#METABOLOMICS WORKBENCH matthijskox_20190916_023026 DATATRACK_ID:1817 STUDY_ID:ST001251 ANALYSIS_ID:AN002077 PROJECT_ID:PR000838 VERSION 1 CREATED_ON September 17, 2019, 10:35 am #PROJECT PR:PROJECT_TITLE The effects of a training program encompassing cold exposure, breathing PR:PROJECT_TITLE exercises, and meditation on the inflammatory response PR:PROJECT_TYPE Experimental human endotoxemia project PR:PROJECT_SUMMARY Project to investigate the effects of a training program encompassing cold PR:PROJECT_SUMMARY exposure, breathing exercises, and meditation on the inflammatory response PR:PROJECT_SUMMARY during experimental human endotoxemia. PR:INSTITUTE Radboud University Medical Centre Nijmegen PR:DEPARTMENT Intensive Care Medicine PR:LAST_NAME Kox PR:FIRST_NAME Matthijs PR:ADDRESS Intensive Care Medicine (710), Geert Grooteplein 10, 6500 HB, Nijmegen, the PR:ADDRESS Netherlands PR:EMAIL matthijs.kox@radboudumc.nl PR:PHONE +31243653881 PR:FUNDING_SOURCE Dutch Arthritis Society (ReumaNederland, https://reumanederland.nl/) Serendipity PR:FUNDING_SOURCE Grant, no. 12-1-101 PR:PUBLICATIONS https://www.pnas.org/content/111/20/7379.long; PR:PUBLICATIONS https://link.springer.com/article/10.1007%2Fs10067-015-3009-8 #STUDY ST:STUDY_TITLE The effects of a training program encompassing cold exposure, breathing ST:STUDY_TITLE exercises, and meditation on plasma metabomics during experimental human ST:STUDY_TITLE endotoxemia ST:STUDY_TYPE Experimental human endotoxemia study ST:STUDY_SUMMARY Study to investigate the effects of a training program encompassing cold ST:STUDY_SUMMARY exposure, breathing exercises, and meditation on plasma metabolomic during ST:STUDY_SUMMARY experimental human endotoxemia. ST:INSTITUTE Radboud University Medical Centre Nijmegen ST:DEPARTMENT Intensive Care Medicine ST:LABORATORY Metabolomic Discoveries (acquired by Metabolon in September 2017) ST:LAST_NAME Kox ST:FIRST_NAME Matthijs ST:ADDRESS Intensive Care Medicine (710), Geert Grooteplein 10 ST:EMAIL matthijs.kox@radboudumc.nl ST:PHONE 243653881 ST:NUM_GROUPS 2 ST:TOTAL_SUBJECTS 24 ST:NUM_MALES 24 #SUBJECT SU:SUBJECT_TYPE Human SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 SU:AGE_OR_AGE_RANGE 19-27 SU:WEIGHT_OR_WEIGHT_RANGE 58-92 SU:HEIGHT_OR_HEIGHT_RANGE 172-190 SU:GENDER Male SU:HUMAN_RACE Caucasian SU:HUMAN_TRIAL_TYPE Prospective randomized open label controlled intervention study SU:HUMAN_MEDICATIONS None SU:HUMAN_PRESCRIPTION_OTC None SU:HUMAN_SMOKING_STATUS Non smoker SU:HUMAN_ALCOHOL_DRUG_USE Not in SU:HUMAN_NUTRITION Fasted for 12 hours before the first sample was obtained. SU:HUMAN_INCLUSION_CRITERIA Healthy (normal physical examination, electrocardiography, and routine SU:HUMAN_INCLUSION_CRITERIA laboratory values). SU:HUMAN_EXCLUSION_CRITERIA Febrile illness during the 2 weeks before the endotoxemia experiment, taking any SU:HUMAN_EXCLUSION_CRITERIA prescription medication, history of spontaneous vagal collapse, practicing or SU:HUMAN_EXCLUSION_CRITERIA experience with any kind of meditation, or participation in a previous trial SU:HUMAN_EXCLUSION_CRITERIA where LPS was administered. #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS 17_41 17_41 _t_minus_50 treatment:control age (years)=21; height (cm)=180; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_41 17_41 _t_0 treatment:control age (years)=21; height (cm)=180; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_41 17_41 _t_60 treatment:control age (years)=21; height (cm)=180; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_41 17_41 _t_120 treatment:control age (years)=21; height (cm)=180; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_41 17_41 _t_240 treatment:control age (years)=21; height (cm)=180; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_41 17_41 _t_480 treatment:control age (years)=21; height (cm)=180; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_42 17_42 _t_minus_50 treatment:control age (years)=22; height (cm)=189; weight (kg)=87.7 SUBJECT_SAMPLE_FACTORS 17_42 17_42 _t_0 treatment:control age (years)=22; height (cm)=189; weight (kg)=87.7 SUBJECT_SAMPLE_FACTORS 17_42 17_42 _t_60 treatment:control age (years)=22; height (cm)=189; weight (kg)=87.7 SUBJECT_SAMPLE_FACTORS 17_42 17_42 _t_120 treatment:control age (years)=22; height (cm)=189; weight (kg)=87.7 SUBJECT_SAMPLE_FACTORS 17_42 17_42 _t_240 treatment:control age (years)=22; height (cm)=189; weight (kg)=87.7 SUBJECT_SAMPLE_FACTORS 17_42 17_42 _t_480 treatment:control age (years)=22; height (cm)=189; weight (kg)=87.7 SUBJECT_SAMPLE_FACTORS 17_36 17_36 _t_minus_50 treatment:trained age (years)=19; height (cm)=180; weight (kg)=60.9 SUBJECT_SAMPLE_FACTORS 17_36 17_36 _t_0 treatment:trained age (years)=19; height (cm)=180; weight (kg)=60.9 SUBJECT_SAMPLE_FACTORS 17_36 17_36 _t_60 treatment:trained age (years)=19; height (cm)=180; weight (kg)=60.9 SUBJECT_SAMPLE_FACTORS 17_36 17_36 _t_120 treatment:trained age (years)=19; height (cm)=180; weight (kg)=60.9 SUBJECT_SAMPLE_FACTORS 17_36 17_36 _t_240 treatment:trained age (years)=19; height (cm)=180; weight (kg)=60.9 SUBJECT_SAMPLE_FACTORS 17_36 17_36 _t_480 treatment:trained age (years)=19; height (cm)=180; weight (kg)=60.9 SUBJECT_SAMPLE_FACTORS 17_35 17_35 _t_minus_50 treatment:trained age (years)=26; height (cm)=187; weight (kg)=76.9 SUBJECT_SAMPLE_FACTORS 17_35 17_35 _t_0 treatment:trained age (years)=26; height (cm)=187; weight (kg)=76.9 SUBJECT_SAMPLE_FACTORS 17_35 17_35 _t_120 treatment:trained age (years)=26; height (cm)=187; weight (kg)=76.9 SUBJECT_SAMPLE_FACTORS 17_35 17_35 _t_240 treatment:trained age (years)=26; height (cm)=187; weight (kg)=76.9 SUBJECT_SAMPLE_FACTORS 17_40 17_40 _t_0 treatment:control age (years)=27; height (cm)=188; weight (kg)=76.9 SUBJECT_SAMPLE_FACTORS 17_40 17_40 _t_60 treatment:control age (years)=27; height (cm)=188; weight (kg)=76.9 SUBJECT_SAMPLE_FACTORS 17_40 17_40 _t_120 treatment:control age (years)=27; height (cm)=188; weight (kg)=76.9 SUBJECT_SAMPLE_FACTORS 17_40 17_40 _t_240 treatment:control age (years)=27; height (cm)=188; weight (kg)=76.9 SUBJECT_SAMPLE_FACTORS 17_40 17_40 _t_480 treatment:control age (years)=27; height (cm)=188; weight (kg)=76.9 SUBJECT_SAMPLE_FACTORS 17_14 17_14 _t_minus_50 treatment:trained age (years)=24; height (cm)=177; weight (kg)=74.1 SUBJECT_SAMPLE_FACTORS 17_14 17_14 _t_0 treatment:trained age (years)=24; height (cm)=177; weight (kg)=74.1 SUBJECT_SAMPLE_FACTORS 17_14 17_14 _t_60 treatment:trained age (years)=24; height (cm)=177; weight (kg)=74.1 SUBJECT_SAMPLE_FACTORS 17_14 17_14 _t_120 treatment:trained age (years)=24; height (cm)=177; weight (kg)=74.1 SUBJECT_SAMPLE_FACTORS 17_14 17_14 _t_240 treatment:trained age (years)=24; height (cm)=177; weight (kg)=74.1 SUBJECT_SAMPLE_FACTORS 17_14 17_14 _t_480 treatment:trained age (years)=24; height (cm)=177; weight (kg)=74.1 SUBJECT_SAMPLE_FACTORS 17_23 17_23 _t_minus_50 treatment:trained age (years)=24; height (cm)=172; weight (kg)=69.6 SUBJECT_SAMPLE_FACTORS 17_23 17_23 _t_60 treatment:trained age (years)=24; height (cm)=172; weight (kg)=69.6 SUBJECT_SAMPLE_FACTORS 17_23 17_23 _t_120 treatment:trained age (years)=24; height (cm)=172; weight (kg)=69.6 SUBJECT_SAMPLE_FACTORS 17_23 17_23 _t_240 treatment:trained age (years)=24; height (cm)=172; weight (kg)=69.6 SUBJECT_SAMPLE_FACTORS 17_23 17_23 _t_480 treatment:trained age (years)=24; height (cm)=172; weight (kg)=69.6 SUBJECT_SAMPLE_FACTORS 17_33 17_33 _t_minus_50 treatment:control age (years)=19; height (cm)=183; weight (kg)=83.6 SUBJECT_SAMPLE_FACTORS 17_33 17_33 _t_0 treatment:control age (years)=19; height (cm)=183; weight (kg)=83.6 SUBJECT_SAMPLE_FACTORS 17_33 17_33 _t_60 treatment:control age (years)=19; height (cm)=183; weight (kg)=83.6 SUBJECT_SAMPLE_FACTORS 17_33 17_33 _t_120 treatment:control age (years)=19; height (cm)=183; weight (kg)=83.6 SUBJECT_SAMPLE_FACTORS 17_33 17_33 _t_240 treatment:control age (years)=19; height (cm)=183; weight (kg)=83.6 SUBJECT_SAMPLE_FACTORS 17_33 17_33 _t_480 treatment:control age (years)=19; height (cm)=183; weight (kg)=83.6 SUBJECT_SAMPLE_FACTORS 17_02 17_02 _t_minus_50 treatment:control age (years)=19; height (cm)=185; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_02 17_02 _t_0 treatment:control age (years)=19; height (cm)=185; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_02 17_02 _t_60 treatment:control age (years)=19; height (cm)=185; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_02 17_02 _t_120 treatment:control age (years)=19; height (cm)=185; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_02 17_02 _t_240 treatment:control age (years)=19; height (cm)=185; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_02 17_02 _t_480 treatment:control age (years)=19; height (cm)=185; weight (kg)=77.7 SUBJECT_SAMPLE_FACTORS 17_27 17_27 _t_minus_50 treatment:trained age (years)=21; height (cm)=188; weight (kg)=84.9 SUBJECT_SAMPLE_FACTORS 17_27 17_27 _t_0 treatment:trained age (years)=21; height (cm)=188; weight (kg)=84.9 SUBJECT_SAMPLE_FACTORS 17_27 17_27 _t_60 treatment:trained age (years)=21; height (cm)=188; weight (kg)=84.9 SUBJECT_SAMPLE_FACTORS 17_27 17_27 _t_120 treatment:trained age (years)=21; height (cm)=188; weight (kg)=84.9 SUBJECT_SAMPLE_FACTORS 17_27 17_27 _t_240 treatment:trained age (years)=21; height (cm)=188; weight (kg)=84.9 SUBJECT_SAMPLE_FACTORS 17_27 17_27 _t_480 treatment:trained age (years)=21; height (cm)=188; weight (kg)=84.9 SUBJECT_SAMPLE_FACTORS 17_21 17_21 _t_0 treatment:trained age (years)=20; height (cm)=180; weight (kg)=74.7 SUBJECT_SAMPLE_FACTORS 17_21 17_21 _t_60 treatment:trained age (years)=20; height (cm)=180; weight (kg)=74.7 SUBJECT_SAMPLE_FACTORS 17_21 17_21 _t_120 treatment:trained age (years)=20; height (cm)=180; weight (kg)=74.7 SUBJECT_SAMPLE_FACTORS 17_21 17_21 _t_240 treatment:trained age (years)=20; height (cm)=180; weight (kg)=74.7 SUBJECT_SAMPLE_FACTORS 17_21 17_21 _t_480 treatment:trained age (years)=20; height (cm)=180; weight (kg)=74.7 SUBJECT_SAMPLE_FACTORS 17_01 17_01 _t_minus_50 treatment:trained age (years)=27; height (cm)=188; weight (kg)=91.6 SUBJECT_SAMPLE_FACTORS 17_01 17_01 _t_0 treatment:trained age (years)=27; height (cm)=188; weight (kg)=91.6 SUBJECT_SAMPLE_FACTORS 17_01 17_01 _t_60 treatment:trained age (years)=27; height (cm)=188; weight (kg)=91.6 SUBJECT_SAMPLE_FACTORS 17_01 17_01 _t_120 treatment:trained age (years)=27; height (cm)=188; weight (kg)=91.6 SUBJECT_SAMPLE_FACTORS 17_01 17_01 _t_240 treatment:trained age (years)=27; height (cm)=188; weight (kg)=91.6 SUBJECT_SAMPLE_FACTORS 17_01 17_01 _t_480 treatment:trained age (years)=27; height (cm)=188; weight (kg)=91.6 SUBJECT_SAMPLE_FACTORS 17_34 17_34 _t_minus_50 treatment:trained age (years)=22; height (cm)=182; weight (kg)=79 SUBJECT_SAMPLE_FACTORS 17_34 17_34 _t_0 treatment:trained age (years)=22; height (cm)=182; weight (kg)=79 SUBJECT_SAMPLE_FACTORS 17_34 17_34 _t_60 treatment:trained age (years)=22; height (cm)=182; weight (kg)=79 SUBJECT_SAMPLE_FACTORS 17_34 17_34 _t_120 treatment:trained age (years)=22; height (cm)=182; weight (kg)=79 SUBJECT_SAMPLE_FACTORS 17_34 17_34 _t_240 treatment:trained age (years)=22; height (cm)=182; weight (kg)=79 SUBJECT_SAMPLE_FACTORS 17_34 17_34 _t_480 treatment:trained age (years)=22; height (cm)=182; weight (kg)=79 SUBJECT_SAMPLE_FACTORS 17_29 17_29 _t_minus_50 treatment:control age (years)=22; height (cm)=182; weight (kg)=85 SUBJECT_SAMPLE_FACTORS 17_29 17_29 _t_0 treatment:control age (years)=22; height (cm)=182; weight (kg)=85 SUBJECT_SAMPLE_FACTORS 17_29 17_29 _t_60 treatment:control age (years)=22; height (cm)=182; weight (kg)=85 SUBJECT_SAMPLE_FACTORS 17_29 17_29 _t_120 treatment:control age (years)=22; height (cm)=182; weight (kg)=85 SUBJECT_SAMPLE_FACTORS 17_29 17_29 _t_240 treatment:control age (years)=22; height (cm)=182; weight (kg)=85 SUBJECT_SAMPLE_FACTORS 17_29 17_29 _t_480 treatment:control age (years)=22; height (cm)=182; weight (kg)=85 SUBJECT_SAMPLE_FACTORS 17_05 17_05 _t_minus_50 treatment:trained age (years)=26; height (cm)=179; weight (kg)=75.3 SUBJECT_SAMPLE_FACTORS 17_05 17_05 _t_0 treatment:trained age (years)=26; height (cm)=179; weight (kg)=75.3 SUBJECT_SAMPLE_FACTORS 17_05 17_05 _t_60 treatment:trained age (years)=26; height (cm)=179; weight (kg)=75.3 SUBJECT_SAMPLE_FACTORS 17_05 17_05 _t_120 treatment:trained age (years)=26; height (cm)=179; weight (kg)=75.3 SUBJECT_SAMPLE_FACTORS 17_05 17_05 _t_240 treatment:trained age (years)=26; height (cm)=179; weight (kg)=75.3 SUBJECT_SAMPLE_FACTORS 17_05 17_05 _t_480 treatment:trained age (years)=26; height (cm)=179; weight (kg)=75.3 SUBJECT_SAMPLE_FACTORS 17_20 17_20 _t_minus_50 treatment:trained age (years)=25; height (cm)=184; weight (kg)=72.3 SUBJECT_SAMPLE_FACTORS 17_20 17_20 _t_0 treatment:trained age (years)=25; height (cm)=184; weight (kg)=72.3 SUBJECT_SAMPLE_FACTORS 17_20 17_20 _t_60 treatment:trained age (years)=25; height (cm)=184; weight (kg)=72.3 SUBJECT_SAMPLE_FACTORS 17_20 17_20 _t_120 treatment:trained age (years)=25; height (cm)=184; weight (kg)=72.3 SUBJECT_SAMPLE_FACTORS 17_20 17_20 _t_240 treatment:trained age (years)=25; height (cm)=184; weight (kg)=72.3 SUBJECT_SAMPLE_FACTORS 17_20 17_20 _t_480 treatment:trained age (years)=25; height (cm)=184; weight (kg)=72.3 SUBJECT_SAMPLE_FACTORS 17_13 17_13 _t_minus_50 treatment:control age (years)=20; height (cm)=186; weight (kg)=78.5 SUBJECT_SAMPLE_FACTORS 17_13 17_13 _t_0 treatment:control age (years)=20; height (cm)=186; weight (kg)=78.5 SUBJECT_SAMPLE_FACTORS 17_13 17_13 _t_60 treatment:control age (years)=20; height (cm)=186; weight (kg)=78.5 SUBJECT_SAMPLE_FACTORS 17_13 17_13 _t_120 treatment:control age (years)=20; height (cm)=186; weight (kg)=78.5 SUBJECT_SAMPLE_FACTORS 17_13 17_13 _t_240 treatment:control age (years)=20; height (cm)=186; weight (kg)=78.5 SUBJECT_SAMPLE_FACTORS 17_13 17_13 _t_480 treatment:control age (years)=20; height (cm)=186; weight (kg)=78.5 SUBJECT_SAMPLE_FACTORS 17_22 17_22 _t_minus_50 treatment:control age (years)=22; height (cm)=186; weight (kg)=69.5 SUBJECT_SAMPLE_FACTORS 17_22 17_22 _t_0 treatment:control age (years)=22; height (cm)=186; weight (kg)=69.5 SUBJECT_SAMPLE_FACTORS 17_22 17_22 _t_60 treatment:control age (years)=22; height (cm)=186; weight (kg)=69.5 SUBJECT_SAMPLE_FACTORS 17_22 17_22 _t_120 treatment:control age (years)=22; height (cm)=186; weight (kg)=69.5 SUBJECT_SAMPLE_FACTORS 17_22 17_22 _t_240 treatment:control age (years)=22; height (cm)=186; weight (kg)=69.5 SUBJECT_SAMPLE_FACTORS 17_22 17_22 _t_480 treatment:control age (years)=22; height (cm)=186; weight (kg)=69.5 SUBJECT_SAMPLE_FACTORS 17_30 17_30 _t_minus_50 treatment:control age (years)=22; height (cm)=180; weight (kg)=64.5 SUBJECT_SAMPLE_FACTORS 17_30 17_30 _t_0 treatment:control age (years)=22; height (cm)=180; weight (kg)=64.5 SUBJECT_SAMPLE_FACTORS 17_30 17_30 _t_60 treatment:control age (years)=22; height (cm)=180; weight (kg)=64.5 SUBJECT_SAMPLE_FACTORS 17_30 17_30 _t_120 treatment:control age (years)=22; height (cm)=180; weight (kg)=64.5 SUBJECT_SAMPLE_FACTORS 17_30 17_30 _t_240 treatment:control age (years)=22; height (cm)=180; weight (kg)=64.5 SUBJECT_SAMPLE_FACTORS 17_30 17_30 _t_480 treatment:control age (years)=22; height (cm)=180; weight (kg)=64.5 SUBJECT_SAMPLE_FACTORS 17_10 17_10 _t_minus_50 treatment:trained age (years)=27; height (cm)=190; weight (kg)=83 SUBJECT_SAMPLE_FACTORS 17_10 17_10 _t_0 treatment:trained age (years)=27; height (cm)=190; weight (kg)=83 SUBJECT_SAMPLE_FACTORS 17_10 17_10 _t_60 treatment:trained age (years)=27; height (cm)=190; weight (kg)=83 SUBJECT_SAMPLE_FACTORS 17_10 17_10 _t_120 treatment:trained age (years)=27; height (cm)=190; weight (kg)=83 SUBJECT_SAMPLE_FACTORS 17_10 17_10 _t_240 treatment:trained