DDA for preferred ion
gemeprost 394.27283 11.261 No MS2
Gemfibrozil 250.15719 13.697 No MS2
Genistein 270.0533 10.933 No MS2
gibberellin A12 332.19943 11.337 No MS2
glaucarubolone 394.16363 10.396 DDA for preferred ion
Glu-Met 278.09394 4.007 No MS2
glyceraldehyde 3-phosphate 169.99816 0.989 DDA for preferred ion
glycerin 92.04747 0.901 No MS2
Glycerol 3-phosphate 172.01384 0.98 DDA for preferred ion
Glycocholic acid 465.30971 11.654 No MS2
Glycyl-4-hydroxyproline 188.08 0.925 DDA for preferred ion
Glycylglycylglycine 189.07522 1.61 No MS2
Gly-Leu 188.11635 2.9 No MS2
Gly-l-pro 172.08497 0.915 No MS2
Gly-Phe 222.10064 4.625 No MS2
Guaifenesin 198.08938 10.116 DDA for preferred ion
Guanosine monophosphate 363.05843 1.399 No MS2
Hexadecanedioic acid 286.21484 12.553 94.1 DDA for preferred ion
Hexanal 100.08897 9.992 No MS2
Hexanoylglycine 173.10542 9.125 92.6 DDA for preferred ion
Hexaric acid 210.0377 0.909 No MS2
hexobarbital 236.11624 5.822 No MS2
Hexose 180.06375 0.867 DDA for other ion
Hexylresorcinol 194.13097 11.049 No MS2
HIAA 191.05854 3.823 No MS2
Hippuric acid 179.05842 7.311 94.2 DDA for preferred ion
Homovanillic acid sulfate 262.01503 6.485 No MS2
Hydrolyzed fumonisin B1 405.34575 11.204 63.3 DDA for preferred ion
hydroxyacetone phosphate 154.00334 0.991 No MS2
Hydroxyacetylaminofluorene 239.09483 4.468 No MS2
hydroxycitric acid 208.02209 1.395 DDA for preferred ion
Hydroxyhexanoycarnitine 275.17357 5.739 No MS2
Hypoxanthine 136.03869 1.506 92.8 DDA for preferred ion
icomucret 320.2355 14.565 No MS2
Icotidine 379.19986 11.472 No MS2
ilomastat 388.21056 9.81 DDA for preferred ion
Iloprost 360.23033 11.52 No MS2
Indole 117.058 5.827 DDA for preferred ion
Indole-3-acrylic acid 187.06358 5.83 90.8 DDA for preferred ion
Indole-3-lactic acid 205.07403 9.676 92.6 DDA for preferred ion
Indole-3-pyrubate 203.05849 9.564 DDA for preferred ion
Inosine-5'-monophosphate (IMP) 348.04749 0.941 92.2 DDA for preferred ion
IpA 189.07929 10.689 No MS2
isopropylmalic acid 176.06861 6.655 DDA for preferred ion
Isovitexin 432.1064 9.579 DDA for preferred ion
Kinoprene 276.20912 12.706 No MS2
Kynurenine 208.08501 3.575 No MS2
Kyotorphin 337.17392 10.276 DDA for preferred ion
L-(-)-Asparagine 132.05366 0.912 No MS2
L-(-)-Methionine 149.05123 1.396 95.3 DDA for preferred ion
L-(-)-Serine 105.0428 0.858 DDA for other ion
L-(-)-Threonine 119.05838 0.862 No MS2
L-(+)-ERGOTHIONEINE 229.08875 0.922 No MS2
L-(+)-Lactic acid 90.03173 1.049 99.8 DDA for preferred ion
L-(+)-Valine 117.07905 1.017 No MS2
Labdanolic acid 324.26683 13.526 71.7 DDA for preferred ion
Lactamide 89.04778 0.852 78.8 DDA for preferred ion
L-Alanyl-L-glutamine 217.10648 1.734 No MS2
L-alpha-Glycerylphosphorylcholine 257.1031 0.87 No MS2
L-Azaserine 173.04392 1.493 No MS2
leu-asp 246.1218 3.924 DDA for preferred ion
Leu-Glu 260.13751 5.908 DDA for preferred ion
Leu-pro 228.1477 6.011 No MS2
Levulinic acid 116.04739 3.888 70.7 DDA for preferred ion
L-gamma-glutamyl phosphate 227.0198 0.964 No MS2
L-gamma-Glutamyl-L-leucine 260.1375 6.208 DDA for preferred ion
L-Glutamic acid 147.05332 0.865 85.6 DDA for preferred ion
L-Glutamine 146.06931 0.854 87.8 DDA for preferred ion