age (years)=27; height (cm)=190; weight (kg)=83 SUBJECT_SAMPLE_FACTORS 17_10 17_10 _t_480 treatment:trained age (years)=27; height (cm)=190; weight (kg)=83 SUBJECT_SAMPLE_FACTORS 17_15 17_15 _t_minus_50 treatment:trained age (years)=22; height (cm)=175; weight (kg)=58 SUBJECT_SAMPLE_FACTORS 17_15 17_15 _t_0 treatment:trained age (years)=22; height (cm)=175; weight (kg)=58 SUBJECT_SAMPLE_FACTORS 17_15 17_15 _t_60 treatment:trained age (years)=22; height (cm)=175; weight (kg)=58 SUBJECT_SAMPLE_FACTORS 17_15 17_15 _t_120 treatment:trained age (years)=22; height (cm)=175; weight (kg)=58 SUBJECT_SAMPLE_FACTORS 17_15 17_15 _t_240 treatment:trained age (years)=22; height (cm)=175; weight (kg)=58 SUBJECT_SAMPLE_FACTORS 17_15 17_15 _t_480 treatment:trained age (years)=22; height (cm)=175; weight (kg)=58 SUBJECT_SAMPLE_FACTORS 17_08 17_08_t_minus_50 treatment:control age (years)=26; height (cm)=179; weight (kg)=75.6 SUBJECT_SAMPLE_FACTORS 17_08 17_08_t_0 treatment:control age (years)=26; height (cm)=179; weight (kg)=75.6 SUBJECT_SAMPLE_FACTORS 17_08 17_08_t_60 treatment:control age (years)=26; height (cm)=179; weight (kg)=75.6 SUBJECT_SAMPLE_FACTORS 17_08 17_08_t_120 treatment:control age (years)=26; height (cm)=179; weight (kg)=75.6 SUBJECT_SAMPLE_FACTORS 17_08 17_08_t_240 treatment:control age (years)=26; height (cm)=179; weight (kg)=75.6 SUBJECT_SAMPLE_FACTORS 17_08 17_08_t_480 treatment:control age (years)=26; height (cm)=179; weight (kg)=75.6 SUBJECT_SAMPLE_FACTORS 17_03 17_03_t_minus_50 treatment:control age (years)=24; height (cm)=189; weight (kg)=76 SUBJECT_SAMPLE_FACTORS 17_03 17_03_t_0 treatment:control age (years)=24; height (cm)=189; weight (kg)=76 SUBJECT_SAMPLE_FACTORS 17_03 17_03_t_60 treatment:control age (years)=24; height (cm)=189; weight (kg)=76 SUBJECT_SAMPLE_FACTORS 17_03 17_03_t_120 treatment:control age (years)=24; height (cm)=189; weight (kg)=76 SUBJECT_SAMPLE_FACTORS 17_03 17_03_t_240 treatment:control age (years)=24; height (cm)=189; weight (kg)=76 SUBJECT_SAMPLE_FACTORS 17_03 17_03_t_480 treatment:control age (years)=24; height (cm)=189; weight (kg)=76 SUBJECT_SAMPLE_FACTORS 17_09 17_09_t_minus_50 treatment:control age (years)=27; height (cm)=184; weight (kg)=90.5 SUBJECT_SAMPLE_FACTORS 17_09 17_09_t_0 treatment:control age (years)=27; height (cm)=184; weight (kg)=90.5 SUBJECT_SAMPLE_FACTORS 17_09 17_09_t_120 treatment:control age (years)=27; height (cm)=184; weight (kg)=90.5 SUBJECT_SAMPLE_FACTORS 17_09 17_09_t_240 treatment:control age (years)=27; height (cm)=184; weight (kg)=90.5 SUBJECT_SAMPLE_FACTORS 17_09 17_09_t_480 treatment:control age (years)=27; height (cm)=184; weight (kg)=90.5 #COLLECTION CO:COLLECTION_SUMMARY Ethylenediaminetetraacetic acid (EDTA) anti-coagulated blood was obtained one CO:COLLECTION_SUMMARY hour before LPS administration (baseline), and at T=0, T=1, T=2, T=4 and T=8 h. CO:COLLECTION_SUMMARY Blood was immediately centrifuged at 2000 g for 10 minutes at 4 °C after which CO:COLLECTION_SUMMARY plasma was stored at –80 °C until analysis. CO:SAMPLE_TYPE Blood (plasma) CO:COLLECTION_METHOD Arterial canulla CO:COLLECTION_LOCATION Radial artery CO:COLLECTION_FREQUENCY 6 CO:COLLECTION_DURATION 1 minute CO:STORAGE_CONDITIONS -80℃ CO:COLLECTION_VIALS Vacutainer blood collection tubes (BD) CO:STORAGE_VIALS Micronic vials (polypropylene) CO:COLLECTION_TUBE_TEMP Room temperature CO:ADDITIVES Ethylenediaminetetraacetic acid (EDTA) #TREATMENT TR:TREATMENT_SUMMARY The subjects were randomly allocated to the trained group (n=12) or the control TR:TREATMENT_SUMMARY group (n=12) by the opening of sealed envelopes prepared by unblinded staff not TR:TREATMENT_SUMMARY involved in the study. The trained group underwent a 10-day training program TR:TREATMENT_SUMMARY provided by Dutch individual Wim Hof, which consisted of three main elements: TR:TREATMENT_SUMMARY meditation, exposure to cold, and breathing exercises (see TR:TREATMENT_SUMMARY https://www.pnas.org/content/111/20/7379.long for a detailed description). After TR:TREATMENT_SUMMARY completion of the training, subjects underwent experimental human endotoxemia at TR:TREATMENT_SUMMARY our intensive care research unit, consisting of administration of an intravenous TR:TREATMENT_SUMMARY bolus of 2 ng/kg of US Standard Reference Escherichia coli endotoxin (E. coli TR:TREATMENT_SUMMARY O:113 [LPS], Clinical Center Reference Endotoxin; National Institutes of Health, TR:TREATMENT_SUMMARY Bethesda, MD, USA). The experimental human endotoxemia protocol is provided in TR:TREATMENT_SUMMARY detail elsewhere (https://www.ncbi.nlm.nih.gov/pubmed/29936295; TR:TREATMENT_SUMMARY https://www.sciencedirect.com/science/article/pii/S0300908418301718?via%3Dihub). TR:TREATMENT_SUMMARY The control group did not undergo any training procedures and also underwent TR:TREATMENT_SUMMARY experimental human endotoxemia. Subjects in the trained group started practicing TR:TREATMENT_SUMMARY the breathing exercises acquired during the training program 30 minutes before TR:TREATMENT_SUMMARY LPS administration until two-and-a-half hours afterwards. The control group did TR:TREATMENT_SUMMARY not practice any techniques throughout the endotoxemia experiment. As described TR:TREATMENT_SUMMARY in detail elsewhere (https://www.pnas.org/content/111/20/7379.long), the TR:TREATMENT_SUMMARY breathing techniques consisted of two exercises. In brief, the first exercise TR:TREATMENT_SUMMARY comprised cycles of vigorous hyperventilation (approximately 30 breaths) TR:TREATMENT_SUMMARY followed by breath holding for several minutes at the discretion of the subject. TR:TREATMENT_SUMMARY The second exercise was similar, but at the end of the hyperventilation period, TR:TREATMENT_SUMMARY breath was only held for 10 seconds during all body muscles were tightened. TR:TREATMENT Nonpharmacological training intervention TR:TREATMENT_ROUTE n/a. TR:TREATMENT_DOSE n/a. TR:TREATMENT_DOSEVOLUME n/a. TR:TREATMENT_DOSEDURATION 10 days TR:TREATMENT_VEHICLE control group TR:HUMAN_FASTING Yes, 12 hours before obtaining the first sample. TR:TREATMENT_COMPOUND n/a. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Sample extraction was performed as described previously SP:SAMPLEPREP_SUMMARY (https://journals.plos.org/plosone/article?id=10.1371/journal.pone.0154597), SP:SAMPLEPREP_SUMMARY with some modifications. Briefly, 50 µL of plasma was mixed with 450 µL of 90% SP:SAMPLEPREP_SUMMARY (v/v) methanol containing internal standards and incubated for 15 min at 37°C SP:SAMPLEPREP_SUMMARY with 1150 rpm. Precipitated proteins were separated from the extract by SP:SAMPLEPREP_SUMMARY centrifugation for 12 min at 15000 rpm, after which supernatants were stored at SP:SAMPLEPREP_SUMMARY -80 °C until further analysis. SP:PROCESSING_STORAGE_CONDITIONS -80℃ SP:EXTRACTION_METHOD Ethanol precipitation #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Agilent 1290 CH:COLUMN_NAME Discovery HS F5-3 column (15 cm x 2.1 mm, 3 µm, Supelco, Sigma Aldrich) CH:FLOW_GRADIENT 5% B from 0-0.1min to 35% B at 1.5 min, to 95% B at 2.05 min which was kept CH:FLOW_GRADIENT constant until 3.2 min, to 5% B at 3.21 min and washing until 4.3 min with 5% B. CH:FLOW_RATE The flow rate was kept constant at 700 µL/min from 0 min to 2.2 min, and CH:FLOW_RATE increased up to 900 µL/min from 2.2 min to 2.5 min, after which flow rate was CH:FLOW_RATE kept constant until 3.2 min.The flow rate was decreased from 900 µL/min to 800 CH:FLOW_RATE µL/min from 3.2 min to 3.1 min and kept constant until 3.7 min, when flow rate CH:FLOW_RATE was changed to 700 µL/min. CH:SOLVENT_A 95% 10 mM ammonium formate with 0.1% formic acid and 5% acetonitrile CH:SOLVENT_B and 95% acetonitrile with 5% 10 mM ammonium formate with 0.1% formic acid CH:INJECTION_TEMPERATURE 40 °C #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Agilent 6540 QTOF MS:INSTRUMENT_TYPE QTOF MS:MS_TYPE ESI MS:ION_MODE UNSPECIFIED MS:MS_COMMENTS The 6540 QTOF/MS Detector (Agilent) operated in both positive and negative ESI MS:MS_COMMENTS mode in a detection range of 50 to 1700 m/z at 2 GHz in extended dynamic range. MS:MS_COMMENTS The DualAJS ESI source was set to the following parameters: Gas temperature 200 MS:MS_COMMENTS °C, drying gas 8 L/min, nebulizer 35 psig, sheath gas temp: 350 °C, sheath gas MS:MS_COMMENTS flow 11 L/min, VCAp 3500 V and nozzle voltage of 0 V. Online calibration of the MS:MS_COMMENTS instrument was performed throughout the data acquisition using Agilent ES-TOF MS:MS_COMMENTS Reference Mass Solution Kit. Chromatograms were generated by the LC-MS MS:MS_COMMENTS instrument in .d format. Raw data were converted into mzXML and chromatogram MS:MS_COMMENTS peaks were extracted using XCMS v1.42.0 MS:MS_COMMENTS (https://pubs.acs.org/doi/10.1021/ac051437y), which was optimized using the IPO MS:MS_COMMENTS R package MS:MS_COMMENTS (https://bmcbioinformatics.biomedcentral.com/articles/10.1186/s12859-015-0562-8) MS:MS_COMMENTS with the following settings: peakwidth=c(10, 70), ppm= 20, snthresh=10, MS:MS_COMMENTS mzdiff=0.0034, prefilter=c(3, 100), noise=100, gapInit=0.8448, gapExtend=2.0544, MS:MS_COMMENTS bw=5, mzwid=0.015, minfrac=0.5, max=50. All further analyses were performed in R MS:MS_COMMENTS programming language, Metaboanalyst 4.0 MS:MS_COMMENTS (https://www.nature.com/articles/nprot.2011.319), and GraphPad Prism version 5.0 MS:MS_COMMENTS (GraphPad Software). IDEOM software (http://mzmatch.sourceforge.net/ideom.php; MS:MS_COMMENTS https://academic.oup.com/bioinformatics/article/28/7/1048/210126) was used to MS:MS_COMMENTS eliminate noise and for putative peak annotation by exact mass within ±10 ppm MS:MS_COMMENTS against the Metabolomic Discoveries in house metabolite library MS:MS_COMMENTS (https://journals.plos.org/plosone/article?id=10.1371/journal.pone.0125044) in MS:MS_COMMENTS negative and positive ESI mode, respectively. Retention time prediction was MS:MS_COMMENTS applied to aid metabolite annotation. #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS relative abundance MS_METABOLITE_DATA_START Samples 17_41 _t_minus_50 17_41 _t_0 17_41 _t_60 17_41 _t_120 17_41 _t_240 17_41 _t_480 17_42 _t_minus_50 17_42 _t_0 17_42 _t_60 17_42 _t_120 17_42 _t_240 17_42 _t_480 17_36 _t_minus_50 17_36 _t_0 17_36 _t_60 17_36 _t_120 17_36 _t_240 17_36 _t_480 17_35 _t_minus_50 17_35 _t_0 17_35 _t_120 17_35 _t_240 17_40 _t_0 17_40 _t_60 17_40 _t_120 17_40 _t_240 17_40 _t_480 17_14 _t_minus_50 17_14 _t_0 17_14 _t_60 17_14 _t_120 17_14 _t_240 17_14 _t_480 17_23 _t_minus_50 17_23 _t_60 17_23 _t_120 17_23 _t_240 17_23 _t_480 17_33 _t_minus_50 17_33 _t_0 17_33 _t_60 17_33 _t_120 17_33 _t_240 17_33 _t_480 17_02 _t_minus_50 17_02 _t_0 17_02 _t_60 17_02 _t_120 17_02 _t_240 17_02 _t_480 17_27 _t_minus_50 17_27 _t_0 17_27 _t_60 17_27 _t_120 17_27 _t_240 17_27 _t_480 17_21 _t_0 17_21 _t_60 17_21 _t_120 17_21 _t_240 17_21 _t_480 17_01 _t_minus_50 17_01 _t_0 17_01 _t_60 17_01 _t_120 17_01 _t_240 17_01 _t_480 17_34 _t_minus_50 17_34 _t_0 17_34 _t_60 17_34 _t_120 17_34 _t_240 17_34 _t_480 17_29 _t_minus_50 17_29 _t_0 17_29 _t_60 17_29 _t_120 17_29 _t_240 17_29 _t_480 17_05 _t_minus_50 17_05 _t_0 17_05 _t_60 17_05 _t_120 17_05 _t_240 17_05 _t_480 17_20 _t_minus_50 17_20 _t_0 17_20 _t_60 17_20 _t_120 17_20 _t_240 17_20 _t_480 17_13 _t_minus_50 17_13 _t_0 17_13 _t_60 17_13 _t_120 17_13 _t_240 17_13 _t_480 17_22 _t_minus_50 17_22 _t_0 17_22 _t_60 17_22 _t_120 17_22 _t_240 17_22 _t_480 17_30 _t_minus_50 17_30 _t_0 17_30 _t_60 17_30 _t_120 17_30 _t_240 17_30 _t_480 17_10 _t_minus_50 17_10 _t_0 17_10 _t_60 17_10 _t_120 17_10 _t_240 17_10 _t_480 17_15 _t_minus_50 17_15 _t_0 17_15 _t_60 17_15 _t_120 17_15 _t_240 17_15 _t_480 17_08_t_minus_50 17_08_t_0 17_08_t_60 17_08_t_120 17_08_t_240 17_08_t_480 17_03_t_minus_50 17_03_t_0 17_03_t_60 17_03_t_120 17_03_t_240 17_03_t_480 17_09_t_minus_50 17_09_t_0 17_09_t_120 17_09_t_240 17_09_t_480 Factors treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:control treatment:control treatment:control treatment:control treatment:control treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:trained treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control treatment:control Creatinine 0.388 0.366 0.393 0.373 0.390 0.395 0.751 0.699 0.663 0.659 0.653 0.642 0.552 0.508 0.526 0.434 0.462 0.481 0.557 0.508 0.597 0.575 0.613 0.796 0.522 0.496 0.520 0.775 0.698 0.667 0.671 0.666 0.711 0.577 0.506 0.530 0.495 0.501 0.468 0.468 0.507 0.453 0.493 0.439 0.460 0.445 0.418 0.469 0.450 0.450 0.428 0.508 0.415 0.479 0.476 0.489 0.525 0.527 0.558 0.557 0.474 0.519 0.452 0.439 0.508 0.499 0.508 0.601 0.632 0.642 0.607 0.600 0.659 0.570 0.538 0.543 0.507 0.535 0.608 0.500 0.456 0.458 0.451 0.484 0.468 0.547 0.549 0.540 0.496 0.506 0.554 0.742 0.628 0.579 0.606 0.600 0.561 0.392 0.411 0.395 0.392 0.420 0.402 0.377 0.372 0.453 0.455 0.512 0.402 0.490 0.443 0.449 0.492 0.521 0.476 0.337 0.367 0.382 0.408 0.414 0.382 0.515 0.433 0.472 0.612 0.465 0.488 0.627 0.490 0.562 0.591 0.565 0.582 0.650 0.486 0.462 0.518 0.522 Deoxycytidine 0.000 0.000 0.000 0.000 0.014 0.000 0.000 0.000 0.000 0.001 0.010 0.003 0.004 0.014 0.012 0.001 0.018 0.007 0.000 0.028 0.001 0.025 0.000 0.001 0.000 0.000 0.001 0.000 0.030 0.022 0.005 0.003 0.115 0.017 0.129 0.061 0.009 0.026 0.021 0.019 0.050 0.000 0.003 0.007 0.000 0.000 0.000 0.012 0.001 0.002 0.000 0.013 0.006 0.017 0.007 0.016 0.012 0.047 0.037 0.024 0.005 0.014 0.016 0.025 0.030 0.050 0.007 0.004 0.007 0.012 0.008 0.034 0.008 0.011 0.005 0.002 0.026 0.018 0.015 0.003 0.010 0.010 0.000 0.069 0.007 0.016 0.057 0.113 0.032 0.062 0.032 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.006 0.013 0.000 0.000 0.000 0.001 0.013 0.006 0.000 0.030 0.000 0.006 0.013 0.000 0.000 0.030 0.020 0.008 0.023 0.003 0.001 0.002 0.000 0.005 0.018 0.003 0.002 0.004 0.006 0.007 0.004 0.024 0.000 0.000 0.001 0.071 0.003 Leucyl-Proline 0.008 0.005 0.003 0.003 0.006 0.006 0.012 0.010 0.008 0.008 0.009 0.009 0.011 0.010 0.012 0.009 0.008 0.010 0.010 0.009 0.012 0.009 0.012 0.016 0.009 0.007 0.005 0.012 0.008 0.009 0.009 0.007 0.009 0.009 0.007 0.006 0.004 0.005 0.014 0.017 0.016 0.016 0.017 0.015 0.006 0.005 0.003 0.002 0.002 0.003 0.004 0.008 0.005 0.008 0.008 0.006 0.008 0.008 0.010 0.007 0.005 0.004 0.006 0.002 0.008 0.007 0.008 0.009 0.010 0.009 0.010 0.015 0.010 0.009 0.004 0.009 0.007 0.011 0.009 0.009 0.008 0.006 0.007 0.006 0.006 0.009 0.009 0.008 0.007 0.003 0.008 0.014 0.011 0.010 0.011 0.008 0.006 0.006 0.005 0.007 0.004 0.004 0.003 0.001 0.000 0.004 0.002 0.002 0.003 0.008 0.007 0.008 0.010 0.009 0.007 0.003 0.004 0.005 0.006 0.003 0.003 0.009 0.006 0.008 0.012 0.007 0.007 0.006 0.004 0.007 0.004 0.007 0.006 0.012 0.010 0.005 0.008 0.009 Di-2-thienyl disulfide 0.009 0.006 0.006 0.008 0.005 0.007 0.012 0.006 0.016 0.008 0.008 0.008 0.007 0.011 0.010 0.008 0.010 0.012 0.010 0.004 0.007 0.009 0.006 0.009 0.009 0.007 0.012 0.005 0.000 0.005 0.004 0.005 0.000 0.010 0.008 0.007 0.007 0.009 0.006 0.011 0.007 0.008 0.007 0.006 0.012 0.008 0.008 0.007 0.011 0.009 0.007 0.007 0.006 0.005 0.007 0.004 0.008 0.012 0.009 0.009 0.008 0.007 0.006 0.005 0.003 0.005 0.003 0.005 0.010 0.007 0.008 0.007 0.015 0.012 0.007 0.008 0.005 0.001 0.010 0.014 0.007 0.009 0.013 0.009 0.007 0.009 0.009 0.008 0.006 0.008 0.009 0.007 0.008 0.008 0.008 0.009 0.007 0.003 0.003 0.004 0.000 0.004 0.004 0.012 0.012 0.004 0.009 0.008 0.007 0.005 0.008 0.008 0.015 0.009 0.005 0.005 0.003 0.006 0.007 0.006 0.005 0.011 0.009 0.009 0.008 0.012 0.009 0.016 0.009 0.012 0.003 0.008 0.009 0.010 0.010 0.008 0.011 0.004 N(alpha)-t-Butoxycarbonyl-L-leucine 0.003 0.002 0.001 0.000 0.001 0.001 0.003 0.003 0.001 0.003 0.002 0.001 0.002 0.000 0.001 0.000 0.000 0.000 0.007 0.001 0.004 0.003 0.003 0.002 0.001 0.001 0.000 0.009 0.012 0.006 0.013 