L-Glutathione (reduced) 307.08429 0.936 89.1 DDA for preferred ion
L-Glutathione oxidized 612.15284 0.943 75.7 DDA for preferred ion
L-Hexanoylcarnitine 259.1786 9.353 No MS2
Linoleyl carnitine 423.33524 12.093 DDA for preferred ion
L-Lysine 114.0795 0.731 91.4 DDA for other ion
L-Norleucine 131.0948 2.016 95.7 DDA for preferred ion
Lotaustralin 261.12152 1.636 No MS2
L-Phenylalanine 148.05264 3.895 97.4 DDA for other ion
L-Proline 115.06351 0.725 No MS2
L-Pyroglutamic acid 129.04278 0.968 DDA for preferred ion
LQ1825000 127.0999 0.924 No MS2
LT9970000 251.1525 11.493 No MS2
L-Threonic acid 136.03725 1.908 86.6 DDA for preferred ion
L-Tyrosine 164.04761 1.912 94.2 DDA for other ion
L-Valine 117.07906 0.917 90.2 DDA for preferred ion
L-Xylonic acid 166.04782 0.874 DDA for preferred ion
Ly-290411 328.13615 8.32 No MS2
LysoPC(18:3(9Z,12Z,15Z)) 517.3175 12.289 DDA for preferred ion
LysoPC(20:5(5Z,8Z,11Z,14Z,17Z)) 541.31756 12.287 DDA for preferred ion
LysoPC(22:4(7Z,10Z,13Z,16Z)) 571.36443 13.061 No MS2
LysoPC(P-18:0) 507.36951 13.376 DDA for preferred ion
lysophosphatidylethanolamine (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) 525.2863 12.577 DDA for preferred ion
MA4000000 113.04777 1.397 No MS2
Maleic acid 116.01111 1.285 No MS2
Megestrol 342.21972 13.231 No MS2
meprobamate 218.12683 1.661 DDA for preferred ion
Mesalazine 153.04268 11.057 No MS2
methadone-d9 317.95553 0.769 82.5 DDA for preferred ion
Methionine 149.05124 1.202 74.6 DDA for preferred ion
Methyl (3-hydroxy-2-oxo-2,3-dihydro-1H-indol-3-yl)acetate 221.06895 8.016 No MS2
Methyl 11-(6-oxabicyclo[3.1.0]hex-2-yl)undecanoate 282.21983 12.713 No MS2
Methyl 14-acetoxy-5-hydroxy-5,9-dimethyltetracyclo[11.2.1.0~1,10~.0~4,9~]hexadecane-14-carboxylate 378.24115 11.822 DDA for preferred ion
methyl 2-cyano-3-(3,5-dimethyl-1H-pyrrol-2-yl)acrylate 204.09013 6.254 83.4 DDA for preferred ion
Methyl 5-{(3aS,5R,6R,6aS)-5-hydroxy-6-[(1E,3R)-3-hydroxy-1-octen-1-yl]-1,3a,4,5,6,6a-hexahydro-2-pentalenyl}pentanoate 364.26189 13.039 No MS2
Methyl bisulfate 111.9831 1.13 No MS2
Methyl Jasmonate 224.14139 11.802 No MS2
Methyldopa 211.08469 9.224 No MS2
Methylhippuric acid 193.07421 11.377 DDA for preferred ion
Methylsuccinic acid 132.04236 3.412 87.6 DDA for preferred ion
MFCD00025555 202.13201 2.64 No MS2
MFCD00045988 326.28245 13.76 No MS2
MFCD00059633 244.20398 13.12 No MS2
MFCD00191654 128.04744 4.05 DDA for preferred ion
MFCD01706957 334.09101 10.371 DDA for preferred ion
MFCD08277028 284.09008 8.924 DDA for preferred ion
MFCD22416941 425.3509 12.335 DDA for preferred ion
Microcystin LR 994.54759 11.54 DDA for other ion
Milbemycin A3 528.30962 11.353 No MS2
Misoprostol 382.27247 12.198 No MS2
molecular iodine 253.80874 0.833 DDA for preferred ion
monomethyl phosphate 111.99261 0.989 No MS2
Muscimol 114.04308 1.392 No MS2
Mycophenolic acid 320.12631 10.769 No MS2
Myristoleic acid 226.19351 12.458 DDA for other ion
myxochelin B 403.17521 14.379 No MS2
Myxochromide S2 736.41327 11.618 No MS2
Myxochromide S3 748.41296 12.39 No MS2
N-({(2R,4S,5R)-5-[3-(4-Fluorophenyl)-1-methyl-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)-4-methoxybenzamide 448.22374 11.427 60.9 DDA for preferred ion
N(2')-acetylgentamycin C1a 491.29449 8.588 No MS2
N-(4-Hydroxy-3,5-dimethoxybenzoyl)glycine 255.07467 9.669 DDA for preferred ion
N-(tert-Butoxycarbonyl)-L-leucine 231.14727 4.978 DDA for preferred ion
N,N-Dihydroxy-L-tryptophan 236.07995 6.464 DDA for preferred ion
N-[(1-{[(3E,9E)-5-Isopropyl-2,7-dioxo-1,6-diazacyclododeca-3,9-dien-8-yl]amino}-3-methyl-1-oxo-2-butanyl)carbamoyl]valine 493.28939 10.831 DDA for preferred ion
N-[(2S)-2-Hydroxypropanoyl]-L-tryptophan 276.11169 9.839 DDA for preferred ion
N-[(2S)-2-Hydroxypropanoyl]methionine 221.07237 6.805 DDA for preferred ion
N-[(2S,3R,4E)-1-{[2-Acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxy-4-octadecen-2-yl]dodecanamide 1170.69052 11.734 No MS2
N~1~-Isopropyl-2-methylpropan-1,2-diamin 130.14717 0.712 DDA for preferred ion
N~2~-(1-Carboxyethyl)-N~5~-(diaminomethylene)ornithine 246.13293 1.398 No MS2
N~2~-Acetyl-L-ornithine 174.10068 0.936 DDA for preferred ion
N~6~-(2,3-Dihydroxybenzoyl)-N~2~-[(2,3-dihydroxyphenyl)(hydroxy)methyl]lysinamide 419.16981 13.181 No MS2
N~6~-(2,3-Dihydroxybenzoyl)-N~2~-[(2,3-dihydroxyphenyl)(hydroxy)methyl]lysine 420.1542 10.235 No MS2
N1-methyl-5-methoxy-2-({2-[(methylamino)carbonyl]phenyl}thio)benzamide 352.08235 10.049 76.5 DDA for preferred ion
N6,N6,N6-Trimethyl-L-lysine 188.15284 0.991 91.2 DDA for preferred ion
N-Acetylalanine 131.05836 1.904 72.6 DDA for preferred ion
N-Acetylcytidine 285.09638 4.838 No MS2
N-Acetyl-D-alloisoleucine 173.10541 8.696 89.7 DDA for preferred ion
N-Acetyl-DL-glutamic acid 189.06394 1.814 80.3 DDA for preferred ion
N-Acetyl-L-phenylalanine 207.0897 9.438 94.5 DDA for preferred ion
N-Acetyl-L-tyrosine 223.08468 6.351 91.2 DDA for preferred ion
N-Acetylornithine 174.10069 1.96 66.7 DDA for preferred ion
N-Acetylvanilalanine 253.0954 6.961 DDA for preferred ion
Naphthalen-2-amine 143.07369 5.826 No MS2
N-dodecanoylsphinganine 483.46556 13.41 No MS2
N-feruloylglycine 251.0797 11.021 DDA for preferred ion
N-Formylmethionine 177.04616 4.651 76.4 DDA for preferred ion
Niacin 123.03211 1.399 No MS2
Nicotinamide 122.04811 1.441 94.4 DDA for preferred ion
Nicotinuric acid 180.05373 6.3 No MS2
nifursemizone 226.07045 1.488 DDA for preferred ion
NIGAKIHEMIACETAL A 410.23131 9.934 DDA for preferred ion
N-Isobutyrylglycine 145.074 4.103 86.5 DDA for preferred ion
N-Isovalerylglycine 159.08965 6.237 89.8 DDA for preferred ion
NITRILACARB 197.11679 0.831 No MS2
N-methylethanolamine phosphate 155.03502 0.857 No MS2
N-Methylglutamate 161.06897 0.922 DDA for preferred ion
Nodakenin 408.14293 10.554 DDA for preferred ion
NP-001596 286.21483 11.649 72.5 DDA for preferred ion
NP-002855 212.14149 11.057 62.8 DDA for preferred ion
NP-005709 430.09066 8.779 88.6 DDA for preferred ion
NP-007966 254.15223 11.445 61.9 DDA for preferred ion
NP-013098 564.14889 8.775 78.7 DDA for preferred ion
NP-016596 386.19489 10.375 76.6 DDA for preferred ion
NP-018661 160.11006 10.495 71.3 DDA for preferred ion
NP-019483 372.2153 11.656 80.4 DDA for preferred ion
NP-020078 280.2042 12.469 64.5 DDA for preferred ion
NP-020292 232.08501 9.189 62.8 DDA for preferred ion
NP-020353 362.2101 10.84 67.7 DDA for preferred ion
NP-021085 278.18844 11.937 74.2 DDA for other ion
NP-021797 214.1571 11.985 82 DDA for preferred ion