0.004 0.007 0.000 0.001 0.000 0.001 0.001 0.002 0.001 0.003 0.003 0.001 0.001 0.014 0.004 0.005 0.005 0.003 0.004 0.002 0.001 0.001 0.001 0.000 0.002 0.004 0.001 0.001 0.001 0.004 0.004 0.001 0.000 0.000 0.001 0.000 0.005 0.009 0.002 0.004 0.002 0.001 0.006 0.004 0.003 0.003 0.003 0.003 0.001 0.001 0.000 0.001 0.002 0.001 0.005 0.004 0.002 0.001 0.000 0.002 0.004 0.002 0.000 0.000 0.000 0.002 0.003 0.001 0.001 0.002 0.003 0.002 0.000 0.002 0.000 0.001 0.003 0.004 0.001 0.002 0.002 0.003 0.002 0.000 0.000 0.000 0.000 0.002 0.001 0.000 0.000 0.000 0.000 0.002 0.001 0.000 0.008 0.004 0.004 0.004 0.007 0.003 0.001 0.001 0.001 0.000 0.004 Chinomethionat 0.002 0.002 0.000 0.001 0.002 0.000 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.000 0.000 0.001 0.001 0.003 0.000 0.001 0.001 0.003 0.000 0.001 0.001 0.000 0.002 0.000 0.002 0.000 0.000 0.002 0.000 0.000 0.001 0.000 0.001 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.003 0.001 0.000 0.002 0.002 0.003 0.000 0.000 0.001 0.001 0.000 0.001 0.001 0.000 0.000 0.000 0.001 0.002 0.000 0.002 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.001 0.002 0.000 0.002 0.004 0.002 0.000 0.000 0.001 0.001 0.003 0.000 0.000 0.001 0.001 0.001 0.000 0.003 0.001 0.001 0.002 0.001 0.001 0.002 0.001 0.000 0.001 0.002 0.001 0.000 0.002 0.002 0.001 0.000 0.001 0.001 0.000 0.002 0.000 0.002 0.001 0.001 0.000 0.003 0.000 0.001 0.001 0.000 0.001 0.002 0.001 0.000 0.000 0.000 0.000 0.002 0.000 0.002 0.000 0.002 0.001 0.001 0.000 0.000 0.001 0.000 (2Z,4'Z)-2-(5-Methylthio-4-penten-2-ynylidene)-1,6-dioxaspiro[4.4]non-3-ene 0.003 0.003 0.003 0.003 0.006 0.003 0.003 0.004 0.002 0.002 0.003 0.003 0.003 0.003 0.003 0.002 0.007 0.004 0.003 0.004 0.002 0.007 0.003 0.004 0.002 0.004 0.004 0.003 0.003 0.004 0.003 0.005 0.003 0.004 0.003 0.003 0.003 0.003 0.004 0.003 0.003 0.003 0.003 0.004 0.004 0.003 0.003 0.003 0.003 0.003 0.003 0.003 0.003 0.003 0.005 0.002 0.003 0.003 0.002 0.008 0.001 0.002 0.002 0.003 0.004 0.006 0.003 0.003 0.004 0.003 0.002 0.009 0.004 0.003 0.003 0.003 0.003 0.004 0.004 0.004 0.002 0.003 0.002 0.007 0.004 0.003 0.004 0.007 0.004 0.007 0.003 0.005 0.003 0.002 0.002 0.003 0.004 0.003 0.004 0.003 0.003 0.004 0.005 0.004 0.003 0.004 0.004 0.006 0.007 0.003 0.004 0.003 0.006 0.010 0.003 0.003 0.004 0.003 0.003 0.009 0.003 0.002 0.002 0.004 0.004 0.006 0.003 0.002 0.002 0.003 0.002 0.002 0.004 0.003 0.002 0.004 0.008 0.003 Acetic acid 0.023 0.027 0.022 0.019 0.044 0.020 0.021 0.023 0.025 0.018 0.022 0.022 0.021 0.019 0.021 0.022 0.036 0.030 0.020 0.016 0.023 0.048 0.014 0.025 0.023 0.022 0.027 0.027 0.020 0.036 0.018 0.042 0.015 0.025 0.023 0.016 0.022 0.023 0.036 0.028 0.026 0.023 0.034 0.022 0.024 0.017 0.017 0.017 0.024 0.024 0.018 0.021 0.020 0.023 0.037 0.024 0.020 0.025 0.020 0.046 0.019 0.022 0.019 0.028 0.016 0.038 0.019 0.019 0.021 0.025 0.020 0.051 0.023 0.024 0.019 0.029 0.025 0.022 0.019 0.026 0.016 0.023 0.025 0.046 0.023 0.022 0.020 0.027 0.015 0.054 0.016 0.028 0.020 0.020 0.032 0.017 0.027 0.021 0.034 0.036 0.024 0.025 0.040 0.027 0.029 0.012 0.021 0.035 0.042 0.022 0.022 0.035 0.023 0.062 0.023 0.021 0.015 0.021 0.016 0.061 0.019 0.025 0.024 0.029 0.024 0.031 0.027 0.017 0.010 0.020 0.007 0.030 0.032 0.023 0.026 0.036 0.056 0.011 Urea 0.220 0.228 0.233 0.180 0.141 0.141 0.203 0.185 0.187 0.224 0.211 0.131 0.243 0.225 0.260 0.236 0.188 0.225 0.201 0.197 0.273 0.210 0.221 0.203 0.139 0.126 0.189 0.221 0.186 0.225 0.215 0.170 0.137 0.174 0.131 0.165 0.142 0.198 0.250 0.169 0.196 0.231 0.208 0.155 0.275 0.264 0.200 0.213 0.207 0.199 0.171 0.142 0.139 0.130 0.175 0.145 0.214 0.235 0.219 0.234 0.161 0.211 0.147 0.140 0.210 0.144 0.132 0.313 0.277 0.243 0.210 0.251 0.267 0.148 0.215 0.202 0.136 0.167 0.164 0.250 0.277 0.251 0.197 0.189 0.161 0.220 0.207 0.190 0.183 0.196 0.124 0.318 0.282 0.255 0.276 0.292 0.202 0.145 0.136 0.161 0.136 0.206 0.190 0.235 0.239 0.184 0.191 0.188 0.244 0.295 0.285 0.248 0.244 0.300 0.207 0.164 0.136 0.143 0.211 0.129 0.155 0.197 0.171 0.169 0.182 0.162 0.167 0.225 0.240 0.199 0.174 0.184 0.223 0.299 0.172 0.169 0.155 0.212 Diphenylcarbazide 0.039 0.001 0.040 0.001 0.027 0.037 0.032 0.025 0.045 0.028 0.001 0.017 0.014 0.024 0.053 0.026 0.021 0.037 0.008 0.001 0.001 0.029 0.001 0.038 0.027 0.001 0.032 0.023 0.002 0.001 0.001 0.020 0.001 0.049 0.001 0.001 0.001 0.012 0.001 0.001 0.013 0.001 0.030 0.001 0.055 0.041 0.003 0.034 0.048 0.008 0.009 0.029 0.009 0.025 0.027 0.004 0.001 0.027 0.021 0.026 0.020 0.040 0.046 0.036 0.001 0.015 0.001 0.001 0.023 0.023 0.001 0.026 0.015 0.011 0.014 0.057 0.024 0.014 0.016 0.016 0.001 0.017 0.021 0.009 0.001 0.001 0.001 0.004 0.001 0.024 0.020 0.011 0.017 0.014 0.008 0.005 0.031 0.001 0.022 0.017 0.020 0.054 0.001 0.045 0.033 0.001 0.034 0.001 0.008 0.001 0.019 0.001 0.001 0.001 0.001 0.047 0.001 0.062 0.028 0.034 0.025 0.001 0.012 0.027 0.028 0.032 0.004 0.001 0.001 0.011 0.001 0.001 0.005 0.007 0.006 0.001 0.020 0.001 Prolyl-Gamma-glutamate 0.026 0.023 0.033 0.023 0.044 0.025 0.026 0.018 0.030 0.020 0.020 0.026 0.026 0.020 0.023 0.020 0.046 0.029 0.027 0.016 0.020 0.034 0.014 0.022 0.022 0.018 0.040 0.028 0.026 0.031 0.024 0.045 0.002 0.031 0.021 0.014 0.022 0.029 0.040 0.027 0.025 0.027 0.036 0.030 0.024 0.019 0.016 0.022 0.031 0.023 0.025 0.029 0.022 0.027 0.037 0.031 0.021 0.026 0.019 0.059 0.021 0.023 0.026 0.024 0.008 0.033 0.019 0.023 0.020 0.021 0.024 0.057 0.023 0.030 0.024 0.030 0.025 0.021 0.021 0.028 0.017 0.029 0.021 0.038 0.024 0.014 0.025 0.026 0.020 0.050 0.023 0.028 0.022 0.021 0.024 0.020 0.031 0.027 0.038 0.030 0.026 0.027 0.042 0.034 0.027 0.015 0.022 0.033 0.043 0.027 0.031 0.032 0.027 0.075 0.023 0.026 0.012 0.025 0.016 0.058 0.022 0.028 0.021 0.029 0.022 0.036 0.025 0.026 0.016 0.027 0.011 0.038 0.040 0.027 0.031 0.040 0.063 0.008 Lenticin 0.000 0.000 0.000 0.000 0.000 0.000 0.008 0.007 0.008 0.009 0.007 0.006 0.016 0.015 0.013 0.014 0.014 0.017 0.006 0.005 0.005 0.006 0.015 0.018 0.012 0.011 0.011 0.003 0.002 0.002 0.002 0.002 0.002 0.006 0.004 0.003 0.002 0.002 0.004 0.003 0.003 0.003 0.002 0.003 0.014 0.012 0.012 0.012 0.014 0.011 0.006 0.004 0.003 0.005 0.005 0.004 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.010 0.010 0.011 0.009 0.009 0.010 0.004 0.001 0.002 0.002 0.002 0.003 0.019 0.017 0.017 0.016 0.018 0.017 0.009 0.008 0.008 0.018 0.008 0.009 0.016 0.013 0.012 0.010 0.013 0.012 0.014 0.015 0.014 0.013 0.016 0.014 0.000 0.000 0.001 0.000 0.000 0.000 0.007 0.006 0.007 0.007 0.008 0.007 0.009 0.010 0.009 0.009 0.008 0.009 0.005 0.002 0.002 0.005 0.003 0.004 0.008 0.007 0.006 0.006 0.007 0.008 0.016 0.013 0.013 0.013 0.014 2,3-Butanediol glucoside 0.000 0.001 0.001 0.001 0.001 0.001 0.003 0.003 0.002 0.002 0.002 0.002 0.002 0.001 0.000 0.002 0.001 0.001 0.002 0.001 0.002 0.002 0.003 0.003 0.001 0.002 0.001 0.003 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.002 0.001 0.001 0.003 0.003 0.001 0.001 0.002 0.002 0.002 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.003 0.002 0.002 0.002 0.002 0.001 0.001 0.000 0.000 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.000 0.000 0.000 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.000 0.001 0.001 0.001 0.002 0.001 0.001 0.002 0.000 0.001 0.002 0.002 5-Aminopentanoic acid 0.104 0.113 0.112 0.105 0.092 0.086 0.074 0.068 0.083 0.086 0.070 0.050 0.125 0.110 0.126 0.097 0.092 0.088 0.087 0.079 0.075 0.059 0.121 0.115 0.097 0.106 0.099 0.097 0.095 0.077 0.075 0.065 0.058 0.098 0.094 0.103 0.088 0.093 0.087 0.089 0.067 0.079 0.085 0.059 0.098 0.103 0.103 0.112 0.089 0.082 0.072 0.107 0.076 0.080 0.079 0.067 0.109 0.105 0.092 0.078 0.097 0.082 0.058 0.078 0.081 0.075 0.054 0.110 0.111 0.099 0.081 0.111 0.095 0.084 0.076 0.089 0.066 0.073 0.065 0.109 0.113 0.102 0.083 0.090 0.084 0.048 0.091 0.085 0.087 0.080 0.067 0.132 0.116 0.109 0.128 0.128 0.132 0.126 0.125 0.129 0.140 0.145 0.140 0.109 0.115 0.125 0.140 0.129 0.112 0.122 0.128 0.120 0.136 0.130 0.123 0.093 0.116 0.105 0.116 0.117 0.117 0.100 0.099 0.124 0.118 0.113 0.097 0.106 0.099 0.107 0.110 0.116 0.100 0.096 0.102 0.112 0.111 0.112 Glycerophosphocholine 0.007 0.004 0.006 0.005 0.005 0.005 0.007 0.004 0.003 0.004 0.003 0.002 0.006 0.004 0.006 0.003 0.004 0.004 0.006 0.004 0.006 0.007 0.006 0.010 0.006 0.004 0.004 0.005 0.003 0.004 0.004 0.004 0.006 0.006 0.000 0.003 0.003 0.003 0.002 0.002 0.002 0.002 0.001 0.002 0.004 0.003 0.004 0.004 0.002 0.001 0.004 0.005 0.004 0.004 0.004 0.004 0.004 0.004 0.003 0.004 0.003 0.006 0.005 0.005 0.005 0.005 0.005 0.005 0.004 0.005 0.003 0.003 0.003 0.008 0.006 0.007 0.005 0.005 0.005 0.006 0.004 0.004 0.004 0.004 0.005 0.007 0.007 0.006 0.007 0.007 0.006 0.004 0.003 0.001 0.002 0.001 0.001 0.002 0.003 0.003 0.003 0.003 0.002 0.004 0.003 0.005 0.003 0.003 0.002 0.004 0.002 0.003 0.002 0.004 0.003 0.004 0.003 0.003 0.003 0.003 0.003 0.004 0.003 0.003 0.006 0.004 0.003 0.007 0.003 0.004 0.003 0.002 0.003 0.006 0.005 0.003 0.004 0.004 6-Phosphonoglucono-D-lactone 0.002 0.002 0.006 0.003 0.011 0.003 0.001 0.002 0.003 0.005 0.006 0.005 0.006 0.010 0.006 0.007 0.009 0.004 0.005 0.010 0.004 0.011 0.004 0.003 0.002 0.002 0.005 0.002 0.011 0.010 0.008 0.006 0.007 0.011 0.020 0.013 0.005 0.013 0.010 0.009 0.017 0.002 0.006 0.010 0.000 0.001 0.002 0.008 0.005 0.005 0.003 0.011 0.006 0.009 0.007 0.011 0.007 0.014 0.014 0.015 0.007 0.008 0.012 0.011 0.008 0.018 0.006 0.006 0.005 0.009 0.008 0.012 0.007 0.007 0.006 0.004 0.011 0.010 0.010 0.004 0.007 0.006 0.004 0.020 0.006 0.008 0.020 0.026 0.011 0.017 0.012 0.000 0.002 0.001 0.006 0.003 0.001 0.002 0.002 0.001 0.004 0.006 0.009 0.003 0.002 0.000 0.003 0.005 0.006 0.000 0.011 0.003 0.009 0.008 0.003 0.004 0.009 0.012 0.008 0.010 0.007 0.006 0.003 0.003 0.006 0.013 0.008 0.004 0.003 0.004 0.005 0.005 0.008 0.002 0.003 0.005 0.017 0.003 Imidazoleacetic acid riboside 0.009 0.010 0.013 0.010 0.018 0.009 0.011 0.010 0.012 0.010 0.009 0.009 0.013 0.009 0.009 0.010 0.018 0.012 0.010 0.007 0.010 0.017 0.009 0.011 0.010 0.011 0.016 0.010 0.011 0.014 0.012 0.018 0.002 0.010 0.012 0.006 0.012 0.013 0.013 0.012 0.010 0.009 0.013 0.016 0.010 0.007 0.009 0.011 0.014 0.009 0.012 0.012 0.010 0.010 0.019 0.015 0.010 0.011 0.008 0.020 0.007 0.007 0.011 0.010 0.005 0.018 0.006 0.008 0.010 0.006 0.010 0.021 0.010 0.010 0.009 0.012 0.008 0.010 0.009 0.012 0.007 0.010 0.008 0.019 0.011 0.008 0.013 0.011 0.009 0.023 0.011 0.008 0.010 0.008 0.012 0.009 0.015 0.010 0.015 0.012 0.011 0.014 0.017 0.013 0.012 0.005 0.010 0.016 0.017 0.010 0.015 0.014 0.015 0.026 0.011 0.010 0.004 0.011 0.007 0.021 0.009 0.011 0.011 0.011 0.011 0.016 0.009 0.011 0.008 0.011 0.006 0.013 0.015 0.009 0.014 0.014 0.019 0.004 Methyl 3-hydroxybutyrate 0.058 0.026 0.046 0.033 0.038 0.035 0.028 0.040 0.032 0.026 0.026 0.027 0.054 0.066 0.061 0.054 0.043 0.060 0.027 0.021 0.031 0.049 0.019 0.027 0.021 0.014 0.019 0.032 0.024 0.030 0.022 0.034 0.058 0.036 0.044 0.035 0.034 0.029 0.010 0.017 0.024 0.012 0.020 0.013 0.033 0.033 0.047 0.045 0.046 0.033 0.019 0.024 0.015 0.019 0.020 0.021 0.020 0.045 0.030 0.026 0.022 0.026 0.032 0.030 0.022 0.028 0.018 0.023 0.022 0.033 0.034 0.036 0.034 0.028 0.017 0.024 0.030 0.021 0.022 0.034 0.037 0.026 0.024 0.024 0.021 0.063 0.064 0.069 0.074 0.056 0.057 0.023 0.027 0.019 0.017 0.022 0.034 0.014 0.016 0.015 0.015 0.014 0.016 0.028 0.028 0.008 0.036 0.045 0.049 0.019 0.018 0.022 0.019 0.022 0.010 0.019 0.010 0.019 0.021 0.004 0.023 0.019 0.019 0.017 0.026 0.024 0.022 0.029 0.024 0.083 0.025 0.033 0.030 0.043 0.048 0.047 0.055 0.045 Diisopropyl sulfide 0.036 0.039 0.036 0.025 0.025 0.038 0.034 0.024 0.006 0.003 0.001 0.001 0.031 0.030 0.034 0.010 0.012 0.039 0.022 0.035 0.007 0.025 0.043 0.067 0.059 0.022 0.037 0.024 0.041 0.010 0.001 0.010 0.001 0.026 0.062 0.011 0.004 0.034 0.004 0.050 0.055 0.001 0.020 0.016 0.021 0.013 0.022 0.014 0.003 0.011 0.001 0.025 0.009 0.001 0.001 0.008 0.037 0.001 0.038 0.028 0.033 0.018 0.022 0.006 0.002 0.001 0.001 0.031 0.042 0.033 0.012 0.024 0.029 0.029 0.015 0.020 0.017 0.001 0.015 0.041 0.017 0.019 0.007 0.066 0.018 0.013 0.055 0.001 0.004 0.012 0.019 0.066 0.053 0.012 0.049 0.043 0.023 0.050 0.056 0.047 0.036 0.036 0.059 0.029 0.066 0.049 0.042 0.030 0.023 0.043 0.025 0.030 0.037 0.033 0.044 0.004 0.037 0.060 0.035 0.029 0.037 0.005 0.013 0.021 0.026 0.016 0.027 0.030 0.015 0.025 0.016 0.015 0.033 0.039 0.031 0.021 0.059 0.044 5,8-Dihydro-6-(4-methyl-3-pentenyl)-1,2,3,4-tetrathiocin 0.004 0.003 0.004 0.003 0.004 0.003 0.003 0.003 0.002 0.003 0.004 0.003 0.004 0.003 0.004 0.003 0.004 0.004 0.003 0.003 0.003 0.004 0.003 0.004 0.003 0.004 0.004 0.004 0.004 0.004 0.004 0.004 0.003 0.003 0.003 0.003 0.003 0.004 0.005 0.003 0.004 0.004 0.004 0.003 0.003 0.003 0.003 0.003 0.004 0.003 0.003 0.004 0.003 0.003 0.004 0.004 0.003 0.003 0.003 0.005 0.003 0.003 0.003 0.003 0.003 0.005 0.003 0.004 0.002 0.003 0.003 0.005 0.004 0.003 0.003 0.004 0.004 0.004 0.003 0.003 0.003 0.003 0.003 0.004 0.003 0.003 0.004 0.005 0.004 0.005 0.003 0.004 0.003 0.003 0.004 0.004 0.005 0.003 0.004 0.004 0.004 0.004 0.005 0.003 0.003 0.003 0.003 0.005 0.004 0.003 0.004 0.004 0.004 0.006 0.004 0.003 0.004 0.003 0.003 0.006 0.003 0.003 0.003 0.003 0.004 0.004 0.003 0.004 0.003 0.003 0.003 0.004 0.004 0.003 0.003 0.004 0.006 0.004 5'-Dehydroadenosine 0.538 0.477 0.534 0.429 1.023 0.442 0.540 0.425 0.508 0.439 0.397 0.543 0.609 0.431 0.491 0.413 0.849 0.604 0.511 0.350 0.405 0.873 0.346 0.509 0.449 0.406 0.674 0.612 0.549 0.637 0.488 0.857 0.108 0.599 0.421 0.281 0.555 0.619 0.780 0.501 0.544 0.502 0.763 0.597 0.495 0.449 0.384 0.501 0.688 0.493 0.564 0.518 0.467 0.532 0.774 0.655 0.428 0.495 0.422 1.117 0.398 0.496 0.507 0.552 0.202 0.984 0.382 0.479 0.412 0.491 0.448 1.059 0.573 0.550 0.487 0.608 0.507 0.486 0.471 0.568 0.432 0.530 0.468 0.989 0.565 0.396 0.559 0.553 0.396 1.103 0.493 0.485 0.475 0.394 0.545 0.401 0.615 0.583 0.892 0.565 0.468 0.555 0.877 0.587 0.576 0.332 0.493 0.810 0.915 0.560 0.574 0.706 0.612 1.412 0.547 0.511 0.281 0.493 0.383 1.337 0.500 0.651 0.500 0.554 0.509 0.784 0.551 0.459 0.320 0.517 0.286 0.751 0.839 0.520 0.695 0.706 1.199 0.247 Adenosine 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid 0.010 0.013 0.015 0.009 0.053 0.009 0.017 0.005 0.017 0.009 0.020 0.013 0.026 0.024 0.024 0.011 0.055 0.017 0.016 0.030 0.018 0.094 0.011 0.029 0.019 0.013 0.023 0.017 0.023 0.035 0.013 0.039 0.028 0.037 0.094 0.032 0.023 0.038 0.075 0.034 0.049 0.012 0.020 0.026 0.015 0.008 0.005 0.020 0.019 0.015 0.024 0.025 0.020 0.025 0.036 0.033 0.016 0.033 0.034 0.089 0.014 0.028 0.027 0.032 0.021 0.095 0.022 0.019 0.018 0.031 0.023 0.085 0.029 0.031 0.021 0.020 0.040 0.034 0.021 0.020 0.028 0.024 0.017 0.138 0.029 0.029 0.051 0.082 0.031 0.125 0.042 0.013 0.016 0.006 0.018 0.011 0.013 0.016 0.026 0.015 0.008 0.028 0.043 0.019 0.014 0.007 0.018 0.048 0.040 0.017 0.030 0.025 0.020 0.104 0.020 0.016 0.022 0.033 0.015 0.088 0.019 0.017 0.022 0.014 0.021 0.055 0.024 0.019 0.010 0.022 0.016 0.026 0.055 0.012 0.017 0.020 0.128 0.010 Di-2-propenyl hexasulfide 0.016 0.015 0.019 0.014 0.016 0.007 0.013 0.012 0.017 0.020 0.014 0.014 0.017 0.015 0.019 0.017 0.012 0.016 0.010 0.010 0.010 0.014 0.018 0.019 0.016 0.018 0.017 0.015 0.019 0.017 0.013 0.011 0.007 0.016 0.011 0.014 0.016 0.014 0.010 0.011 0.013 0.012 0.018 0.017 0.014 0.015 0.015 0.015 0.015 0.015 0.013 0.015 0.012 0.013 0.020 0.015 0.014 0.012 0.012 0.014 0.015 0.017 0.011 0.019 0.012 0.017 0.012 0.014 0.011 0.019 0.015 0.016 0.015 0.014 0.014 0.018 0.013 0.014 0.019 0.013 0.011 0.013 0.013 0.016 0.013 0.012 0.018 0.017 0.017 0.014 0.016 0.016 0.013 0.008 0.015 0.015 0.016 0.015 0.018 0.017 0.017 0.016 0.015 0.013 0.017 0.005 0.015 0.016 0.011 0.013 0.017 0.016 0.018 0.011 0.015 0.013 0.013 0.016 0.020 0.017 0.019 0.014 0.012 0.017 0.019 0.014 0.012 0.014 0.016 0.012 0.013 0.011 0.016 0.013 0.013 0.015 0.013 0.020 N-(2-formyl-3-chlorophenyl)anthranilic acid 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 5-(4-Acetoxy-1-butynyl)-2,2'-bithiophene 0.002 0.001 0.001 0.002 0.002 0.000 0.002 0.003 0.002 0.002 0.002 0.002 0.003 0.001 0.001 0.000 0.000 0.002 0.000 0.001 0.000 0.002 0.002 0.004 0.002 0.001 0.003 0.002 0.001 0.001 0.001 0.001 0.002 0.003 0.001 0.001 0.001 0.004 0.002 0.002 0.001 0.001 0.002 0.001 0.002 0.003 0.004 0.003 0.000 0.001 0.005 0.001 0.000 0.002 0.002 0.003 0.001 0.001 0.001 0.002 0.001 0.003 0.002 0.003 0.002 0.000 0.002 0.002 0.001 0.002 0.000 0.000 0.000 0.001 0.001 0.004 0.002 0.002 0.003 0.001 0.002 0.000 0.001 0.003 0.002 0.002 0.001 0.000 0.001 0.003 0.001 0.003 0.002 0.001 0.001 0.000 0.000 0.002 0.006 0.004 0.003 0.003 0.003 0.002 0.002 0.000 0.001 0.001 0.001 0.003 0.002 0.002 0.001 0.002 0.002 0.003 0.002 0.004 0.001 0.002 0.005 0.003 0.001 0.003 0.004 0.001 0.003 0.003 0.002 0.002 0.001 0.003 0.002 0.001 0.004 0.001 0.001 0.003 hexane-6-keto-1,3,4,6-tetracarboxylate 0.001 0.000 0.003 0.003 0.004 0.000 0.001 0.000 0.000 0.004 0.003 0.002 0.001 0.004 0.001 0.002 0.005 0.002 0.003 0.008 0.001 0.005 0.000 0.000 0.001 0.000 0.002 0.000 0.008 0.007 0.002 0.003 0.006 0.004 0.016 0.007 0.002 0.005 0.005 0.008 0.011 0.001 0.003 0.002 0.001 0.002 0.001 0.004 0.003 0.001 0.000 0.005 0.006 0.005 0.003 0.007 0.003 0.007 0.009 0.008 0.004 0.003 0.005 0.011 0.005 0.012 0.002 0.001 0.005 0.005 0.003 0.010 0.003 0.002 0.001 0.002 0.007 0.006 0.005 0.004 0.005 0.003 0.002 0.010 0.002 0.004 0.009 0.018 0.009 0.006 0.007 0.001 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.001 0.000 0.002 0.005 0.001 0.002 0.001 0.001 0.004 0.004 0.000 0.005 0.002 0.002 0.003 0.001 0.001 0.005 0.007 0.005 0.004 0.004 0.003 0.002 0.001 0.002 0.006 0.004 0.002 0.002 0.005 0.004 0.001 0.006 0.000 0.002 0.001 0.011 0.002 Ranunculin 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.001 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.002 0.000 0.001 0.000 0.002 0.000 0.000 0.000 0.000 0.004 0.000 0.000 0.000 0.000 0.001 0.004 0.001 0.000 0.000 0.000 0.004 0.001 0.000 0.000 0.000 0.000 0.001 0.002 0.000 0.001 0.000 0.000 0.001 0.002 0.004 0.001 0.001 0.000 0.001 0.000 0.000 0.000 0.000 0.003 0.002 0.000 0.002 0.002 0.001 0.003 0.002 0.002 0.001 0.001 0.001 0.003 0.001 0.000 0.000 0.000 0.002 0.001 0.000 0.000 0.000 0.000 0.000 0.002 0.002 0.000 0.001 0.001 0.002 0.002 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.002 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.001 0.001 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.001 1-Pyrrolinium 0.255 0.235 0.246 0.213 0.337 0.244 0.151 0.139 0.132 0.124 0.105 0.072 0.153 0.161 0.166 0.114 0.170 0.168 0.327 0.304 0.258 0.350 0.198 0.252 0.163 0.163 0.186 0.158 0.157 0.137 0.110 0.175 0.268 0.278 0.270 0.222 0.163 0.327 0.125 0.139 0.138 0.102 0.101 0.182 0.171 0.169 0.156 0.135 0.095 0.116 0.278 0.343 0.294 0.262 0.324 0.375 0.300 0.275 0.253 0.274 0.263 0.291 0.272 0.232 0.218 0.249 0.269 0.269 0.291 0.291 0.233 0.256 0.250 0.191 0.186 0.189 0.166 0.141 0.171 0.218 0.208 0.184 0.145 0.256 0.251 0.186 0.206 0.192 0.140 0.177 0.178 0.139 0.126 0.111 0.097 0.080 0.085 0.194 0.201 0.179 0.161 0.135 0.196 0.720 0.628 0.716 0.641 0.558 0.657 0.164 0.149 0.135 0.129 0.243 0.185 0.409 0.424 0.456 0.362 0.372 0.337 0.151 0.140 0.150 0.184 0.168 0.162 0.150 0.124 0.139 0.130 0.106 0.224 0.116 0.101 0.080 0.235 0.147 3'-O-Methyladenosine 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.002 0.002 0.002 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.003 0.002 0.002 0.002 0.002 0.001 0.001 0.002 0.002 0.001 0.002 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.002 0.001 0.001 0.002 0.001 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.001 0.002 0.002 0.001 0.002 0.002 0.001 0.002 0.001 0.001 0.001 0.002 0.001 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.001 0.002 0.001 0.002 0.001 0.002 0.001 0.002 0.001 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.002 0.002 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.002 0.002 Probenecid 0.004 0.005 0.006 0.003 0.007 0.001 0.004 0.003 0.002 0.001 0.004 0.001 0.005 0.002 0.004 0.001 0.005 0.004 0.005 0.001 0.002 0.007 0.004 0.007 0.005 0.000 0.006 0.004 0.004 0.003 0.001 0.004 0.000 0.004 0.004 0.001 0.002 0.002 0.003 0.001 0.001 0.001 0.003 0.001 0.003 0.003 0.004 0.005 0.003 0.002 0.009 0.008 0.005 0.006 0.009 0.011 0.001 0.000 0.001 0.004 0.002 0.004 0.003 0.004 0.002 0.005 0.002 0.002 0.002 0.005 0.002 0.007 0.002 0.006 0.003 0.007 0.005 0.005 0.003 0.004 0.007 0.003 0.002 0.004 0.005 0.003 0.003 0.000 0.002 0.007 0.003 0.005 0.005 0.000 0.001 0.000 0.001 0.003 0.012 0.006 0.003 0.005 0.006 0.006 0.006 0.000 0.003 0.004 0.004 0.006 0.005 0.004 0.003 0.011 0.004 0.007 0.005 0.006 0.004 0.012 0.006 0.007 0.006 0.006 0.004 0.004 0.004 0.003 0.004 0.006 0.003 0.005 0.012 0.005 0.009 0.008 0.006 0.002 1,6-Naphthalenedisulfonic acid 0.005 0.003 0.005 0.006 0.011 0.005 0.002 0.004 0.004 0.006 0.007 0.006 0.007 0.011 0.011 0.008 0.014 0.010 0.005 0.012 0.004 0.012 0.005 0.006 0.007 0.004 0.008 0.004 0.012 0.014 0.008 0.008 0.008 0.012 0.022 0.017 0.008 0.011 0.013 0.012 0.018 0.006 0.006 0.009 0.005 0.004 0.005 0.011 0.008 0.005 0.006 0.010 0.007 0.009 0.008 0.010 0.008 0.016 0.014 0.014 0.010 0.008 0.013 0.012 0.009 0.015 0.007 0.008 0.005 0.008 0.008 0.014 0.008 0.009 0.006 0.005 0.013 0.012 0.010 0.005 0.007 0.010 0.005 0.022 0.005 0.008 0.020 0.024 0.015 0.018 0.012 0.004 0.003 0.004 0.007 0.005 0.003 0.006 0.003 0.004 0.003 0.007 0.011 0.006 0.005 0.002 0.006 0.009 0.009 0.003 0.015 0.005 0.006 0.008 0.003 0.005 0.011 0.010 0.007 0.008 0.006 0.005 0.004 0.004 0.007 0.011 0.008 0.007 0.006 0.006 0.007 0.007 0.010 0.006 0.004 0.006 0.018 0.005 Pyrrolidine 0.006 0.006 0.005 0.005 0.007 0.005 0.006 0.004 0.006 0.006 0.005 0.002 0.005 0.005 0.004 0.003 0.004 0.003 0.007 0.007 0.006 0.007 0.005 0.007 0.004 0.006 0.004 0.005 0.005 0.004 0.004 0.006 0.005 0.004 0.003 0.003 0.002 0.003 0.004 0.004 0.004 0.004 0.004 0.003 0.007 0.006 0.006 0.005 0.004 0.005 0.004 0.005 0.004 0.003 0.005 0.004 0.005 0.003 0.003 0.003 0.003 0.005 0.003 0.003 0.004 0.004 0.002 0.007 0.006 0.006 0.004 0.005 0.004 0.006 0.006 0.005 0.004 0.003 0.004 0.006 0.005 0.005 0.004 0.005 0.004 0.004 0.005 0.004 0.002 0.003 0.003 0.005 0.005 0.004 0.005 0.004 0.005 0.003 0.004 0.003 0.003 0.003 0.002 0.004 0.004 0.004 0.005 0.006 0.004 0.004 0.004 0.003 0.006 0.005 0.003 0.005 0.005 0.004 0.003 0.002 0.002 0.004 0.005 0.005 0.005 0.005 0.004 0.005 0.004 0.005 0.005 0.005 0.004 0.005 0.005 0.004 0.007 0.004 D-Sedoheptulose 7-phosphate 0.002 0.001 0.001 0.002 0.003 0.003 0.006 0.006 0.003 0.003 0.003 0.004 0.002 0.003 0.002 0.002 0.002 0.003 0.003 0.003 0.004 0.004 0.004 0.005 0.004 0.002 0.002 0.004 0.004 0.004 0.004 0.005 0.005 0.003 0.004 0.002 0.002 0.002 0.002 0.003 0.003 0.002 0.003 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.003 0.002 0.002 0.003 0.002 0.002 0.003 0.003 0.004 0.003 0.002 0.002 0.003 0.002 0.002 0.003 0.004 0.003 0.004 0.004 0.004 0.003 0.004 0.003 0.003 0.002 0.003 0.003 0.003 0.003 0.003 0.002 0.003 0.003 0.002 0.003 0.002 0.003 0.002 0.002 0.003 0.004 0.003 0.003 0.002 0.003 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.003 0.003 0.002 0.002 0.002 0.002 0.002 0.001 0.003 0.002 0.002 0.002 0.002 0.001 0.001 0.002 0.002 0.003 0.002 0.003 0.002 0.003 0.003 0.002 0.003 0.003 0.003 0.003 0.003 0.003 0.002 0.003 0.002 1-Octen-3-yl glucoside 0.035 0.067 0.062 0.000 0.038 0.017 0.050 0.021 0.019 0.014 0.000 0.010 0.020 0.000 0.031 0.033 0.021 0.035 0.033 0.000 0.020 0.042 0.012 0.055 0.017 0.005 0.029 0.028 0.000 0.023 0.000 0.043 0.000 0.024 0.021 0.000 0.002 0.026 0.000 0.011 0.021 0.004 0.014 0.012 0.037 0.027 0.000 0.038 0.051 0.005 0.008 0.010 0.000 0.009 0.018 0.001 0.002 0.000 0.011 0.019 0.005 0.017 0.049 0.041 0.000 0.015 0.000 0.035 0.009 0.000 0.028 0.016 0.010 0.032 0.032 0.027 0.000 0.000 0.008 0.023 0.000 0.019 0.018 0.037 0.000 0.008 0.000 0.007 0.005 0.017 0.028 0.019 0.014 0.000 0.017 0.004 0.038 0.021 0.016 0.039 0.025 0.059 0.016 0.041 0.032 0.000 0.058 0.000 0.010 0.000 0.025 0.000 0.000 0.000 0.000 0.000 0.000 0.026 0.015 0.018 0.034 0.021 0.030 0.000 0.024 0.030 0.018 0.019 0.000 0.011 0.000 0.000 0.000 0.000 0.028 0.007 0.015 0.000 5-Hexyltetrahydro-2-furanoctanoic acid 0.107 0.247 0.130 0.051 0.064 0.003 0.084 0.044 0.099 0.091 0.054 0.060 0.245 0.199 0.258 0.171 0.141 0.247 0.036 0.001 0.018 0.009 0.135 0.206 0.110 0.117 0.145 0.079 0.104 0.074 0.022 0.023 0.001 0.055 0.001 0.069 0.057 0.031 0.061 0.057 0.059 0.043 0.066 0.100 0.055 0.109 0.061 0.092 0.041 0.047 0.110 0.139 0.106 0.159 0.138 0.137 0.080 0.112 0.040 0.089 0.056 0.103 0.034 0.092 0.013 0.115 0.044 0.099 0.104 0.155 0.066 0.117 0.151 0.078 0.073 0.057 0.020 0.030 0.031 0.054 0.001 0.091 0.047 0.057 0.044 0.075 0.104 0.140 0.075 0.129 0.076 0.186 0.050 0.086 0.122 0.095 0.158 0.055 0.086 0.089 0.072 0.250 0.095 0.091 0.061 0.001 0.061 0.042 0.052 0.053 0.086 0.036 0.123 0.054 0.039 0.252 0.205 0.235 0.262 0.237 0.239 0.085 0.001 0.121 0.141 0.108 0.063 0.166 0.070 0.122 0.142 0.126 0.092 0.082 0.053 0.057 0.079 0.060 4'-Methoxy-2',3,7-trihydroxyisoflavanone 0.010 0.010 0.014 0.009 0.013 0.009 0.007 0.006 0.011 0.007 0.008 0.009 0.008 0.008 0.007 0.006 0.013 0.009 0.010 0.005 0.007 0.012 0.004 0.009 0.009 0.008 0.010 0.009 0.009 0.011 0.008 0.013 0.002 0.009 0.007 0.006 0.008 0.010 0.011 0.011 0.008 0.008 0.011 0.008 0.007 0.009 0.008 0.009 0.008 0.007 0.010 0.010 0.005 0.010 0.012 0.009 0.007 0.008 0.008 0.013 0.006 0.009 0.009 0.009 0.004 0.011 0.008 0.008 0.007 0.009 0.008 0.016 0.009 0.011 0.008 0.011 0.009 0.009 0.008 0.009 0.005 0.011 0.009 0.012 0.010 0.008 0.010 0.010 0.006 0.013 0.009 0.010 0.008 0.007 0.010 0.008 0.009 0.008 0.012 0.010 0.009 0.010 0.010 0.010 0.009 0.006 0.006 0.013 0.014 0.007 0.010 0.005 0.011 0.014 0.007 0.010 0.006 0.010 0.008 0.017 0.011 0.008 0.008 0.009 0.008 0.009 0.008 0.009 0.006 0.009 0.005 0.009 0.011 0.011 0.011 0.010 0.015 0.005 L-Cyclo(alanylglycyl) 0.011 0.009 0.011 0.011 0.012 0.010 0.008 0.006 0.006 0.006 0.005 0.004 0.014 0.014 0.016 0.010 0.015 0.013 0.010 0.011 0.010 0.011 0.014 0.018 0.012 0.010 0.014 0.000 0.000 0.000 0.000 0.000 0.000 0.006 0.006 0.005 0.005 0.007 0.010 0.012 0.014 0.007 0.010 0.010 0.011 0.008 0.014 0.010 0.009 0.010 0.032 0.010 0.007 0.008 0.008 0.011 0.014 0.016 0.013 0.015 0.012 0.013 0.012 0.012 0.012 0.014 0.012 0.009 0.012 0.012 0.011 0.014 0.012 0.063 0.005 0.006 0.006 0.006 0.006 0.005 0.007 0.007 0.004 0.009 0.006 0.009 0.012 0.013 0.010 0.011 0.010 0.021 0.052 0.015 0.015 0.016 0.017 0.009 0.011 0.010 0.011 0.012 0.012 0.003 0.011 0.005 0.005 0.007 0.004 0.006 0.008 0.007 0.009 0.011 0.006 0.003 0.010 0.005 0.008 0.005 0.009 0.005 0.005 0.006 0.018 0.008 0.007 0.003 0.002 0.002 0.002 0.002 0.006 0.005 0.004 0.004 0.008 0.006 Narciclasine 0.008 0.007 0.009 0.007 0.005 0.003 0.009 0.010 0.008 0.003 0.006 0.001 0.011 0.011 0.008 0.004 0.004 0.004 0.012 0.023 0.009 0.009 0.012 0.016 0.008 0.001 0.005 0.008 0.011 0.008 0.006 0.004 0.017 0.011 0.020 0.009 0.005 0.004 0.005 0.004 0.007 0.003 0.001 0.003 0.007 0.006 0.005 0.005 0.005 0.002 0.008 0.013 0.008 0.009 0.003 0.003 0.013 0.013 0.009 0.003 0.000 0.011 0.013 0.010 0.010 0.004 0.003 0.004 0.004 0.011 0.004 0.002 0.005 0.013 0.013 0.010 0.009 0.007 0.006 0.012 0.021 0.010 0.008 0.008 0.005 0.017 0.022 0.018 0.009 0.009 0.007 0.012 0.015 0.010 0.006 0.002 0.003 0.005 0.008 0.004 0.003 0.006 0.004 0.009 0.010 0.006 0.006 0.007 0.003 0.013 0.010 0.011 0.003 0.008 0.005 0.006 0.011 0.008 0.005 0.004 0.004 0.006 0.012 0.009 0.008 0.006 0.006 0.009 0.008 0.015 0.006 0.006 0.009 0.006 0.006 0.003 0.002 0.004 Pipecolic acid 0.008 0.009 0.006 0.009 0.005 0.009 0.004 0.007 0.008 0.008 0.010 0.037 0.040 0.035 0.036 0.031 0.029 0.091 0.034 0.032 0.032 0.030 0.009 0.013 0.000 0.008 0.008 0.042 0.035 0.035 0.035 0.033 0.133 0.123 0.100 0.086 0.070 0.113 0.004 0.004 0.000 0.003 0.004 0.002 0.004 0.003 0.003 0.002 0.003 0.004 0.000 0.001 0.003 0.000 0.005 0.004 0.035 0.033 0.036 0.033 0.024 0.013 0.014 0.013 0.016 0.012 0.013 0.004 0.005 0.003 0.000 0.003 0.000 0.000 0.003 0.000 0.002 0.002 0.000 0.015 0.016 0.017 0.016 0.058 0.046 0.005 0.002 0.003 0.003 0.005 0.006 0.017 0.015 0.014 0.017 0.015 0.014 0.022 0.026 0.024 0.025 0.020 0.022 0.021 0.018 0.018 0.024 0.018 0.018 0.010 0.012 0.011 0.014 0.011 0.012 0.020 0.017 0.018 0.019 0.016 0.016 0.000 0.004 0.004 0.004 0.002 0.003 0.010 0.008 0.008 0.009 0.009 0.008 0.000 0.000 0.000 0.001 0.001 5-Ethoxy-4,5-dihydro-2(3H)furanone 0.057 0.044 0.069 0.047 0.076 0.044 0.079 0.056 0.058 0.081 0.079 0.042 0.064 0.040 0.061 0.044 0.054 0.040 0.070 0.070 0.060 0.077 0.053 0.068 0.060 0.053 0.038 0.062 0.066 0.063 0.051 0.083 0.074 0.063 0.202 0.041 0.040 0.048 0.066 0.059 0.074 0.048 0.065 0.050 0.050 0.047 0.061 0.088 0.076 0.035 0.042 0.053 0.040 0.046 0.067 0.035 0.043 0.069 0.055 0.056 0.031 0.075 0.063 0.063 0.060 0.072 0.036 0.047 0.045 0.059 0.055 0.056 0.042 0.080 0.054 0.065 0.073 0.053 0.049 0.061 0.053 0.059 0.045 0.069 0.040 0.059 0.059 0.083 0.034 0.063 0.067 0.056 0.038 0.040 0.051 0.052 0.092 0.034 0.034 0.035 0.037 0.077 0.028 0.062 0.046 0.029 0.054 0.050 0.033 0.053 0.064 0.046 0.042 0.053 0.034 0.042 0.044 0.138 0.035 0.028 0.027 0.064 0.033 0.043 0.065 0.070 0.035 0.060 0.047 0.066 0.044 0.054 0.046 0.062 0.046 0.043 0.078 0.050 Niclosamide 0.005 0.002 0.004 0.002 0.003 0.002 0.004 0.003 0.002 0.005 0.003 0.004 0.004 0.003 0.002 0.003 0.002 0.003 0.001 0.004 0.003 0.002 0.000 0.004 0.001 0.001 0.004 0.005 0.004 0.004 0.003 0.002 0.000 0.004 0.000 0.002 0.002 0.002 0.002 0.004 0.002 0.003 0.003 0.002 0.002 0.002 0.003 0.003 0.004 0.002 0.002 0.003 0.002 0.002 0.003 0.005 0.002 0.003 0.003 0.003 0.002 0.001 0.003 0.001 0.001 0.004 0.001 0.004 0.002 0.003 0.002 0.003 0.005 0.004 0.002 0.006 0.002 0.005 0.004 0.004 0.001 0.003 0.003 0.004 0.003 0.005 0.001 0.004 0.003 0.003 0.003 0.006 0.002 0.002 0.003 0.001 0.003 0.002 0.003 0.003 0.004 0.003 0.003 0.003 0.003 0.000 0.002 0.001 0.001 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.001 0.003 0.001 0.003 0.002 0.003 0.001 0.003 0.003 0.002 0.002 0.001 0.002 0.004 0.002 0.000 0.002 0.005 0.003 0.001 0.001 0.001 Moracin 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 2,2,4-Trimethyl-3-(4-fluorophenyl)-2H-1-benzopyran-7-ol acetate 0.015 0.011 0.018 0.014 0.018 0.009 0.018 0.016 0.016 0.011 0.014 0.006 0.018 0.011 0.010 0.005 0.012 0.017 0.013 0.013 0.012 0.022 0.015 0.024 0.017 0.011 0.022 0.013 0.008 0.008 0.009 0.013 0.022 0.024 0.013 0.008 0.013 0.025 0.016 0.011 0.013 0.006 0.010 0.014 0.014 0.011 0.013 0.014 0.011 0.009 0.018 0.016 0.009 0.014 0.014 0.023 0.008 0.006 0.006 0.021 0.011 0.017 0.014 0.011 0.011 0.017 0.015 0.014 0.010 0.016 0.008 0.016 0.013 0.018 0.018 0.020 0.018 0.009 0.017 0.014 0.024 0.012 0.008 0.021 0.017 0.014 0.015 0.008 0.008 0.022 0.016 0.013 0.014 0.006 0.017 0.006 0.011 0.015 0.043 0.020 0.013 0.017 0.018 0.017 0.016 0.006 0.016 0.021 0.020 0.027 0.012 0.026 0.015 0.044 0.027 0.019 0.011 0.013 0.010 0.030 0.027 0.022 0.020 0.021 0.022 0.010 0.014 0.015 0.015 0.024 0.018 0.024 0.042 0.015 0.024 0.020 0.018 0.013 Creatine 0.019 0.017 0.017 0.017 0.033 0.030 0.066 0.056 0.053 0.053 0.080 0.048 0.021 0.018 0.019 0.024 0.044 0.026 0.027 0.019 0.021 0.043 0.025 0.034 0.022 0.022 0.030 0.079 0.073 0.066 0.078 0.096 0.084 0.019 0.020 0.020 0.030 0.035 0.036 0.031 0.032 0.028 0.030 0.033 0.051 0.036 0.031 0.035 0.047 0.044 0.064 0.061 0.051 0.066 0.113 0.086 0.017 0.015 0.025 0.040 0.022 0.021 0.013 0.012 0.022 0.030 0.025 0.038 0.038 0.029 0.026 0.035 