N-Pentacosanoylglycine 439.40298 12.476 No MS2
NS1800000 183.05326 3.014 No MS2
N-Stearoyltyrosine 447.33532 12.087 DDA for preferred ion
N-Tigloylglycine 157.0741 5.971 83.7 DDA for preferred ion
N-Undecanoylglycine 243.18371 10.989 DDA for preferred ion
O-(4,8-dimethylnonanoyl)carnitine 329.25683 12.066 No MS2
O-{Hydroxy[2-hydroxy-3-(stearoyloxy)propoxy]phosphoryl}serine 525.30736 12.752 DDA for preferred ion
O-heptanoylcarnitine 273.19441 11.768 No MS2
OI1695000 172.11014 10.498 No MS2
Olean-12-ene-3,16,21,22,23,28-hexol 506.35822 13.33 No MS2
oleandolide 386.23102 10.518 DDA for preferred ion
Oleic acid 282.25639 12.341 No MS2
olivetolic acid 224.10509 10.815 DDA for preferred ion
ON1225000 172.07377 8.661 DDA for preferred ion
ophthalmic acid 289.1277 1.569 DDA for preferred ion
Orotidine 288.05987 1.158 No MS2
O-tiglyl-L-carnitine 243.14746 9.41 DDA for preferred ion
Otonecine 185.10543 9.888 No MS2
O-ureido-D-serine 163.0597 0.7 No MS2
oxiracetam 158.06941 0.87 No MS2
oxymesterone 318.21973 11.478 DDA for preferred ion
Palmitamide 255.2564 11.154 No MS2
Palmitelaidic acid 254.22466 12.817 No MS2
Palmitic Acid 273.26698 11.139 73.2 DDA for preferred ion
Palmitoyl ethanolamide 299.2827 11.28 72.5 DDA for preferred ion
Palmitoylcarnitine 399.33522 12.241 92.8 DDA for preferred ion
Pantothenic acid 219.11086 5.003 91.9 DDA for preferred ion
Paracetamol 151.06355 6.307 DDA for preferred ion
paracetamol sulfate 231.01963 2.113 DDA for preferred ion
PC(o-22:1(13Z)/22:3(10Z,13Z,16Z)) 879.70785 9.383 No MS2
PEG Diethylhexanoate n6 551.40412 14.42 87.9 DDA for preferred ion
PEG Monolaurate n6 481.35356 13.167 91.3 DDA for preferred ion
PEG Monooleate n7 607.46672 15.377 91.3 DDA for preferred ion
PEG Monooleate n8 651.49281 15.353 93.1 DDA for preferred ion
PEG n5 238.14181 6.057 96.8 DDA for preferred ion
PEG-4 194.11569 5.071 DDA for preferred ion
P-Gal 256.09517 8.937 No MS2
phenacetin 179.09487 1.78 No MS2
Phenyl D-glucopyranosiduronic acid 270.07447 6.766 DDA for preferred ion
Phenylacetylglycine 193.07419 8.212 89.5 DDA for preferred ion
Phosphonoacetate 139.9877 0.955 No MS2
Phosphoric acid 97.97699 0.932 DDA for preferred ion
Pimelea factor P2 638.34725 12.78 No MS2
Pimelic acid 160.07367 7.43 90 DDA for preferred ion
Piracetam 142.07446 0.923 No MS2
Pivagabine 187.12107 10.228 DDA for preferred ion
Pizotifen 295.13902 12.918 No MS2
Pregabalin 159.1261 0.926 No MS2
primary fluorescent chlorophyll catabolite 628.28696 12.305 No MS2
Probucol 516.3107 11.652 No MS2
prohydrojasmon 254.18851 12.78 DDA for preferred ion
Promazine 284.13497 10.551 91.8 DDA for preferred ion
Promegestone 326.22448 12.075 No MS2
Promethazine sulfoxide 300.12986 9.445 84 DDA for preferred ion
propionylcarnitine 217.13155 9.864 DDA for preferred ion
Pro-Pro 212.1163 1.791 DDA for preferred ion
Prostaglandin A1 ethyl ester 346.25123 13.433 66.7 DDA for preferred ion
Prostaglandin D2 Ethanolamide 395.2677 11.519 No MS2
Prostaglandin F1α 356.25684 11.5 74 DDA for preferred ion
Prostaglandin F3? 352.22546 11.947 80.4 DDA for preferred ion
prostaglandin G2 2-glyceryl ester 442.25738 12.012 No MS2
Protodioscin 1048.54624 11.547 No MS2
Prunin 434.12205 10.318 DDA for preferred ion
Pyrogallol 126.03179 5.953 No MS2
Pyrophosphoric Acid 177.94339 0.93 No MS2
Pyruvic acid 88.01616 1.257 92.4 DDA for preferred ion
Reduced Glutathione 307.08437 9.973 No MS2
Retinyl acetate 328.24038 13.434 No MS2
RI2735000 154.09871 10.86 No MS2
Salbutamol 239.15249 11.428 No MS2
Salicylic acid 138.03178 6.602 84.3 DDA for preferred ion
S-Allyl-L-cysteine 161.05121 2.698 No MS2
Sebacic acid 202.12066 9.585 No MS2
sec-Butyl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-D-glucopyranoside 368.16866 7.856 DDA for preferred ion
Sec-O-glucosylhamaudol 438.15339 11.102 No MS2
Skatole 131.07363 5.824 No MS2
Sorbitan, monododecanoate 346.23603 10.876 DDA for preferred ion
Spermidine 128.13157 0.705 80.1 DDA for other ion
Spermine 202.21604 0.725 DDA for preferred ion
sphinganine 301.29836 11.603 DDA for preferred ion
Sphingosine (d18:1) 299.28267 11.759 91 DDA for preferred ion
Sphingosine-1-phosphate (d16:1) 351.21797 11.488 No MS2
Spiroxamine 297.26705 11.47 No MS2
ST2975000 153.05406 4.831 DDA for preferred ion
Stachydrine 143.09484 1.077 No MS2
Stavudine 224.07989 5.731 DDA for preferred ion
stearoylcarnitine 427.36653 12.601 DDA for preferred ion
Streptamine 4-phosphate 258.06047 1.424 No MS2
Succinic acid 118.02667 1.748 90.1 DDA for preferred ion
Sulfamic acid 96.98358 0.696 DDA for other ion
Sulfolithocholic acid 456.25673 11.023 No MS2
symphytine 381.21577 13.096 No MS2
Taurine 125.01475 0.861 92.1 DDA for preferred ion
TBHQ 166.09959 8.82 No MS2
Testosterone diacetate 374.24605 14.223 DDA for preferred ion
Tetradecanedioic acid 258.1836 11.914 91.1 DDA for preferred ion
tetrahydrocortisol 366.24115 10.787 DDA for preferred ion
thiamine pyrophosphate 425.04346 0.918 No MS2
Threonylglutamine 247.11726 2 No MS2
Thromboxane B2 370.23596 10.976 78.2 DDA for preferred ion
TI1090000 362.24631 12.81 No MS2
Timonacic 133.01922 0.911 No MS2
tinoridine 316.12481 9.652 No MS2
Toloxatone 207.0897 9.738 DDA for preferred ion
Tomelukast 318.1682 9.877 No MS2
Traumatic Acid 228.13645 10.997 DDA for preferred ion
Traumatin 212.14147 12.399 No MS2
Tretinoin 300.20903 12.846 No MS2
Trifluoroacetic acid 113.99298 0.786 DDA for preferred ion
trimethadione 143.05833 3.786 No MS2
Trolox 250.12081 11.23 DDA for preferred ion
tyr-glu 310.11684 4.805 DDA for preferred ion
UNII:V9Q7UUZ15U 280.16787 11.785 No MS2
UNII:Z5JO63XGNK 262.19349 12.466 No MS2
Uracil 112.02728 0.947 DDA for preferred ion
Uric acid 168.02844 0.932 92.2 DDA for preferred ion
Uridine 244.06992 1.884 90.6 DDA for preferred ion
Valeroidine 241.16814 11.8 DDA for preferred ion
Valerophenone 162.10462 11.493 DDA for preferred ion
Valproic acid beta-D-glucuronide 320.14763 8.06 DDA for preferred ion
Vigabatrin 129.07918 0.722 DDA for preferred ion
Vitamin C 176.03222 1.959 No MS2
VS1150000 314.24631 13.192 No MS2
Xanthine 152.03354 1.734 90.1 DDA for preferred ion
Xanthosine 284.07606 4.109 89.4 DDA for preferred ion
zidometacin 364.11657 10.502 DDA for preferred ion
α-D-Mannose 1-phosphate 260.03009 0.965 92.4 DDA for preferred ion
δ-Gluconic acid δ-lactone 178.04788 1.638 63 DDA for preferred ion
δ-Ribono-1,4-lactone 148.0373 0.942 75.5 DDA for preferred ion
METABOLITES_END
#END