0.038 0.055 0.048 0.046 0.048 0.055 0.042 0.024 0.019 0.021 0.026 0.052 0.025 0.020 0.017 0.018 0.023 0.058 0.024 0.038 0.034 0.025 0.026 0.031 0.041 0.021 0.019 0.020 0.020 0.032 0.033 0.034 0.026 0.040 0.030 0.036 0.046 0.022 0.016 0.023 0.020 0.037 0.024 0.025 0.019 0.022 0.016 0.048 0.023 0.033 0.029 0.032 0.050 0.054 0.036 0.120 0.091 0.105 0.104 0.105 0.112 0.060 0.041 0.036 0.080 0.043 Lysyl-Tryptophan 0.028 0.035 0.019 0.024 0.019 0.000 0.003 0.000 0.001 0.003 0.006 0.002 0.029 0.028 0.036 0.043 0.025 0.029 0.013 0.000 0.027 0.025 0.025 0.050 0.021 0.033 0.022 0.020 0.017 0.023 0.015 0.004 0.003 0.043 0.039 0.041 0.048 0.032 0.012 0.011 0.022 0.005 0.019 0.010 0.024 0.019 0.017 0.031 0.031 0.022 0.016 0.025 0.020 0.040 0.062 0.030 0.032 0.027 0.026 0.029 0.007 0.024 0.029 0.025 0.026 0.024 0.009 0.011 0.013 0.019 0.021 0.014 0.020 0.036 0.048 0.018 0.027 0.044 0.039 0.030 0.023 0.037 0.042 0.026 0.042 0.022 0.019 0.021 0.014 0.017 0.018 0.030 0.035 0.026 0.024 0.056 0.040 0.041 0.039 0.051 0.035 0.043 0.041 0.035 0.012 0.000 0.021 0.019 0.002 0.015 0.009 0.004 0.018 0.008 0.000 0.010 0.013 0.011 0.011 0.023 0.011 0.049 0.048 0.046 0.072 0.046 0.030 0.023 0.020 0.032 0.029 0.016 0.024 0.036 0.025 0.024 0.021 0.023 [FA hydroxy(4:0)] 1,9S,11R,15S-tetrahydroxy-13E-prostaene 0.000 0.008 0.011 0.000 0.012 0.004 0.004 0.000 0.009 0.005 0.000 0.012 0.000 0.012 0.007 0.012 0.000 0.018 0.009 0.000 0.016 0.005 0.005 0.021 0.000 0.009 0.002 0.004 0.000 0.006 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.002 0.005 0.006 0.011 0.007 0.008 0.000 0.003 0.009 0.000 0.000 0.000 0.006 0.000 0.002 0.000 0.009 0.000 0.002 0.000 0.012 0.004 0.008 0.000 0.008 0.005 0.011 0.000 0.018 0.000 0.008 0.005 0.000 0.000 0.009 0.015 0.006 0.011 0.007 0.008 0.011 0.007 0.010 0.000 0.008 0.005 0.011 0.000 0.005 0.000 0.002 0.005 0.000 0.017 0.016 0.014 0.001 0.000 0.000 0.012 0.001 0.009 0.011 0.001 0.028 0.007 0.020 0.015 0.000 0.032 0.003 0.004 0.004 0.000 0.008 0.003 0.002 0.000 0.000 0.000 0.004 0.002 0.006 0.004 0.002 0.000 0.004 0.018 0.008 0.007 0.006 0.000 0.007 0.000 0.000 0.002 0.004 0.015 0.000 0.004 0.000 Prostaglandin F1a 0.001 0.007 0.000 0.005 0.006 0.006 0.000 0.004 0.001 0.002 0.005 0.003 0.008 0.006 0.007 0.002 0.000 0.001 0.005 0.004 0.005 0.005 0.000 0.005 0.006 0.000 0.006 0.002 0.000 0.006 0.001 0.004 0.000 0.001 0.004 0.006 0.002 0.007 0.005 0.005 0.004 0.000 0.000 0.005 0.000 0.007 0.008 0.000 0.006 0.000 0.005 0.000 0.005 0.002 0.006 0.004 0.001 0.000 0.002 0.006 0.001 0.006 0.003 0.003 0.005 0.005 0.000 0.003 0.001 0.000 0.000 0.003 0.003 0.000 0.000 0.001 0.000 0.000 0.000 0.001 0.002 0.005 0.000 0.006 0.006 0.000 0.004 0.005 0.000 0.000 0.004 0.002 0.006 0.004 0.002 0.003 0.001 0.000 0.007 0.008 0.007 0.009 0.003 0.005 0.006 0.002 0.009 0.007 0.000 0.000 0.007 0.006 0.002 0.003 0.006 0.001 0.003 0.002 0.003 0.002 0.006 0.004 0.005 0.000 0.006 0.001 0.000 0.003 0.003 0.000 0.006 0.000 0.005 0.000 0.001 0.002 0.002 0.001 [PR trimethyl,methyl,methyl(5:0/15:0)] 2,6,14-trimethyl-6,7-epoxy-10-methylene-9-(3-methylpent-4-enyl)-pentadec-2-ene 0.000 0.000 0.001 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.002 0.002 0.000 0.000 0.000 0.001 0.000 0.001 0.001 0.001 0.000 0.001 0.001 0.000 0.001 0.001 0.000 0.001 0.001 0.000 0.000 0.001 0.001 0.000 0.001 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.000 0.001 0.001 0.001 0.000 0.000 0.000 0.000 0.001 0.001 0.001 0.000 0.000 0.000 0.001 0.001 0.000 0.002 0.002 0.001 0.003 0.002 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.002 0.001 0.001 0.001 0.002 0.001 0.000 0.001 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.002 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.001 N-[2-(4-Chloro-phenyl)-acetyl]-N'-(4,7-dimethyl-quinazolin-2-yl)- guanidine 0.005 0.004 0.008 0.004 0.011 0.003 0.005 0.003 0.005 0.004 0.004 0.005 0.008 0.004 0.004 0.004 0.011 0.006 0.003 0.005 0.003 0.011 0.005 0.007 0.004 0.004 0.008 0.005 0.009 0.005 0.005 0.009 0.010 0.007 0.004 0.003 0.006 0.007 0.009 0.004 0.006 0.005 0.009 0.008 0.005 0.003 0.004 0.006 0.008 0.005 0.007 0.009 0.003 0.006 0.011 0.008 0.003 0.003 0.003 0.014 0.002 0.006 0.003 0.005 0.003 0.013 0.004 0.004 0.003 0.004 0.003 0.016 0.006 0.005 0.004 0.007 0.007 0.006 0.006 0.006 0.007 0.004 0.004 0.013 0.006 0.003 0.008 0.006 0.005 0.020 0.006 0.005 0.004 0.004 0.007 0.003 0.007 0.004 0.013 0.006 0.004 0.009 0.008 0.006 0.005 0.002 0.005 0.010 0.011 0.010 0.005 0.008 0.006 0.026 0.009 0.004 0.003 0.005 0.005 0.023 0.007 0.007 0.007 0.006 0.006 0.010 0.005 0.007 0.004 0.005 0.004 0.010 0.016 0.004 0.009 0.011 0.016 0.004 3-O-Caffeoyl-4-O-methylquinic acid 0.020 0.018 0.022 0.022 0.048 0.013 0.020 0.016 0.019 0.015 0.019 0.017 0.030 0.018 0.021 0.015 0.043 0.023 0.020 0.018 0.014 0.050 0.017 0.027 0.018 0.018 0.037 0.028 0.028 0.024 0.019 0.035 0.045 0.024 0.020 0.011 0.025 0.031 0.043 0.020 0.022 0.017 0.029 0.035 0.017 0.018 0.016 0.020 0.029 0.018 0.028 0.025 0.018 0.022 0.039 0.034 0.016 0.017 0.014 0.058 0.012 0.021 0.019 0.022 0.011 0.052 0.017 0.019 0.013 0.022 0.017 0.061 0.026 0.022 0.021 0.030 0.026 0.024 0.023 0.020 0.028 0.016 0.019 0.050 0.026 0.016 0.026 0.024 0.018 0.069 0.019 0.022 0.020 0.012 0.026 0.013 0.029 0.023 0.053 0.020 0.018 0.036 0.039 0.021 0.020 0.010 0.016 0.041 0.041 0.032 0.026 0.034 0.026 0.103 0.030 0.017 0.016 0.018 0.016 0.092 0.030 0.032 0.021 0.026 0.026 0.036 0.020 0.024 0.015 0.027 0.018 0.041 0.063 0.023 0.034 0.041 0.066 0.014 Kanzonol R 0.000 0.012 0.006 0.000 0.000 0.000 0.002 0.000 0.000 0.001 0.000 0.000 0.019 0.016 0.004 0.004 0.000 0.000 0.000 0.000 0.005 0.014 0.004 0.025 0.005 0.006 0.009 0.016 0.021 0.002 0.029 0.008 0.000 0.020 0.013 0.014 0.005 0.000 0.000 0.005 0.010 0.003 0.002 0.001 0.000 0.000 0.000 0.007 0.000 0.001 0.021 0.014 0.013 0.031 0.048 0.036 0.007 0.011 0.000 0.000 0.000 0.000 0.008 0.008 0.000 0.006 0.005 0.000 0.000 0.000 0.001 0.000 0.000 0.029 0.015 0.024 0.001 0.044 0.033 0.011 0.000 0.009 0.014 0.008 0.000 0.021 0.003 0.021 0.009 0.020 0.005 0.008 0.013 0.000 0.020 0.036 0.010 0.023 0.019 0.025 0.005 0.012 0.016 0.014 0.008 0.000 0.002 0.002 0.000 0.002 0.006 0.000 0.004 0.005 0.002 0.020 0.009 0.011 0.029 0.023 0.009 0.016 0.010 0.013 0.010 0.001 0.009 0.017 0.009 0.012 0.010 0.004 0.029 0.005 0.005 0.000 0.009 0.000 [6]-Gingerdiol 3,5-diacetate 0.017 0.001 0.004 0.006 0.020 0.018 0.000 0.007 0.006 0.007 0.000 0.000 0.022 0.023 0.031 0.016 0.011 0.015 0.000 0.000 0.000 0.005 0.031 0.024 0.000 0.000 0.004 0.012 0.013 0.010 0.000 0.008 0.006 0.000 0.025 0.016 0.014 0.000 0.000 0.000 0.010 0.005 0.006 0.004 0.022 0.003 0.022 0.000 0.000 0.000 0.011 0.000 0.009 0.005 0.009 0.000 0.004 0.001 0.017 0.000 0.015 0.000 0.000 0.005 0.000 0.000 0.002 0.021 0.025 0.017 0.018 0.012 0.017 0.000 0.008 0.007 0.005 0.000 0.002 0.000 0.023 0.000 0.009 0.018 0.011 0.000 0.011 0.010 0.000 0.000 0.004 0.018 0.030 0.029 0.033 0.029 0.033 0.035 0.035 0.030 0.011 0.016 0.034 0.025 0.012 0.040 0.023 0.026 0.028 0.013 0.031 0.009 0.032 0.016 0.024 0.019 0.025 0.020 0.008 0.007 0.001 0.001 0.026 0.020 0.022 0.006 0.027 0.022 0.005 0.020 0.000 0.025 0.003 0.007 0.025 0.024 0.028 0.029 Erucicoyl-EA 0.000 0.000 0.001 0.002 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.000 0.000 0.000 0.002 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.001 0.001 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.000 0.001 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.000 0.000 0.000 0.001 0.002 0.000 0.000 0.001 0.000 0.000 0.001 0.000 0.000 0.001 0.001 0.001 0.001 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.001 0.001 0.001 0.001 0.000 0.000 0.001 0.000 0.001 0.000 0.001 0.001 0.000 0.001 0.000 0.002 Artonin K 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.003 0.001 0.001 0.001 0.001 0.001 0.003 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 Trihydroxy-3,6,7,4'-tetramethoxyflavone 0.001 0.001 0.001 0.001 0.002 0.002 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.001 0.001 0.001 0.002 0.002 0.002 0.002 0.002 0.003 0.001 0.003 0.001 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.002 0.001 0.001 0.001 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.003 0.001 0.001 0.001 0.001 0.001 0.003 0.002 0.001 0.001 0.001 0.001 0.003 0.002 0.001 0.001 0.002 0.001 0.002 0.002 0.002 0.001 0.002 0.001 0.003 0.002 0.002 0.001 0.002 0.001 0.003 0.002 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.002 0.001 0.001 0.001 0.002 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.004 0.001 0.001 0.001 0.001 0.001 0.003 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.003 0.001 3-Amino-1,2,4-triazole 0.007 0.003 0.003 0.003 0.002 0.002 0.001 0.002 0.005 0.002 0.002 0.003 0.003 0.003 0.011 0.002 0.003 0.007 0.003 0.001 0.001 0.002 0.004 0.008 0.001 0.001 0.001 0.003 0.000 0.000 0.002 0.000 0.001 0.008 0.002 0.001 0.002 0.001 0.000 0.006 0.001 0.000 0.000 0.004 0.002 0.003 0.003 0.003 0.002 0.003 0.001 0.002 0.001 0.002 0.000 0.001 0.002 0.004 0.002 0.002 0.002 0.002 0.007 0.002 0.005 0.008 0.001 0.004 0.000 0.001 0.002 0.002 0.002 0.002 0.003 0.003 0.000 0.002 0.002 0.003 0.003 0.002 0.002 0.002 0.000 0.006 0.002 0.004 0.002 0.001 0.000 0.004 0.001 0.000 0.003 0.001 0.001 0.002 0.003 0.005 0.004 0.005 0.001 0.002 0.001 0.003 0.003 0.004 0.004 0.002 0.003 0.001 0.001 0.003 0.003 0.001 0.003 0.002 0.002 0.003 0.001 0.002 0.001 0.003 0.002 0.003 0.003 0.003 0.003 0.002 0.003 0.002 0.002 0.001 0.000 0.006 0.002 0.003 Proline betaine 0.112 0.097 0.095 0.089 0.081 0.071 0.116 0.099 0.092 0.084 0.170 0.621 0.888 0.777 0.760 0.629 0.531 1.569 0.306 0.271 0.291 0.254 0.393 0.478 0.350 0.269 0.224 0.543 0.409 0.376 0.390 0.341 2.339 1.579 1.113 1.021 0.812 1.591 0.190 0.197 0.186 0.172 0.164 0.136 0.005 0.006 0.004 0.004 0.005 0.010 0.016 0.017 0.016 0.015 0.012 0.033 0.646 0.607 0.643 0.508 0.377 0.392 0.336 0.302 0.365 0.295 0.280 0.045 0.044 0.045 0.040 0.033 0.034 0.005 0.004 0.002 0.001 0.003 0.003 0.653 0.552 0.563 0.551 1.328 0.874 0.103 0.094 0.094 0.085 0.070 0.082 0.533 0.436 0.371 0.376 0.336 0.268 0.588 0.554 0.502 0.489 0.442 0.374 0.048 0.042 0.048 0.050 0.050 0.031 0.371 0.302 0.312 0.316 0.281 0.225 0.265 0.233 0.246 0.226 0.176 0.161 0.021 0.018 0.017 0.022 0.016 0.014 0.077 0.050 0.057 0.054 0.048 0.052 0.087 0.066 0.054 0.059 0.052 Piperidine 0.040 0.041 0.042 0.033 0.066 0.036 0.050 0.049 0.047 0.041 0.033 0.022 0.034 0.025 0.055 0.027 0.040 0.049 0.048 0.042 0.035 0.061 0.041 0.049 0.030 0.034 0.024 0.046 0.044 0.029 0.033 0.045 0.031 0.038 0.024 0.024 0.037 0.032 0.027 0.022 0.027 0.037 0.026 0.024 0.036 0.041 0.038 0.033 0.030 0.019 0.034 0.038 0.027 0.025 0.055 0.034 0.034 0.025 0.022 0.031 0.024 0.041 0.035 0.030 0.033 0.033 0.027 0.046 0.044 0.037 0.032 0.033 0.027 0.047 0.043 0.045 0.037 0.028 0.025 0.037 0.034 0.027 0.026 0.031 0.042 0.031 0.034 0.020 0.018 0.048 0.022 0.041 0.037 0.040 0.035 0.054 0.028 0.032 0.040 0.034 0.029 0.053 0.049 0.034 0.032 0.036 0.055 0.033 0.041 0.043 0.036 0.031 0.028 0.043 0.030 0.031 0.033 0.027 0.026 0.027 0.025 0.038 0.034 0.037 0.045 0.058 0.022 0.042 0.037 0.038 0.035 0.037 0.036 0.050 0.037 0.032 0.049 0.029 hydroxymethyl-dCDP 0.004 0.004 0.007 0.004 0.003 0.004 0.005 0.003 0.005 0.004 0.002 0.003 0.006 0.004 0.005 0.003 0.003 0.004 0.004 0.002 0.004 0.002 0.003 0.008 0.004 0.002 0.004 0.003 0.003 0.002 0.002 0.002 0.001 0.005 0.003 0.003 0.003 0.006 0.003 0.002 0.003 0.003 0.003 0.005 0.004 0.006 0.004 0.006 0.003 0.003 0.004 0.003 0.003 0.003 0.005 0.006 0.003 0.002 0.003 0.003 0.005 0.007 0.005 0.004 0.003 0.004 0.003 0.003 0.002 0.004 0.002 0.003 0.003 0.005 0.005 0.005 0.003 0.003 0.005 0.004 0.002 0.003 0.005 0.004 0.006 0.004 0.003 0.003 0.002 0.003 0.004 0.003 0.005 0.004 0.004 0.004 0.007 0.007 0.008 0.007 0.005 0.003 0.004 0.005 0.004 0.003 0.006 0.004 0.005 0.005 0.005 0.005 0.004 0.004 0.004 0.004 0.003 0.004 0.005 0.004 0.008 0.005 0.003 0.003 0.006 0.003 0.005 0.004 0.005 0.006 0.004 0.004 0.005 0.004 0.004 0.005 0.002 0.003 FA amino(7:0) aminoheptanoic acid 0.018 0.016 0.016 0.015 0.012 0.015 0.030 0.027 0.024 0.022 0.014 0.015 0.019 0.019 0.016 0.009 0.011 0.019 0.024 0.020 0.019 0.021 0.018 0.026 0.016 0.011 0.015 0.014 0.012 0.008 0.007 0.010 0.018 0.016 0.011 0.011 0.006 0.013 0.014 0.016 0.020 0.009 0.010 0.017 0.021 0.017 0.021 0.019 0.012 0.014 0.017 0.021 0.017 0.017 0.014 0.016 0.020 0.019 0.016 0.013 0.016 0.021 0.019 0.017 0.017 0.014 0.020 0.019 0.022 0.020 0.018 0.014 0.022 0.019 0.015 0.015 0.013 0.011 0.018 0.012 0.011 0.007 0.007 0.010 0.011 0.020 0.019 0.019 0.011 0.013 0.020 0.026 0.020 0.018 0.018 0.013 0.015 0.016 0.016 0.014 0.012 0.008 0.010 0.013 0.012 0.017 0.014 0.012 0.009 0.017 0.016 0.014 0.015 0.012 0.015 0.014 0.015 0.014 0.012 0.011 0.014 0.010 0.011 0.011 0.014 0.009 0.011 0.022 0.014 0.020 0.017 0.013 0.013 0.029 0.022 0.017 0.021 0.023 Glutamine 0.016 0.015 0.017 0.016 0.015 0.022 0.022 0.024 0.021 0.014 0.009 0.010 0.014 0.012 0.011 0.008 0.011 0.017 0.014 0.012 0.013 0.015 0.019 0.031 0.020 0.015 0.015 0.015 0.010 0.007 0.011 0.014 0.018 0.020 0.011 0.010 0.013 0.022 0.012 0.012 0.014 0.008 0.006 0.012 0.015 0.014 0.015 0.014 0.010 0.013 0.018 0.016 0.013 0.013 0.013 0.015 0.012 0.010 0.007 0.010 0.013 0.018 0.015 0.016 0.016 0.013 0.018 0.011 0.015 0.015 0.011 0.009 0.016 0.017 0.018 0.019 0.015 0.011 0.019 0.013 0.012 0.013 0.013 0.016 0.018 0.015 0.011 0.007 0.008 0.011 0.019 0.015 0.014 0.014 0.010 0.007 0.009 0.021 0.028 0.024 0.025 0.017 0.024 0.018 0.018 0.026 0.023 0.015 0.018 0.017 0.012 0.014 0.012 0.020 0.021 0.019 0.017 0.021 0.018 0.019 0.025 0.016 0.016 0.016 0.026 0.010 0.020 0.015 0.014 0.018 0.015 0.013 0.014 0.014 0.012 0.011 0.014 0.016 2,3-Dimethylbenzofuran 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.003 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.012 0.016 0.018 0.015 0.012 0.014 0.016 0.012 0.013 0.016 0.021 0.014 0.011 0.013 0.016 0.015 0.015 0.019 0.018 0.014 0.015 0.015 0.015 0.015 0.013 0.015 0.014 0.013 0.014 0.013 0.015 0.018 0.017 0.013 0.012 0.018 0.016 0.011 0.017 0.013 0.012 0.012 0.013 0.013 0.014 0.013 0.013 0.017 0.015 0.015 0.014 0.013 0.015 0.012 0.013 0.011 0.013 0.015 0.012 0.014 0.015 0.014 0.012 0.017 0.014 0.015 0.016 0.014 0.014 0.015 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 Sorbitan stearate 0.015 0.041 0.022 0.008 0.013 0.007 0.022 0.013 0.009 0.023 0.000 0.001 0.018 0.016 0.021 0.020 0.011 0.016 0.012 0.000 0.000 0.015 0.012 0.051 0.021 0.011 0.026 0.016 0.000 0.010 0.000 0.006 0.000 0.015 0.000 0.000 0.010 0.000 0.000 0.005 0.011 0.000 0.005 0.017 0.018 0.004 0.000 0.012 0.000 0.000 0.000 0.000 0.000 0.000 0.005 0.004 0.002 0.007 0.007 0.005 0.000 0.015 0.018 0.002 0.000 0.012 0.000 0.020 0.006 0.020 0.019 0.020 0.011 0.031 0.023 0.035 0.002 0.021 0.018 0.021 0.000 0.015 0.006 0.014 0.009 0.013 0.000 0.015 0.000 0.011 0.010 0.033 0.012 0.001 0.010 0.009 0.018 0.000 0.023 0.026 0.008 0.067 0.017 0.024 0.005 0.000 0.022 0.010 0.003 0.000 0.007 0.002 0.004 0.008 0.000 0.018 0.000 0.010 0.007 0.008 0.014 0.018 0.010 0.008 0.028 0.007 0.009 0.000 0.000 0.004 0.000 0.007 0.000 0.025 0.001 0.000 0.010 0.013 6-Hydroxyluteolin 6-xyloside 0.615 1.352 1.129 0.441 0.731 0.588 1.025 0.508 1.436 0.420 0.010 0.228 0.321 0.928 0.010 0.431 0.392 1.111 0.469 0.010 0.296 0.897 0.211 1.209 0.557 0.398 0.577 0.361 0.010 0.136 0.010 0.601 0.010 0.288 0.412 0.010 0.095 0.427 0.010 0.231 0.437 0.010 0.378 0.127 0.538 0.339 0.010 0.710 0.751 0.060 0.137 0.433 0.010 0.106 0.428 0.010 0.021 0.382 0.653 0.320 0.010 0.427 1.185 0.725 0.010 0.761 0.010 0.136 0.452 0.187 0.672 0.125 0.236 1.286 0.479 0.774 0.181 0.105 0.346 0.466 0.010 0.381 0.466 0.916 0.010 0.159 0.010 0.116 0.010 0.395 0.567 0.443 0.709 0.010 0.010 0.130 0.357 0.564 0.343 0.685 0.420 1.422 0.355 0.688 0.736 0.010 1.002 0.069 0.207 0.010 0.094 0.010 0.010 0.021 0.010 0.610 0.010 0.471 0.010 0.408 0.243 0.574 0.658 0.282 0.781 0.639 0.637 0.010 0.010 0.320 0.010 0.010 0.010 0.319 0.756 0.155 0.527 0.010 6-Deoxodolichosterone 0.015 0.034 0.021 0.009 0.008 0.001 0.007 0.002 0.006 0.013 0.007 0.005 0.031 0.027 0.024 0.013 0.015 0.026 0.011 0.001 0.002 0.004 0.028 0.038 0.018 0.017 0.026 0.008 0.006 0.008 0.001 0.000 0.000 0.010 0.003 0.010 0.005 0.007 0.008 0.007 0.002 0.000 0.001 0.011 0.016 0.017 0.010 0.015 0.014 0.011 0.014 0.022 0.017 0.023 0.017 0.016 0.015 0.024 0.010 0.009 0.007 0.011 0.003 0.008 0.001 0.007 0.002 0.008 0.006 0.015 0.000 0.011 0.019 0.016 0.015 0.005 0.000 0.009 0.011 0.014 0.000 0.019 0.005 0.011 0.007 0.015 0.010 0.022 0.017 0.016 0.012 0.022 0.006 0.014 0.021 0.015 0.018 0.010 0.015 0.015 0.009 0.037 0.012 0.021 0.008 0.000 0.016 0.008 0.006 0.005 0.009 0.004 0.009 0.010 0.006 0.029 0.020 0.023 0.018 0.023 0.012 0.020 0.000 0.020 0.024 0.017 0.008 0.021 0.007 0.016 0.011 0.013 0.010 0.017 0.011 0.006 0.014 0.012 Pyruvic acid 0.019 0.019 0.034 0.024 0.106 0.015 0.021 0.011 0.017 0.025 0.023 0.032 0.041 0.048 0.064 0.030 0.095 0.044 0.026 0.055 0.031 0.138 0.017 0.025 0.036 0.021 0.059 0.022 0.049 0.064 0.030 0.058 0.082 0.062 0.219 0.082 0.050 0.087 0.122 0.084 0.128 0.029 0.046 0.067 0.019 0.012 0.008 0.043 0.036 0.025 0.033 0.046 0.038 0.055 0.074 0.073 0.039 0.111 0.095 0.157 0.057 0.054 0.075 0.090 0.065 0.172 0.040 0.041 0.044 0.063 0.058 0.161 0.070 0.058 0.035 0.040 0.070 0.064 0.063 0.038 0.038 0.050 0.040 0.238 0.053 0.054 0.101 0.183 0.076 0.202 0.095 0.024 0.016 0.010 0.021 0.017 0.033 0.020 0.036 0.026 0.029 0.044 0.064 0.025 0.021 0.005 0.033 0.089 0.056 0.018 0.059 0.036 0.031 0.134 0.020 0.022 0.039 0.077 0.041 0.124 0.043 0.029 0.029 0.025 0.045 0.110 0.052 0.042 0.021 0.040 0.029 0.032 0.096 0.017 0.011 0.028 0.213 0.008 Deoxyuridine triphosphate 0.000 0.000 0.001 0.000 0.003 0.000 0.000 0.000 0.000 0.002 0.002 0.001 0.002 0.005 0.004 0.002 0.003 0.001 0.000 0.004 0.001 0.003 0.000 0.000 0.001 0.000 0.002 0.000 0.006 0.005 0.002 0.002 0.006 0.004 0.013 0.008 0.001 0.005 0.004 0.004 0.006 0.000 0.001 0.002 0.000 0.001 0.000 0.001 0.001 0.001 0.000 0.003 0.002 0.004 0.001 0.002 0.002 0.007 0.005 0.006 0.001 0.003 0.004 0.005 0.004 0.006 0.001 0.001 0.002 0.003 0.003 0.006 0.002 0.003 0.002 0.002 0.004 0.004 0.002 0.001 0.002 0.002 0.001 0.010 0.003 0.002 0.007 0.013 0.006 0.010 0.004 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.002 0.002 0.000 0.000 0.000 0.001 0.003 0.001 0.000 0.007 0.001 0.003 0.002 0.000 0.000 0.005 0.004 0.003 0.004 0.000 0.000 0.001 0.001 0.001 0.004 0.001 0.000 0.002 0.002 0.003 0.001 0.004 0.001 0.000 0.000 0.010 0.001 Camelliagenin A 0.004 0.020 0.006 0.000 0.002 0.000 0.003 0.000 0.000 0.001 0.000 0.000 0.010 0.006 0.005 0.006 0.002 0.012 0.000 0.000 0.000 0.000 0.006 0.010 0.005 0.001 0.008 0.002 0.002 0.002 0.000 0.000 0.000 0.002 0.000 0.003 0.000 0.002 0.000 0.001 0.001 0.004 0.000 0.000 0.000 0.002 0.004 0.002 0.002 0.002 0.004 0.009 0.007 0.003 0.008 0.008 0.000 0.007 0.001 0.007 0.002 0.003 0.000 0.002 0.000 0.002 0.000 0.000 0.000 0.006 0.000 0.009 0.003 0.001 0.005 0.000 0.000 0.001 0.001 0.000 0.000 0.007 0.007 0.000 0.000 0.002 0.005 0.004 0.004 0.004 0.006 0.009 0.001 0.003 0.003 0.002 0.006 0.007 0.006 0.007 0.004 0.016 0.005 0.004 0.002 0.000 0.002 0.001 0.003 0.000 0.003 0.000 0.003 0.002 0.000 0.007 0.000 0.004 0.010 0.008 0.007 0.006 0.000 0.005 0.009 0.001 0.001 0.008 0.000 0.001 0.000 0.003 0.003 0.003 0.003 0.004 0.000 0.001 (2alpha,3alpha,5alpha,22R,23R)-2,3,22,23-Tetrahydroxy-25-methylergost-24(28)en-6-one 0.054 0.047 0.039 0.014 0.021 0.000 0.031 0.011 0.051 0.039 0.002 0.000 0.044 0.040 0.050 0.060 0.047 0.029 0.045 0.011 0.035 0.013 0.071 0.126 0.051 0.033 0.054 0.021 0.034 0.036 0.000 0.000 0.000 0.025 0.003 0.028 0.033 0.001 0.000 0.006 0.010 0.000 0.000 0.000 0.045 0.042 0.020 0.046 0.019 0.019 0.036 0.025 0.019 0.033 0.047 0.001 0.011 0.019 0.012 0.030 0.000 0.060 0.000 0.037 0.012 0.032 0.005 0.032 0.020 0.023 0.010 0.021 0.013 0.074 0.035 0.040 0.021 0.019 0.031 0.029 0.013 0.040 0.025 0.034 0.028 0.038 0.022 0.056 0.012 0.032 0.019 0.026 0.009 0.000 0.000 0.010 0.012 0.024 0.016 0.025 0.039 0.000 0.000 0.040 0.038 0.000 0.034 0.038 0.019 0.018 0.032 0.027 0.048 0.025 0.000 0.048 0.024 0.046 0.031 0.030 0.022 0.037 0.000 0.049 0.044 0.032 0.005 0.041 0.020 0.032 0.039 0.034 0.016 0.053 0.048 0.027 0.020 0.015 LysoPE(18:0/0:0) 0.013 0.015 0.017 0.005 0.009 0.006 0.004 0.010 0.007 0.007 0.002 0.005 0.023 0.009 0.013 0.007 0.004 0.011 0.009 0.004 0.011 0.011 0.018 0.026 0.012 0.010 0.015 0.010 0.011 0.005 0.000 0.002 0.000 0.012 0.002 0.009 0.008 0.005 0.001 0.003 0.003 0.000 0.004 0.001 0.015 0.012 0.007 0.015 0.011 0.005 0.010 0.009 0.004 0.008 0.007 0.002 0.003 0.012 0.007 0.009 0.004 0.014 0.007 0.018 0.008 0.011 0.003 0.015 0.007 0.008 0.007 0.009 0.004 0.017 0.012 0.014 0.009 0.010 0.006 0.010 0.007 0.015 0.012 0.009 0.007 0.013 0.014 0.008 0.007 0.005 0.003 0.014 0.003 0.003 0.006 0.009 0.008 0.013 0.002 0.013 0.012 0.011 0.009 0.012 0.010 0.006 0.013 0.009 0.008 0.007 0.012 0.007 0.008 0.005 0.006 0.015 0.005 0.015 0.011 0.009 0.011 0.015 0.005 0.013 0.018 0.011 0.007 0.015 0.007 0.009 0.007 0.007 0.008 0.013 0.009 0.008 0.008 0.008 Oxolucidine B 0.179 0.116 0.121 0.097 0.089 0.101 0.104 0.079 0.084 0.069 0.066 0.040 0.198 0.193 0.180 0.147 0.112 0.123 0.186 0.141 0.147 0.105 0.220 0.256 0.183 0.110 0.099 0.129 0.112 0.091 0.072 0.056 0.091 0.140 0.101 0.113 0.064 0.041 0.059 0.061 0.066 0.030 0.011 0.037 0.159 0.128 0.136 0.126 0.088 0.064 0.133 0.138 0.125 0.106 0.102 0.060 0.105 0.121 0.086 0.100 0.073 0.149 0.137 0.115 0.125 0.101 0.099 0.177 0.151 0.165 0.104 0.074 0.089 0.253 0.140 0.178 0.103 0.098 0.095 0.110 0.114 0.147 0.110 0.063 0.080 0.161 0.118 0.161 0.114 0.086 0.080 0.138 0.087 0.081 0.061 0.056 0.057 0.123 0.068 0.086 0.104 0.041 0.050 0.141 0.109 0.215 0.109 0.106 0.094 0.114 0.144 0.103 0.101 0.114 0.083 0.278 0.227 0.203 0.168 0.114 0.136 0.134 0.092 0.121 0.134 0.092 0.078 0.222 0.131 0.123 0.142 0.091 0.090 0.235 0.169 0.127 0.078 0.094 Prenol 30,32-dihydroxy-2b-methyl-bishomohopane 0.006 0.021 0.008 0.000 0.003 0.000 0.001 0.000 0.007 0.003 0.000 0.000 0.016 0.008 0.015 0.017 0.009 0.023 0.000 0.000 0.000 0.000 0.014 0.022 0.006 0.008 0.010 0.004 0.002 0.000 0.000 0.000 0.000 0.000 0.000 0.002 0.004 0.000 0.000 0.000 0.001 0.000 0.007 0.003 0.009 0.002 0.003 0.009 0.008 0.003 0.001 0.008 0.004 0.011 0.013 0.009 0.007 0.009 0.000 0.006 0.002 0.005 0.000 0.002 0.000 0.002 0.000 0.002 0.001 0.007 0.001 0.009 0.008 0.004 0.003 0.000 0.000 0.001 0.000 0.004 0.000 0.007 0.002 0.000 0.000 0.004 0.007 0.011 0.000 0.001 0.007 0.015 0.000 0.008 0.005 0.004 0.014 0.000 0.005 0.007 0.000 0.027 0.011 0.013 0.001 0.000 0.004 0.000 0.004 0.000 0.006 0.000 0.004 0.000 0.000 0.023 0.007 0.013 0.017 0.016 0.010 0.009 0.000 0.007 0.013 0.010 0.001 0.012 0.000 0.004 0.000 0.002 0.002 0.004 0.000 0.004 0.002 0.001 Lumequoylacetone 0.010 0.058 0.000 0.000 0.004 0.000 0.011 0.000 0.012 0.012 0.000 0.007 0.037 0.040 0.043 0.028 0.027 0.045 0.006 0.000 0.000 0.000 0.030 0.055 0.017 0.019 0.005 0.015 0.004 0.010 0.003 0.002 0.000 0.002 0.000 0.000 0.000 0.007 0.000 0.002 0.006 0.004 0.005 0.007 0.011 0.013 0.010 0.019 0.016 0.004 0.028 0.040 0.024 0.041 0.035 0.026 0.011 0.017 0.010 0.017 0.003 0.012 0.000 0.000 0.000 0.007 0.000 0.011 0.007 0.012 0.000 0.004 0.014 0.012 0.008 0.000 0.000 0.008 0.001 0.009 0.000 0.017 0.004 0.007 0.004 0.017 0.017 0.019 0.011 0.013 0.014 0.030 0.007 0.014 0.017 0.015 0.014 0.031 0.030 0.040 0.011 0.102 0.027 0.005 0.000 0.000 0.006 0.000 0.002 0.008 0.013 0.000 0.004 0.010 0.000 0.038 0.015 0.044 0.034 0.031 0.028 0.029 0.007 0.031 0.043 0.021 0.013 0.007 0.000 0.002 0.001 0.013 0.008 0.039 0.024 0.027 0.025 0.023 LysoPC(16:0) 0.473 0.314 0.342 0.304 0.261 0.190 0.389 0.275 0.336 0.300 0.213 0.084 0.431 0.423 0.463 0.390 0.313 0.278 0.485 0.387 0.432 0.402 0.721 0.919 0.608 0.433 0.312 0.331 0.246 0.236 0.190 0.186 0.187 0.392 0.366 0.292 0.273 0.132 0.124 0.116 0.114 0.024 0.009 0.017 0.410 0.284 0.315 0.312 0.220 0.150 0.343 0.315 0.359 0.299 0.308 0.119 0.236 0.336 0.241 0.270 0.216 0.440 0.357 0.381 0.424 0.326 0.209 0.377 0.345 0.320 0.248 0.213 0.192 0.541 0.335 0.435 0.290 0.286 0.245 0.349 0.350 0.458 0.322 0.275 0.245 0.384 0.286 0.419 0.317 0.249 0.190 0.356 0.237 0.219 0.122 0.176 0.093 0.312 0.175 0.276 0.300 0.113 0.121 0.430 0.371 0.437 0.369 0.334 0.183 0.353 0.346 0.318 0.304 0.382 0.260 0.424 0.332 0.388 0.297 0.228 0.223 0.415 0.296 0.392 0.482 0.323 0.198 0.492 0.329 0.367 0.383 0.275 0.219 0.634 0.421 0.342 0.303 0.297 L-Histidine 0.006 0.016 0.007 0.011 0.009 0.006 0.007 0.006 0.014 0.011 0.002 0.001 0.013 0.003 0.003 0.002 0.003 0.004 0.009 0.003 0.005 0.010 0.007 0.014 0.055 0.004 0.005 0.012 0.002 0.008 0.001 0.009 0.039 0.004 0.000 0.003 0.002 0.006 0.013 0.030 0.011 0.001 0.001 0.007 0.004 0.005 0.004 0.005 0.001 0.003 0.004 0.003 0.001 0.001 0.005 0.013 0.008 0.002 0.002 0.005 0.006 0.003 0.008 0.002 0.003 0.002 0.003 0.038 0.005 0.005 0.002 0.036 0.005 0.005 0.014 0.006 0.002 0.028 0.006 0.004 0.003 0.002 0.011 0.003 0.008 0.003 0.003 0.000 0.002 0.003 0.005 0.007 0.007 0.013 0.006 0.004 0.006 0.009 0.013 0.007 0.005 0.005 0.006 0.005 0.006 0.014 0.019 0.005 0.039 0.007 0.004 0.008 0.006 0.007 0.014 0.003 0.003 0.002 0.004 0.014 0.004 0.006 0.005 0.007 0.009 0.005 0.065 0.005 0.013 0.005 0.006 0.041 0.007 0.006 0.013 0.041 0.005 0.013 Lactic acid 0.134 0.091 0.125 0.151 0.366 0.102 0.109 0.104 0.101 0.187 0.317 0.200 0.253 0.380 0.357 0.195 0.414 0.263 0.128 0.530 0.165 0.540 0.145 0.199 0.154 0.129 0.185 0.137 0.550 0.512 0.261 0.211 1.400 0.469 1.621 0.911 0.270 0.540 0.464 0.407 0.893 0.161 0.189 0.331 0.099 0.102 0.115 0.315 0.182 0.181 0.151 0.346 0.288 0.388 0.260 0.404 0.367 0.721 0.681 0.565 0.254 0.382 0.488 0.493 0.531 0.871 0.304 0.218 0.244 0.392 0.328 0.596 0.311 0.302 0.216 0.183 0.463 0.462 0.375 0.184 0.351 0.307 0.179 1.106 0.306 0.366 0.828 1.630 0.595 0.968 0.600 0.086 0.091 0.085 0.139 0.091 0.109 0.093 0.130 0.104 0.133 0.267 0.313 0.113 0.102 0.068 0.135 0.335 0.245 0.104 0.596 0.129 0.243 0.351 0.104 0.152 0.597 0.474 0.341 0.457 0.245 0.177 0.161 0.132 0.221 0.484 0.233 0.165 0.243 0.242 0.265 0.185 0.537 0.107 0.125 0.165 1.019 0.181 1,2,4,8-Tetraacetoxy-7-hydroxy-3-(4-hydroxyphenyl)dibenzofuran 0.135 0.323 0.112 0.016 0.063 0.058 0.151 0.055 0.067 0.041 0.000 0.039 0.070 0.200 0.111 0.072 0.064 0.150 0.135 0.048 0.102 0.177 0.034 0.342 0.128 0.038 0.070 0.037 0.000 0.021 0.000 0.079 0.000 0.089 0.052 0.000 0.038 0.041 0.000 0.000 0.000 0.000 0.046 0.013 0.104 0.057 0.000 0.101 0.076 0.007 0.001 0.000 0.000 0.000 0.042 0.001 0.019 0.048 0.000 0.034 0.021 0.049 0.107 0.081 0.000 0.062 0.000 0.074 0.012 0.070 0.056 0.017 0.021 0.259 0.000 0.086 0.000 0.031 0.012 0.000 0.000 0.068 0.045 0.077 0.060 0.043 0.000 0.029 0.000 0.001 0.067 0.089 0.050 0.027 0.013 0.024 0.044 0.103 0.046 0.087 0.086 0.766 0.064 0.129 0.090 0.000 0.193 0.018 0.027 0.013 0.024 0.014 0.000 0.000 0.000 0.058 0.000 0.049 0.030 0.018 0.000 0.054 0.063 0.081 0.078 0.089 0.052 0.023 0.000 0.041 0.000 0.000 0.000 0.036 0.077 0.000 0.036 0.006 LysoPE(20:0/0:0) 0.002 0.003 0.004 0.005 0.002 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.002 0.000 0.000 0.000 0.000 0.001 0.004 0.000 0.008 0.003 0.011 0.010 0.006 0.002 0.001 0.001 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.005 0.000 0.000 0.004 0.004 0.002 0.003 0.000 0.000 0.002 0.001 0.000 0.005 0.000 0.000 0.002 0.001 0.000 0.003 0.001 0.001 0.001 0.002 0.000 0.000 0.000 0.001 0.002 0.003 0.001 0.001 0.002 0.000 0.000 0.004 0.000 0.002 0.000 0.001 0.003 0.004 0.000 0.000 0.000 0.000 0.001 0.004 0.000 0.000 0.000 0.003 0.000 0.000 0.000 0.000 0.000 0.005 0.000 0.001 0.004 0.000 0.000 0.007 0.006 0.014 0.009 0.002 0.005 0.002 0.005 0.005 0.000 0.007 0.002 0.003 0.004 0.004 0.004 0.004 0.002 0.004 0.002 0.004 0.002 0.002 0.000 0.001 0.000 0.002 0.003 0.000 0.000 0.003 0.002 0.002 0.000 0.001 Didodecyl thiobispropanoate 0.006 0.004 0.004 0.003 0.002 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.006 0.005 0.005 0.002 0.003 0.001 0.001 0.002 0.001 0.000 0.007 0.005 0.003 0.002 0.002 0.000 0.000 0.000 0.000 0.000 0.000 0.004 0.003 0.003 0.003 0.001 0.001 0.000 0.000 0.000 0.000 0.000 0.005 0.003 0.003 0.003 0.002 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.004 0.004 0.001 0.001 0.001 0.000 0.000 0.000 0.001 0.000 0.000 0.006 0.004 0.002 0.002 0.000 0.002 0.002 0.000 0.001 0.000 0.000 0.000 0.004 0.005 0.003 0.002 0.001 0.001 0.000 0.001 0.000 0.000 0.000 0.000 0.005 0.002 0.002 0.002 0.002 0.003 0.003 0.004 0.003 0.005 0.004 0.004 0.002 0.004 0.000 0.002 0.002 0.002 0.003 0.002 0.003 0.003 0.002 0.003 0.001 0.001 0.000 0.002 0.001 0.001 0.002 0.001 0.000 0.003 0.002 0.000 0.001 0.000 0.000 0.002 0.000 0.001 0.001 0.002 0.002 0.000 0.001 LysoPC(18:2(9Z,12Z)) 0.302 0.195 0.204 0.171 0.159 0.178 0.173 0.141 0.168 0.155 0.095 0.069 0.290 0.242 0.243 0.175 0.176 0.214 0.365 0.321 0.246 0.222 0.330 0.379 0.255 0.166 0.184 0.329 0.221 0.194 0.166 0.120 0.328 0.350 0.242 0.179 0.150 0.187 0.058 0.090 0.116 0.052 0.038 0.066 0.257 0.200 0.208 0.172 0.087 0.063 0.287 0.294 0.230 0.187 0.123 0.168 0.193 0.209 0.170 0.133 0.152 0.245 0.188 0.195 0.196 0.120 0.183 0.377 0.358 0.366 0.258 0.134 0.188 0.347 0.246 0.245 0.157 0.146 0.112 0.223 0.210 0.213 0.165 0.130 0.267 0.318 0.261 0.261 0.219 0.113 0.228 0.268 0.192 0.148 0.158 0.086 0.067 0.219 0.190 0.244 0.201 0.113 0.109 0.240 0.179 0.235 0.210 0.131 0.149 0.292 0.244 0.216 0.169 0.184 0.224 0.292 0.238 0.199 0.141 0.122 0.172 0.258 0.170 0.220 0.223 0.147 0.193 0.308 0.185 0.175 0.167 0.101 0.159 0.526 0.371 0.235 0.183 0.208 Epoxymurin B 0.016 0.044 0.014 0.000 0.002 0.000 0.010 0.005 0.001 0.001 0.005 0.007 0.048 0.020 0.034 0.025 0.025 0.040 0.000 0.000 0.007 0.000 0.033 0.049 0.009 0.018 0.021 0.034 0.030 0.022 0.010 0.002 0.000 0.008 0.000 0.002 0.003 0.000 0.009 0.010 0.000 0.001 0.005 0.014 0.000 0.014 0.007 0.012 0.005 0.000 0.028 0.034 0.028 0.034 0.030 0.029 0.015 0.028 0.004 0.010 0.002 0.009 0.000 0.016 0.000 0.007 0.004 0.011 0.004 0.012 0.000 0.004 0.016 0.009 0.002 0.000 0.000 0.000 0.000 0.019 0.000 0.011 0.006 0.007 0.000 0.009 0.018 0.025 0.009 0.018 0.015 0.034 0.006 0.009 0.015 0.015 0.022 0.010 0.010 0.020 0.017 0.077 0.013 0.025 0.000 0.000 0.007 0.000 0.002 0.008 0.011 0.000 0.010 0.003 0.000 0.039 0.034 0.038 0.040 0.032 0.035 0.025 0.000 0.021 0.032 0.020 0.012 0.026 0.000 0.008 0.010 0.012 0.009 0.017 0.009 0.000 0.011 0.019 [FA amino(8:0)] 3-amino-octanoic acid 0.023 0.020 0.022 0.020 0.019 0.020 0.034 0.027 0.024 0.023 0.019 0.016 0.020 0.016 0.016 0.011 0.013 0.017 0.021 0.019 0.018 0.018 0.021 0.030 0.021 0.016 0.017 0.017 0.012 0.010 0.011 0.011 0.016 0.013 0.008 0.008 0.007 0.010 0.018 0.019 0.018 0.015 0.013 0.015 0.032 0.025 0.021 0.024 0.017 0.019 0.026 0.025 0.020 0.022 0.019 0.023 0.032 0.027 0.028 0.024 0.024 0.013 0.011 0.008 0.011 0.010 0.013 0.020 0.021 0.018 0.015 0.013 0.018 0.029 0.024 0.022 0.021 0.021 0.017 0.021 0.018 0.018 0.017 0.018 0.021 0.030 0.025 0.022 0.019 0.019 0.027 0.040 0.031 0.027 0.028 0.023 0.020 0.012 0.010 0.009 0.009 0.007 0.007 0.022 0.019 0.023 0.022 0.018 0.015 0.026 0.018 0.019 0.017 0.014 0.017 0.007 0.005 0.005 0.004 0.005 0.004 0.018 0.017 0.018 0.022 0.014 0.014 0.027 0.019 0.022 0.022 0.019 0.019 0.034 0.024 0.021 0.022 0.025 LysoPC(20:5(5Z,8Z,11Z,14Z,17Z)) 0.027 0.021 0.017 0.009 0.014 0.010 0.010 0.009 0.009 0.009 0.011 0.000 0.022 0.014 0.022 0.002 0.009 0.010 0.045 0.030 0.023 0.006 0.027 0.031 0.007 0.012 0.014 0.019 0.028 0.010 0.005 0.000 0.021 0.020 0.013 0.010 0.009 0.010 0.007 0.011 0.009 0.000 0.004 0.006 0.008 0.026 0.018 0.014 0.013 0.008 0.010 0.020 0.014 0.007 0.008 0.009 0.011 0.000 0.043 0.016 0.014 0.016 0.008 0.008 0.019 0.008 0.005 0.030 0.025 0.007 0.024 0.001 0.024 0.019 0.008 0.019 0.011 0.003 0.001 0.029 0.028 0.015 0.004 0.015 0.030 0.016 0.006 0.015 0.000 0.000 0.019 0.019 0.018 0.014 0.011 0.014 0.009 0.033 0.036 0.024 0.022 0.018 0.016 0.023 0.017 0.025 0.023 0.013 0.023 0.022 0.009 0.012 0.015 0.015 0.036 0.002 0.017 0.025 0.018 0.011 0.011 0.019 0.013 0.026 0.030 0.013 0.015 0.033 0.029 0.022 0.016 0.013 0.008 0.038 0.039 0.016 0.027 0.016 LysoPC(20:4(8Z,11Z,14Z,17Z)) 0.060 0.038 0.043 0.041 0.024 0.043 0.033 0.018 0.025 0.033 0.016 0.016 0.053 0.054 0.054 0.033 0.025 0.035 0.052 0.044 0.036 0.025 0.087 0.097 0.056 0.036 0.051 0.033 0.026 0.019 0.015 0.008 0.032 0.023 0.016 0.008 0.011 0.002 0.012 0.005 0.011 0.007 0.001 0.009 0.050 0.048 0.044 0.037 0.017 0.019 0.034 0.034 0.027 0.019 0.017 0.016 0.020 0.019 0.014 0.015 0.010 0.031 0.015 0.022 0.019 0.009 0.016 0.037 0.035 0.038 0.023 0.015 0.025 0.067 0.046 0.049 0.033 0.028 0.043 0.045 0.033 0.033 0.025 0.015 0.031 0.030 0.026 0.029 0.028 0.013 0.024 0.029 0.009 0.014 0.020 0.011 0.016 0.021 0.011 0.022 0.019 0.007 0.001 0.047 0.029 0.078 0.044 0.037 0.034 0.036 0.030 0.023 0.024 0.026 0.032 0.049 0.050 0.038 0.032 0.026 0.034 0.065 0.028 0.054 0.065 0.028 0.042 0.073 0.037 0.030 0.031 0.020 0.032 0.080 0.046 0.038 0.030 0.035 L-Carnitine 0.892 0.730 0.853 0.830 0.905 0.894 1.305 1.089 1.014 0.958 0.757 0.709 0.848 0.641 0.567 0.630 0.781 1.112 1.039 0.716 0.819 0.930 0.830 1.128 0.876 0.636 0.834 0.824 0.540 0.529 0.624 0.749 1.193 0.799 0.520 0.570 0.556 0.829 1.100 1.363 1.266 0.749 0.863 1.272 1.039 0.877 0.734 0.798 0.544 0.830 0.992 0.876 0.741 0.829 0.705 0.903 1.282 0.852 1.164 1.240 1.284 0.860 0.715 0.558 0.709 0.662 0.934 0.891 0.927 0.893 0.775 0.707 1.060 1.173 1.116 1.195 1.171 1.071 1.258 0.903 0.792 0.722 0.817 0.953 1.063 0.775 0.672 0.586 0.668 0.691 0.986 1.303 1.121 0.966 1.039 0.933 0.947 0.956 0.888 0.822 0.928 0.776 1.012 1.209 1.024 1.184 1.243 0.983 0.884 0.910 0.642 0.809 0.658 0.875 1.029 0.648 0.498 0.500 0.522 0.554 0.622 0.988 0.876 0.988 1.277 0.863 0.896 1.151 0.967 1.122 1.099 0.870 0.984 1.134 0.881 0.742 0.797 0.851 PS(21:0/0:0) 0.112 0.092 0.104 0.038 0.038 0.073 0.047 0.047 0.060 0.041 0.007 0.025 0.148 0.130 0.121 0.105 0.052 0.110 0.112 0.056 0.098 0.073 0.122 0.157 0.090 0.063 0.093 0.087 0.096 0.052 0.022 0.011 0.001 0.078 0.023 0.075 0.039 0.020 0.002 0.026 0.052 0.001 0.002 0.041 0.131 0.098 0.110 0.120 0.069 0.030 0.106 0.097 0.079 0.064 0.069 0.043 0.040 0.077 0.058 0.073 0.025 0.111 0.075 0.109 0.051 0.076 0.049 0.099 0.072 0.081 0.082 0.046 0.081 0.228 0.125 0.119 0.079 0.063 0.067 0.093 0.041 0.098 0.095 0.053 0.062 0.143 0.099 0.101 0.075 0.068 0.076 0.076 0.060 0.018 0.022 0.007 0.035 0.059 0.050 0.055 0.060 0.003 0.038 0.106 0.082 0.083 0.074 0.044 0.046 0.048 0.115 0.055 0.109 0.047 0.026 0.227 0.191 0.167 0.123 0.076 0.104 0.094 0.029 0.090 0.115 0.067 0.042 0.136 0.081 0.110 0.120 0.046 0.056 0.166 0.122 0.089 0.059 0.045 Cer(d18:0/20:0) 0.004 0.003 0.004 0.004 0.005 0.007 0.003 0.003 0.002 0.002 0.001 0.000 0.006 0.006 0.005 0.003 0.004 0.003 0.005 0.004 0.005 0.008 0.008 0.012 0.007 0.006 0.005 0.003 0.001 0.000 0.001 0.002 0.007 0.002 0.000 0.002 0.000 0.002 0.002 0.003 0.002 0.000 0.001 0.002 0.004 0.004 0.004 0.003 0.004 0.005 0.001 0.001 0.000 0.003 0.001 0.000 0.002 0.003 0.003 0.003 0.001 0.002 0.005 0.002 0.002 0.003 0.008 0.004 0.006 0.004 0.013 0.003 0.004 0.005 0.006 0.005 0.004 0.005 0.003 0.004 0.003 0.004 0.003 0.005 0.003 0.000 0.000 0.001 0.001 0.001 0.001 0.005 0.007 0.003 0.003 0.003 0.002 0.004 0.004 0.002 0.002 0.003 0.003 0.006 0.007 0.006 0.007 0.005 0.006 0.002 0.005 0.003 0.002 0.005 0.004 0.003 0.002 0.002 0.003 0.002 0.002 0.006 0.005 0.004 0.006 0.005 0.008 0.002 0.002 0.003 0.002 0.002 0.004 0.003 0.003 0.002 0.006 0.004 Gnidicin 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.000 0.001 0.001 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.002 0.001 0.001 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.001 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.000 0.000 0.000 0.000 0.002 0.001 0.000 0.000 0.000 0.002 0.001 Uric acid 0.082 0.056 0.081 0.058 0.080 0.053 0.110 0.098 0.092 0.105 0.101 0.096 0.105 0.085 0.105 0.089 0.073 0.083 0.075 0.069 0.080 0.108 0.073 0.119 0.069 0.058 0.071 0.094 0.077 0.080 0.070 0.076 0.171 0.112 0.095 0.100 0.087 0.084 0.063 0.078 0.082 0.062 0.077 0.077 0.069 0.065 0.063 0.074 0.079 0.067 0.082 0.081 0.064 0.092 0.089 0.080 0.068 0.072 0.087 0.095 0.064 0.085 0.060 0.085 0.088 0.088 0.064 0.103 0.084 0.121 0.108 0.108 0.101 0.107 0.092 0.109 0.100 0.117 0.114 0.081 0.075 0.077 0.069 0.086 0.060 0.092 0.077 0.106 0.070 0.100 0.095 0.090 0.073 0.055 0.069 0.065 0.069 0.091 0.115 0.100 0.086 0.101 0.092 0.067 0.061 0.017 0.072 0.079 0.048 0.042 0.041 0.043 0.042 0.056 0.035 0.061 0.057 0.085 0.080 0.079 0.064 0.084 0.053 0.067 0.102 0.069 0.056 0.063 0.055 0.072 0.063 0.071 0.075 0.094 0.095 0.068 0.078 0.095 Cer(d18:1/24:1(15Z)) 0.005 0.006 0.014 0.004 0.004 0.008 0.002 0.000 0.002 0.000 0.000 0.000 0.008 0.008 0.012 0.010 0.002 0.004 0.001 0.001 0.004 0.007 0.003 0.003 0.007 0.003 0.004 0.002 0.000 0.002 0.000 0.002 0.000 0.008 0.007 0.001 0.003 0.001 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.005 0.000 0.010 0.009 0.003 0.000 0.005 0.000 0.003 0.001 0.000 0.003 0.003 0.007 0.005 0.000 0.001 0.008 0.002 0.000 0.003 0.000 0.005 0.005 0.006 0.004 0.004 0.001 0.006 0.004 0.006 0.000 0.002 0.012 0.010 0.001 0.008 0.009 0.005 0.001 0.000 0.000 0.000 0.000 0.000 0.001 0.006 0.000 0.000 0.005 0.003 0.006 0.004 0.000 0.008 0.005 0.004 0.003 0.012 0.008 0.001 0.018 0.004 0.001 0.000 0.001 0.003 0.000 0.008 0.000 0.000 0.000 0.003 0.000 0.000 0.000 0.007 0.003 0.007 0.004 0.008 0.006 0.001 0.000 0.002 0.000 0.001 0.000 0.003 0.005 0.002 0.005 0.000 N-(2-hydroxytetracosanoyl)-4,8-sphingadienine 0.008 0.010 0.020 0.013 0.024 0.016 0.022 0.019 0.021 0.022 0.018 0.017 0.017 0.021 0.013 0.027 0.019 0.020 0.022 0.018 0.029 0.027 0.011 0.020 0.014 0.012 0.012 0.014 0.013 0.023 0.012 0.014 0.006 0.009 0.017 0.013 0.012 0.014 0.010 0.009 0.013 0.011 0.010 0.013 0.013 0.007 0.009 0.015 0.019 0.008 0.011 0.016 0.013 0.023 0.022 0.013 0.014 0.014 0.012 0.013 0.009 0.023 0.020 0.019 0.011 0.021 0.013 0.025 0.016 0.020 0.012 0.019 0.007 0.021 0.022 0.015 0.017 0.016 0.022 0.021 0.014 0.020 0.022 0.038 0.017 0.017 0.016 0.021 0.020 0.023 0.020 0.003 0.005 0.001 0.001 0.001 0.000 0.003 0.004 0.005 0.001 0.003 0.014 0.006 0.005 0.005 0.003 0.003 0.003 0.000 0.000 0.001 0.000 0.000 0.000 0.011 0.001 0.003 0.007 0.002 0.002 0.016 0.007 0.013 0.013 0.016 0.008 0.006 0.004 0.006 0.002 0.010 0.007 0.013 0.014 0.009 0.014 0.010 PE(P-18:1(9Z)/14:1(9Z)) 0.006 0.005 0.006 0.003 0.004 0.004 0.005 0.005 0.005 0.008 0.003 0.005 0.004 0.005 0.006 0.005 0.004 0.006 0.005 0.003 0.005 0.004 0.005 0.006 0.004 0.005 0.005 0.005 0.005 0.006 0.004 0.004 0.000 0.006 0.003 0.003 0.006 0.005 0.004 0.005 0.005 0.005 0.006 0.004 0.006 0.005 0.006 0.007 0.005 0.006 0.005 0.006 0.005 0.005 0.006 0.004 0.005 0.006 0.005 0.007 0.006 0.005 0.004 0.005 0.002 0.007 0.004 0.005 0.004 0.004 0.006 0.005 0.005 0.005 0.005 0.006 0.004 0.003 0.004 0.005 0.003 0.004 0.004 0.005 0.006 0.003 0.005 0.004 0.004 0.005 0.004 0.006 0.005 0.004 0.005 0.006 0.006 0.005 0.006 0.004 0.005 0.004 0.005 0.005 0.005 0.002 0.004 0.005 0.004 0.004 0.005 0.004 0.004 0.005 0.004 0.004 0.004 0.006 0.005 0.005 0.005 0.006 0.004 0.005 0.006 0.005 0.005 0.005 0.003 0.005 0.004 0.006 0.005 0.004 0.005 0.005 0.003 0.002 PE(P-18:1(9Z)/14:0) 0.006 0.006 0.007 0.006 0.005 0.004 0.006 0.004 0.006 0.005 0.002 0.006 0.005 0.006 0.007 0.004 0.004 0.006 0.004 0.002 0.005 0.005 0.005 0.008 0.006 0.003 0.005 0.008 0.006 0.007 0.005 0.004 0.000 0.005 0.004 0.004 0.006 0.006 0.004 0.003 0.005 0.004 0.005 0.006 0.005 0.005 0.005 0.006 0.007 0.006 0.005 0.006 0.004 0.006 0.006 0.004 0.005 0.006 0.007 0.006 0.007 0.005 0.005 0.006 0.003 0.006 0.004 0.004 0.004 0.006 0.004 0.005 0.004 0.005 0.004 0.006 0.005 0.004 0.004 0.004 0.004 0.005 0.004 0.008 0.005 0.005 0.006 0.004 0.005 0.005 0.007 0.005 0.005 0.005 0.006 0.004 0.007 0.007 0.007 0.005 0.006 0.004 0.006 0.004 0.007 0.002 0.006 0.006 0.006 0.004 0.006 0.005 0.005 0.005 0.005 0.005 0.004 0.006 0.006 0.006 0.007 0.006 0.006 0.006 0.007 0.005 0.006 0.004 0.003 0.006 0.003 0.006 0.005 0.005 0.006 0.004 0.004 0.004 Hymenocardine 0.026 0.026 0.009 0.025 0.009 0.023 0.009 0.009 0.022 0.009 0.020 0.009 0.028 0.024 0.009 0.009 0.009 0.009 0.023 0.022 0.019 0.019 0.009 0.025 0.024 0.024 0.024 0.009 0.009 0.009 0.020 0.009 0.018 0.022 0.009 0.023 0.009 0.023 0.023 0.022 0.021 0.020 0.021 0.020 0.009 0.009 0.026 0.025 0.022 0.009 0.009 0.026 0.021 0.021 0.021 0.019 0.009 0.025 0.009 0.009 0.024 0.021 0.019 0.021 0.009 0.020 0.009 0.027 0.027 0.009 0.009 0.027 0.023 0.009 0.009 0.023 0.009 0.020 0.021 0.009 0.026 0.023 0.021 0.024 0.009 0.018 0.023 0.022 0.022 0.020 0.019 0.009 0.028 0.028 0.009 0.028 0.009 0.009 0.030 0.031 0.009 0.029 0.031 0.027 0.028 0.009 0.033 0.030 0.009 0.028 0.009 0.029 0.031 0.029 0.028 0.024 0.026 0.026 0.025 0.026 0.027 0.009 0.026 0.028 0.027 0.027 0.026 0.023 0.022 0.024 0.025 0.027 0.009 0.025 0.009 0.009 0.009 0.009 Bruceoside A 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 SM(d33:1) 0.006 0.004 0.004 0.004 0.004 0.007 0.006 0.005 0.003 0.002 0.003 0.003 0.003 0.005 0.002 0.003 0.002 0.002 0.008 0.010 0.008 0.008 0.010 0.017 0.010 0.008 0.006 0.002 0.001 0.000 0.001 0.000 0.001 0.003 0.003 0.003 0.002 0.001 0.005 0.006 0.006 0.004 0.002 0.000 0.005 0.003 0.002 0.001 0.003 0.001 0.004 0.002 0.002 0.002 0.002 0.000 0.005 0.007 0.004 0.002 0.002 0.006 0.004 0.002 0.004 0.005 0.006 0.010 0.006 0.005 0.005 0.003 0.005 0.007 0.004 0.005 0.003 0.002 0.004 0.006 0.004 0.004 0.004 0.005 0.004 0.002 0.001 0.004 0.002 0.000 0.003 0.006 0.005 0.006 0.006 0.005 0.007 0.007 0.005 0.004 0.004 0.003 0.004 0.010 0.010 0.011 0.013 0.009 0.008 0.006 0.002 0.003 0.004 0.006 0.008 0.004 0.002 0.005 0.001 0.002 0.003 0.006 0.008 0.006 0.008 0.004 0.006 0.002 0.002 0.003 0.004 0.004 0.003 0.008 0.005 0.002 0.007 0.007 Spirolide B 0.005 0.003 0.005 0.003 0.005 0.003 0.004 0.004 0.005 0.004 0.004 0.004 0.005 0.004 0.004 0.003 0.003 0.006 0.003 0.001 0.002 0.004 0.003 0.004 0.005 0.003 0.003 0.006 0.004 0.005 0.004 0.003 0.001 0.004 0.003 0.002 0.004 0.005 0.003 0.004 0.004 0.004 0.006 0.004 0.005 0.003 0.004 0.005 0.004 0.004 0.007 0.003 0.004 0.003 0.004 0.003 0.003 0.004 0.005 0.003 0.004 0.004 0.004 0.003 0.001 0.005 0.002 0.003 0.003 0.004 0.003 0.003 0.005 0.003 0.003 0.004 0.003 0.004 0.005 0.004 0.002 0.005 0.004 0.004 0.003 0.003 0.004 0.003 0.003 0.004 0.004 0.004 0.003 0.003 0.004 0.003 0.004 0.005 0.005 0.003 0.004 0.004 0.005 0.004 0.004 0.002 0.004 0.005 0.003 0.004 0.004 0.005 0.006 0.003 0.003 0.005 0.002 0.004 0.004 0.005 0.004 0.005 0.003 0.003 0.004 0.005 0.004 0.004 0.003 0.004 0.003 0.003 0.002 0.003 0.005 0.004 0.003 0.004 SM(d34:2) 0.028 0.023 0.019 0.018 0.029 0.034 0.037 0.030 0.019 0.019 0.021 0.021 0.024 0.029 0.025 0.023 0.023 0.027 0.031 0.030 0.032 0.036 0.044 0.051 0.041 0.026 0.026 0.017 0.011 0.012 0.010 0.017 0.017 0.019 0.030 0.018 0.016 0.017 0.019 0.027 0.024 0.014 0.013 0.011 0.021 0.020 0.016 0.019 0.016 0.018 0.016 0.013 0.018 0.021 0.017 0.012 0.021 0.024 0.025 0.016 0.015 0.026 0.033 0.022 0.025 0.022 0.033 0.021 0.029 0.025 0.024 0.016 0.023 0.036 0.025 0.024 0.023 0.025 0.025 0.030 0.027 0.025 0.025 0.026 0.021 0.022 0.016 0.024 0.016 0.013 0.016 0.033 0.036 0.026 0.024 0.025 0.024 0.026 0.023 0.021 0.020 0.022 0.021 0.026 0.032 0.029 0.036 0.024 0.023 0.022 0.015 0.020 0.018 0.026 0.020 0.022 0.017 0.018 0.017 0.015 0.013 0.034 0.034 0.035 0.041 0.032 0.038 0.016 0.013 0.014 0.015 0.017 0.019 0.032 0.027 0.019 0.034 0.032 SM(d18:0/16:1(9Z)) 0.166 0.127 0.136 0.123 0.135 0.161 0.210 0.182 0.147 0.146 0.152 0.132 0.171 0.148 0.165 0.140 0.141 0.155 0.184 0.166 0.180 0.187 0.284 0.351 0.249 0.197 0.195 0.103 0.077 0.074 0.073 0.081 0.086 0.126 0.144 0.101 0.100 0.106 0.137 0.138 0.144 0.105 0.097 0.091 0.132 0.109 0.107 0.126 0.108 0.104 0.105 0.099 0.107 0.110 0.107 0.081 0.133 0.150 0.136 0.110 0.100 0.159 0.148 0.136 0.145 0.132 0.146 0.151 0.153 0.161 0.126 0.116 0.154 0.207 0.157 0.168 0.141 0.161 0.171 0.166 0.141 0.148 0.132 0.133 0.130 0.143 0.125 0.155 0.124 0.099 0.110 0.222 0.175 0.165 0.165 0.166 0.155 0.160 0.155 0.142 0.142 0.151 0.130 0.166 0.192 0.193 0.199 0.158 0.147 0.134 0.103 0.111 0.111 0.143 0.127 0.141 0.123 0.116 0.128 0.120 0.121 0.184 0.143 0.180 0.225 0.176 0.169 0.118 0.084 0.095 0.100 0.100 0.122 0.204 0.150 0.123 0.167 0.187 [ST (20:4)] cholest-5-en-3beta-yl (15S-hydroperoxy-5Z,8Z,12E,14Z-eicosatetraenoate) 0.020 0.014 0.020 0.016 0.012 0.022 0.023 0.024 0.019 0.018 0.019 0.015 0.019 0.019 0.020 0.016 0.018 0.019 0.023 0.021 0.014 0.016 0.035 0.042 0.031 0.023 0.023 0.015 0.004 0.004 0.009 0.011 0.011 0.014 0.016 0.008 0.012 0.009 0.015 0.018 0.017 0.012 0.008 0.011 0.017 0.015 0.013 0.017 0.013 0.015 0.014 0.007 0.007 0.013 0.012 0.009 0.019 0.020 0.018 0.015 0.012 0.020 0.019 0.015 0.017 0.012 0.014 0.020 0.020 0.020 0.015 0.011 0.021 0.023 0.018 0.019 0.017 0.019 0.019 0.023 0.017 0.018 0.016 0.018 0.015 0.018 0.011 0.015 0.015 0.013 0.014 0.024 0.024 0.020 0.022 0.022 0.024 0.019 0.022 0.020 0.020 0.021 0.013 0.021 0.023 0.026 0.026 0.020 0.020 0.016 0.013 0.016 0.010 0.019 0.014 0.018 0.016 0.016 0.016 0.015 0.010 0.022 0.015 0.022 0.028 0.016 0.017 0.013 0.011 0.014 0.011 0.017 0.016 0.024 0.020 0.016 0.023 0.023 PE-NMe(16:0/16:0) 0.009 0.006 0.008 0.008 0.007 0.009 0.002 0.003 0.003 0.003 0.002 0.001 0.007 0.007 0.010 0.005 0.005 0.006 0.015 0.010 0.010 0.009 0.013 0.016 0.014 0.008 0.009 0.001 0.001 0.000 0.000 0.000 0.002 0.001 0.000 0.001 0.000 0.001 0.006 0.010 0.007 0.005 0.003 0.003 0.005 0.005 0.004 0.004 0.000 0.002 0.004 0.005 0.003 0.005 0.002 0.002 0.005 0.007 0.005 0.004 0.003 0.007 0.006 0.006 0.005 0.007 0.009 0.018 0.018 0.016 0.015 0.010 0.014 0.013 0.008 0.009 0.006 0.006 0.005 0.004 0.007 0.003 0.004 0.003 0.005 0.008 0.007 0.010 0.005 0.006 0.005 0.005 0.007 0.004 0.006 0.006 0.006 0.005 0.004 0.003 0.004 0.005 0.002 0.013 0.011 0.010 0.013 0.010 0.011 0.003 0.002 0.003 0.003 0.005 0.005 0.006 0.006 0.004 0.005 0.003 0.003 0.004 0.002 0.006 0.008 0.004 0.006 0.005 0.003 0.005 0.004 0.003 0.003 0.004 0.004 0.002 0.005 0.009 SM(d18:0/16:0) 0.002 0.000 0.002 0.002 0.005 0.001 0.004 0.002 0.000 0.000 0.001 0.001 0.003 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.005 0.006 0.007 0.005 0.003 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.000 0.001 0.000 0.004 0.002 0.000 0.000 0.000 0.000 0.002 0.001 0.002 0.001 0.001 0.000 0.000 0.000 0.002 0.000 0.000 0.000 0.001 0.001 0.001 0.001 0.000 0.000 0.002 0.002 0.000 0.000 0.001 0.001 0.000 0.003 0.002 0.004 0.002 0.000 0.002 0.000 0.001 0.002 0.004 0.000 0.003 0.001 0.002 0.001 0.001 0.002 0.003 0.001 0.000 0.000 0.003 0.001 0.003 0.003 0.003 0.004 0.003 0.003 0.003 0.002 0.002 0.002 0.003 0.004 0.005 0.004 0.002 0.002 0.000 0.001 0.002 0.002 0.003 0.003 0.002 0.002 0.000 0.001 0.002 0.001 0.003 0.002 0.002 0.003 0.002 0.001 0.000 0.000 0.000 0.001 0.001 0.001 0.003 0.002 0.002 0.003 0.003 TG(41:0) 0.031 0.025 0.029 0.028 0.031 0.042 0.036 0.034 0.021 0.022 0.022 0.020 0.024 0.021 0.021 0.020 0.019 0.022 0.032 0.028 0.032 0.035 0.038 0.048 0.036 0.026 0.025 0.016 0.013 0.010 0.011 0.014 0.014 0.021 0.030 0.017 0.019 0.018 0.022 0.022 0.023 0.013 0.013 0.012 0.015 0.011 0.013 0.013 0.014 0.012 0.013 0.013 0.013 0.015 0.014 0.007 0.018 0.022 0.022 0.018 0.016 0.025 0.025 0.021 0.022 0.020 0.023 0.020 0.024 0.021 0.017 0.017 0.022 0.031 0.023 0.024 0.022 0.023 0.023 0.023 0.021 0.018 0.018 0.019 0.017 0.014 0.013 0.019 0.013 0.010 0.011 0.030 0.028 0.022 0.020 0.022 0.022 0.021 0.019 0.019 0.020 0.017 0.018 0.027 0.028 0.039 0.037 0.027 0.023 0.022 0.017 0.022 0.019 0.024 0.021 0.015 0.015 0.015 0.015 0.016 0.015 0.026 0.024 0.027 0.034 0.026 0.027 0.015 0.013 0.012 0.013 0.014 0.016 0.029 0.021 0.017 0.030 0.030 DG(43:5) 0.115 0.210 0.115 0.055 0.097 0.086 0.134 0.103 0.099 0.096 0.068 0.089 0.108 0.115 0.108 0.095 0.068 0.119 0.106 0.064 0.112 0.112 0.142 0.210 0.139 0.102 0.118 0.078 0.052 0.063 0.038 0.051 0.018 0.092 0.080 0.056 0.073 0.073 0.068 0.085 0.101 0.061 0.079 0.087 0.099 0.085 0.057 0.091 0.089 0.074 0.078 0.068 0.052 0.086 0.085 0.074 0.091 0.102 0.096 0.078 0.058 0.114 0.117 0.102 0.047 0.086 0.068 0.097 0.080 0.109 0.092 0.078 0.100 0.160 0.109 0.112 0.083 0.111 0.105 0.112 0.057 0.105 0.092 0.110 0.080 0.110 0.093 0.099 0.061 0.089 0.114 0.159 0.109 0.087 0.084 0.094 0.096 0.101 0.095 0.107 0.086 0.312 0.082 0.120 0.099 0.051 0.144 0.079 0.091 0.069 0.065 0.054 0.050 0.088 0.049 0.107 0.049 0.101 0.069 0.075 0.077 0.103 0.092 0.108 0.136 0.107 0.103 0.083 0.036 0.064 0.043 0.058 0.061 0.114 0.107 0.058 0.104 0.086 Tin chloride (SnCl4) 0.026 0.022 0.026 0.022 0.028 0.023 0.028 0.029 0.022 0.029 0.021 0.025 0.023 0.025 0.026 0.024 0.022 0.024 0.022 0.020 0.022 0.030 0.022 0.026 0.029 0.023 0.021 0.023 0.025 0.022 0.021 0.026 0.016 0.025 0.026 0.022 0.024 0.026 0.017 0.026 0.022 0.024 0.026 0.026 0.025 0.025 0.022 0.027 0.023 0.024 0.022 0.024 0.020 0.024 0.023 0.022 0.024 0.021 0.029 0.022 0.022 0.021 0.029 0.024 0.019 0.021 0.022 0.025 0.024 0.026 0.028 0.024 0.021 0.028 0.022 0.025 0.024 0.025 0.023 0.022 0.020 0.022 0.027 0.026 0.022 0.025 0.022 0.024 0.019 0.024 0.026 0.024 0.025 0.020 0.023 0.020 0.023 0.023 0.023 0.022 0.024 0.024 0.022 0.024 0.023 0.020 0.029 0.021 0.021 0.022 0.021 0.023 0.018 0.021 0.021 0.023 0.022 0.026 0.025 0.024 0.023 0.026 0.027 0.023 0.025 0.023 0.025 0.020 0.019 0.026 0.017 0.018 0.023 0.022 0.026 0.022 0.024 0.021 PG(16:0/16:0) 0.002 0.007 0.003 0.005 0.002 0.001 0.003 0.000 0.000 0.000 0.000 0.000 0.013 0.013 0.004 0.007 0.000 0.001 0.000 0.000 0.000 0.000 0.005 0.002 0.003 0.000 0.003 0.000 0.002 0.003 0.002 0.004 0.000 0.000 0.003 0.001 0.003 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.004 0.010 0.000 0.002 0.001 0.000 0.000 0.017 0.000 0.000 0.000 0.000 0.002 0.007 0.000 0.000 0.003 0.000 0.000 0.000 0.004 0.000 0.000 0.004 0.006 0.002 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.005 0.007 0.009 0.004 0.003 0.000 0.000 0.001 0.000 0.002 0.000 0.000 0.006 0.005 0.008 0.005 0.009 0.006 0.007 0.006 0.007 0.007 0.006 0.012 0.005 0.003 0.009 0.009 0.003 0.004 0.005 0.005 0.005 0.006 0.008 0.004 0.005 0.003 0.001 0.000 0.003 0.006 0.003 0.005 0.003 0.006 0.004 0.003 0.000 0.003 0.002 0.000 0.010 0.001 0.001 0.007 0.001 0.001 0.013 PE(P-18:1(9Z)/18:3(6Z,9Z,12Z)) 0.003 0.003 0.003 0.001 0.002 0.002 0.008 0.003 0.002 0.001 0.001 0.002 0.004 0.005 0.006 0.003 0.010 0.003 0.004 0.004 0.006 0.004 0.006 0.007 0.004 0.007 0.003 0.003 0.003 0.002 0.002 0.002 0.002 0.002 0.004 0.001 0.002 0.000 0.003 0.003 0.002 0.001 0.002 0.001 0.004 0.002 0.004 0.003 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.001 0.003 0.002 0.002 0.002 0.000 0.000 0.002 0.001 0.002 0.003 0.001 0.003 0.002 0.002 0.002 0.001 0.002 0.007 0.005 0.003 0.004 0.008 0.004 0.002 0.004 0.003 0.003 0.002 0.002 0.002 0.002 0.003 0.000 0.000 0.002 0.004 0.004 0.003 0.003 0.004 0.004 0.003 0.005 0.002 0.002 0.002 0.002 0.003 0.003 0.002 0.004 0.008 0.004 0.003 0.002 0.001 0.002 0.002 0.002 0.003 0.002 0.001 0.002 0.001 0.001 0.003 0.001 0.003 0.005 0.003 0.002 0.002 0.001 0.002 0.000 0.002 0.002 0.005 0.003 0.003 0.005 0.003 SM(d18:1/18:1(11Z)) 0.014 0.014 0.011 0.013 0.014 0.017 0.013 0.011 0.008 0.007 0.008 0.007 0.010 0.008 0.011 0.022 0.008 0.009 0.013 0.013 0.011 0.013 0.015 0.017 0.013 0.012 0.011 0.017 0.003 0.004 0.003 0.004 0.017 0.009 0.011 0.010 0.007 0.011 0.007 0.007 0.029 0.004 0.003 0.022 0.007 0.021 0.008 0.007 0.007 0.006 0.004 0.007 0.007 0.004 0.007 0.003 0.008 0.009 0.006 0.022 0.005 0.008 0.009 0.007 0.009 0.007 0.010 0.008 0.010 0.008 0.015 0.009 0.006 0.010 0.010 0.009 0.007 0.012 0.011 0.010 0.008 0.006 0.023 0.032 0.008 0.022 0.007 0.021 0.005 0.003 0.004 0.013 0.014 0.010 0.010 0.010 0.012 0.028 0.011 0.007 0.008 0.006 0.008 0.009 0.011 0.013 0.013 0.011 0.022 0.028 0.007 0.008 0.006 0.010 0.009 0.007 0.006 0.007 0.007 0.007 0.007 0.012 0.010 0.012 0.017 0.012 0.012 0.005 0.006 0.005 0.005 0.007 0.008 0.013 0.024 0.007 0.011 0.011 PE(20:2(11Z,14Z)/15:0) 0.010 0.009 0.010 0.009 0.008 0.006 0.000 0.000 0.001 0.002 0.000 0.001 0.013 0.013 0.014 0.012 0.013 0.008 0.012 0.011 0.013 0.008 0.012 0.013 0.011 0.008 0.006 0.004 0.000 0.003 0.003 0.001 0.003 0.004 0.002 0.003 0.003 0.003 0.010 0.008 0.009 0.006 0.003 0.002 0.003 0.003 0.004 0.005 0.003 0.002 0.002 0.002 0.002 0.002 0.002 0.000 0.004 0.007 0.008 0.006 0.002 0.007 0.007 0.008 0.008 0.005 0.006 0.011 0.012 0.012 0.008 0.010 0.010 0.011 0.008 0.009 0.007 0.007 0.007 0.009 0.009 0.008 0.008 0.009 0.005 0.006 0.004 0.007 0.005 0.005 0.003 0.012 0.007 0.004 0.006 0.005 0.006 0.008 0.007 0.007 0.005 0.007 0.003 0.012 0.014 0.007 0.015 0.010 0.008 0.007 0.005 0.006 0.006 0.007 0.005 0.004 0.006 0.005 0.006 0.003 0.002 0.007 0.003 0.011 0.008 0.008 0.006 0.007 0.004 0.005 0.003 0.003 0.003 0.009 0.004 0.005 0.006 0.010 PE(18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z)) 0.004 0.004 0.007 0.004 0.004 0.003 0.003 0.003 0.006 0.005 0.003 0.003 0.004 0.005 0.004 0.005 0.005 0.005 0.004 0.003 0.004 0.004 0.003 0.005 0.004 0.006 0.005 0.005 0.004 0.004 0.004 0.004 0.001 0.006 0.003 0.002 0.005 0.004 0.002 0.003 0.004 0.004 0.005 0.005 0.005 0.004 0.004 0.005 0.005 0.004 0.005 0.007 0.004 0.005 0.004 0.004 0.004 0.005 0.004 0.005 0.005 0.004 0.004 0.006 0.002 0.006 0.003 0.004 0.003 0.004 0.004 0.005 0.003 0.005 0.005 0.004 0.003 0.003 0.004 0.004 0.003 0.005 0.004 0.004 0.004 0.004 0.005 0.003 0.003 0.004 0.004 0.003 0.003 0.005 0.005 0.004 0.005 0.004 0.004 0.003 0.004 0.004 0.005 0.004 0.005 0.002 0.004 0.003 0.003 0.003 0.005 0.005 0.005 0.004 0.003 0.004 0.002 0.005 0.004 0.006 0.003 0.004 0.003 0.002 0.004 0.004 0.004 0.005 0.003 0.004 0.003 0.004 0.004 0.004 0.005 0.005 0.004 0.004 PE-NMe(16:0/18:1(9Z)) 0.044 0.041 0.040 0.038 0.037 0.033 0.013 0.015 0.016 0.018 0.019 0.014 0.110 0.215 0.112 0.094 0.193 0.072 0.039 0.032 0.048 0.123 0.052 0.070 0.050 0.046 0.031 0.004 0.000 0.000 0.000 0.000 0.000 0.010 0.007 0.005 0.007 0.012 0.070 0.163 0.062 0.040 0.032 0.023 0.024 0.023 0.030 0.036 0.026 0.015 0.004 0.008 0.004 0.008 0.016 0.000 0.021 0.026 0.021 0.019 0.013 0.044 0.040 0.048 0.041 0.053 0.044 0.034 0.141 0.053 0.031 0.032 0.039 0.201 0.063 0.064 0.057 0.050 0.050 0.026 0.020 0.021 0.034 0.022 0.033 0.059 0.018 0.023 0.024 0.019 0.025 0.052 0.039 0.036 0.039 0.038 0.034 0.024 0.018 0.018 0.022 0.027 0.017 0.028 0.051 0.019 0.053 0.035 0.027 0.015 0.014 0.016 0.015 0.020 0.023 0.023 0.019 0.012 0.018 0.015 0.017 0.042 0.017 0.048 0.148 0.034 0.025 0.031 0.023 0.027 0.025 0.023 0.029 0.035 0.022 0.025 0.032 0.043 PC(P-18:0/15:0) 0.002 0.000 0.002 0.003 0.003 0.000 0.000 0.000 0.000 0.000 0.000 0.003 0.002 0.004 0.002 0.004 0.000 0.003 0.003 0.003 0.002 0.000 0.000 0.002 0.003 0.004 0.002 0.002 0.000 0.000 0.002 0.000 0.000 0.000 0.004 0.005 0.003 0.005 0.000 0.000 0.003 0.000 0.000 0.000 0.000 0.002 0.007 0.005 0.003 0.002 0.003 0.001 0.003 0.004 0.002 0.003 0.000 0.003 0.000 0.001 0.001 0.004 0.000 0.000 0.003 0.004 0.000 0.002 0.000 0.004 0.000 0.000 0.003 0.000 0.000 0.000 0.001 0.004 0.001 0.001 0.003 0.000 0.004 0.004 0.000 0.001 0.003 0.002 0.000 0.000 0.001 0.004 0.003 0.005 0.000 0.005 0.004 0.005 0.000 0.002 0.001 0.002 0.000 0.000 0.000 0.001 0.000 0.004 0.005 0.000 0.002 0.002 0.002 0.004 0.002 0.000 0.002 0.003 0.000 0.004 0.002 0.000 0.000 0.004 0.002 0.002 0.003 0.000 0.004 0.002 0.000 0.004 0.000 0.002 0.003 0.002 0.000 0.000 N-desmethylclarithromycin 0.004 0.006 0.007 0.005 0.006 0.004 0.005 0.003 0.004 0.006 0.004 0.004 0.007 0.006 0.006 0.005 0.004 0.005 0.004 0.003 0.005 0.004 0.003 0.005 0.004 0.004 0.005 0.005 0.004 0.005 0.004 0.005 0.001 0.005 0.004 0.004 0.005 0.004 0.004 0.004 0.004 0.005 0.004 0.005 0.004 0.005 0.005 0.005 0.005 0.004 0.005 0.005 0.004 0.004 0.005 0.006 0.004 0.005 0.004 0.005 0.005 0.004 0.004 0.005 0.002 0.005 0.003 0.004 0.005 0.004 0.004 0.004 0.004 0.003 0.005 0.007 0.005 0.004 0.004 0.004 0.003 0.005 0.004 0.004 0.004 0.005 0.005 0.004 0.004 0.006 0.005 0.003 0.004 0.004 0.005 0.006 0.006 0.005 0.005 0.005 0.006 0.004 0.006 0.004 0.004 0.002 0.004 0.005 0.005 0.004 0.006 0.004 0.004 0.004 0.004 0.004 0.003 0.006 0.003 0.004 0.005 0.005 0.003 0.006 0.005 0.003 0.004 0.004 0.004 0.004 0.002 0.004 0.004 0.004 0.004 0.005 0.004 0.003 PC(16:0/16:0) 0.025 0.018 0.018 0.016 0.026 0.041 0.041 0.035 0.014 0.014 0.018 0.025 0.025 0.051 0.025 0.028 0.024 0.028 0.030 0.027 0.039 0.043 0.042 0.058 0.054 0.023 0.023 0.015 0.008 0.011 0.011 0.022 0.024 0.014 0.032 0.016 0.013 0.013 0.025 0.030 0.025 0.015 0.014 0.009 0.031 0.018 0.012 0.018 0.015 0.016 0.021 0.011 0.016 0.018 0.014 0.008 0.024 0.021 0.030 0.017 0.010 0.023 0.038 0.018 0.019 0.020 0.040 0.023 0.030 0.026 0.032 0.014 0.034 0.056 0.025 0.021 0.033 0.024 0.018 0.025 0.021 0.020 0.021 0.022 0.019 0.023 0.012 0.026 0.013 0.010 0.014 0.028 0.032 0.023 0.020 0.026 0.019 0.026 0.022 0.018 0.020 0.022 0.020 0.034 0.022 0.035 0.036 0.018 0.028 0.019 0.010 0.012 0.011 0.020 0.013 0.024 0.018 0.023 0.014 0.013 0.013 0.024 0.033 0.026 0.027 0.023 0.037 0.014 0.011 0.026 0.012 0.017 0.016 0.024 0.023 0.014 0.041 0.030 Stenopalustroside A 0.014 0.067 0.031 0.006 0.020 0.017 0.030 0.015 0.030 0.000 0.000 0.000 0.012 0.032 0.032 0.027 0.012 0.032 0.000 0.000 0.002 0.019 0.011 0.047 0.017 0.007 0.001 0.002 0.000 0.000 0.000 0.000 0.000 0.006 0.003 0.000 0.011 0.001 0.000 0.009 0.001 0.000 0.020 0.009 0.022 0.000 0.000 0.037 0.026 0.000 0.000 0.000 0.000 0.002 0.025 0.021 0.000 0.011 0.010 0.013 0.000 0.000 0.031 0.000 0.000 0.009 0.000 0.009 0.022 0.010 0.010 0.003 0.000 0.042 0.016 0.037 0.006 0.007 0.000 0.011 0.000 0.009 0.021 0.022 0.000 0.007 0.000 0.000 0.000 0.017 0.012 0.019 0.022 0.000 0.005 0.005 0.008 0.011 0.010 0.021 0.000 0.067 0.023 0.016 0.022 0.000 0.025 0.000 0.008 0.000 0.004 0.000 0.000 0.005 0.000 0.006 0.000 0.015 0.000 0.021 0.014 0.013 0.009 0.012 0.024 0.027 0.016 0.000 0.000 0.006 0.000 0.000 0.000 0.026 0.000 0.001 0.002 0.000 PC(o-16:1(9Z)/18:2(9Z,12Z)) 0.020 0.014 0.017 0.013 0.012 0.011 0.019 0.014 0.015 0.015 0.016 0.012 0.027 0.020 0.026 0.022 0.021 0.024 0.031 0.029 0.028 0.027 0.028 0.035 0.021 0.020 0.018 0.020 0.016 0.018 0.014 0.013 0.014 0.015 0.013 0.011 0.012 0.011 0.015 0.011 0.015 0.010 0.009 0.008 0.021 0.016 0.015 0.019 0.016 0.014 0.009 0.012 0.010 0.011 0.012 0.007 0.016 0.016 0.013 0.014 0.010 0.018 0.013 0.014 0.016 0.015 0.015 0.017 0.015 0.018 0.012 0.013 0.017 0.028 0.022 0.023 0.020 0.026 0.022 0.022 0.021 0.017 0.013 0.011 0.014 0.016 0.015 0.020 0.014 0.012 0.014 0.031 0.025 0.023 0.023 0.026 0.020 0.022 0.021 0.021 0.022 0.020 0.017 0.019 0.018 0.009 0.017 0.018 0.017 0.015 0.012 0.011 0.012 0.015 0.011 0.017 0.017 0.015 0.017 0.013 0.015 0.023 0.015 0.021 0.028 0.020 0.018 0.017 0.014 0.015 0.015 0.013 0.017 0.026 0.020 0.018 0.017 0.023 Hordatine B glucoside 0.004 0.006 0.003 0.003 0.002 0.003 0.001 0.003 0.004 0.004 0.002 0.002 0.002 0.004 0.003 0.002 0.004 0.003 0.002 0.002 0.002 0.002 0.002 0.004 0.003 0.003 0.003 0.004 0.003 0.003 0.002 0.002 0.001 0.003 0.002 0.003 0.003 0.003 0.002 0.002 0.004 0.002 0.003 0.004 0.002 0.004 0.002 0.003 0.003 0.002 0.004 0.002 0.001 0.003 0.003 0.003 0.002 0.002 0.002 0.003 0.002 0.003 0.003 0.003 0.003 0.003 0.002 0.003 0.003 0.003 0.004 0.003 0.002 0.003 0.003 0.003 0.003 0.002 0.002 0.004 0.002 0.003 0.001 0.002 0.003 0.003 0.003 0.002 0.003 0.003 0.004 0.002 0.003 0.002 0.002 0.003 0.003 0.004 0.004 0.004 0.003 0.003 0.003 0.003 0.004 0.001 0.003 0.004 0.003 0.003 0.006 0.002 0.003 0.003 0.003 0.003 0.001 0.003 0.003 0.002 0.004 0.004 0.004 0.003 0.003 0.002 0.003 0.002 0.002 0.001 0.003 0.003 0.003 0.003 0.002 0.003 0.003 0.002 PC(O-16:0/18:2(9Z,12Z)) 0.014 0.011 0.009 0.009 0.014 0.016 0.020 0.016 0.010 0.008 0.011 0.011 0.019 0.025 0.019 0.019 0.017 0.021 0.036 0.035 0.032 0.033 0.019 0.023 0.020 0.011 0.009 0.020 0.013 0.017 0.014 0.018 0.021 0.011 0.015 0.009 0.010 0.007 0.010 0.010 0.015 0.004 0.005 0.005 0.016 0.012 0.011 0.013 0.009 0.008 0.009 0.006 0.007 0.008 0.006 0.004 0.013 0.013 0.014 0.011 0.006 0.015 0.017 0.011 0.013 0.012 0.016 0.013 0.018 0.015 0.016 0.008 0.013 0.022 0.014 0.014 0.013 0.015 0.012 0.017 0.017 0.012 0.014 0.013 0.012 0.015 0.010 0.014 0.009 0.006 0.010 0.021 0.027 0.017 0.014 0.019 0.012 0.022 0.015 0.014 0.014 0.013 0.012 0.014 0.012 0.016 0.016 0.012 0.014 0.010 0.006 0.007 0.007 0.009 0.009 0.016 0.012 0.012 0.009 0.010 0.008 0.017 0.018 0.016 0.020 0.014 0.019 0.011 0.007 0.014 0.010 0.012 0.009 0.019 0.017 0.012 0.019 0.016 PE(P-18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) 0.023 0.047 0.014 0.004 0.004 0.001 0.010 0.005 0.024 0.010 0.004 0.011 0.018 0.021 0.013 0.022 0.014 0.018 0.022 0.016 0.019 0.015 0.017 0.041 0.024 0.009 0.012 0.024 0.009 0.025 0.008 0.004 0.000 0.018 0.004 0.005 0.011 0.015 0.010 0.006 0.018 0.006 0.017 0.009 0.020 0.017 0.009 0.018 0.028 0.015 0.024 0.023 0.006 0.006 0.009 0.003 0.007 0.015 0.009 0.012 0.009 0.022 0.009 0.015 0.008 0.017 0.004 0.012 0.013 0.025 0.010 0.011 0.011 0.028 0.026 0.041 0.016 0.024 0.017 0.026 0.008 0.019 0.016 0.016 0.017 0.009 0.005 0.014 0.000 0.006 0.019 0.018 0.016 0.014 0.013 0.014 0.013 0.019 0.025 0.020 0.023 0.055 0.011 0.036 0.028 0.006 0.026 0.022 0.016 0.008 0.004 0.005 0.005 0.010 0.006 0.016 0.008 0.013 0.013 0.015 0.007 0.035 0.006 0.014 0.032 0.019 0.014 0.010 0.022 0.017 0.000 0.016 0.011 0.020 0.026 0.009 0.016 0.019 PE(P-18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) 0.002 0.001 0.000 0.002 0.004 0.001 0.004 0.005 0.004 0.001 0.001 0.001 0.005 0.007 0.006 0.004 0.004 0.002 0.006 0.008 0.007 0.006 0.008 0.009 0.006 0.004 0.004 0.005 0.002 0.002 0.003 0.001 0.002 0.002 0.002 0.000 0.001 0.001 0.004 0.001 0.004 0.001 0.003 0.001 0.004 0.002 0.002 0.002 0.002 0.002 0.000 0.000 0.004 0.001 0.000 0.000 0.004 0.003 0.003 0.005 0.000 0.003 0.004 0.003 0.003 0.003 0.002 0.011 0.006 0.012 0.004 0.002 0.007 0.008 0.007 0.004 0.005 0.008 0.004 0.003 0.004 0.006 0.002 0.009 0.003 0.004 0.002 0.003 0.003 0.000 0.002 0.006 0.006 0.004 0.004 0.004 0.005 0.003 0.003 0.002 0.002 0.006 0.003 0.004 0.004 0.000 0.007 0.003 0.006 0.002 0.000 0.003 0.002 0.000 0.004 0.004 0.003 0.003 0.004 0.001 0.000 0.006 0.002 0.004 0.006 0.003 0.005 0.003 0.000 0.002 0.001 0.002 0.001 0.010 0.002 0.002 0.005 0.004 Arginine 0.018 0.016 0.020 0.014 0.018 0.016 0.030 0.028 0.027 0.023 0.016 0.009 0.016 0.014 0.013 0.009 0.020 0.013 0.026 0.021 0.017 0.021 0.022 0.031 0.017 0.014 0.011 0.019 0.016 0.011 0.013 0.017 0.015 0.018 0.011 0.010 0.008 0.017 0.009 0.008 0.010 0.005 0.007 0.010 0.012 0.014 0.013 0.013 0.009 0.009 0.017 0.020 0.015 0.015 0.018 0.016 0.015 0.011 0.009 0.012 0.012 0.015 0.012 0.010 0.009 0.009 0.008 0.017 0.015 0.017 0.012 0.010 0.010 0.016 0.018 0.022 0.019 0.010 0.011 0.019 0.016 0.013 0.012 0.014 0.019 0.016 0.018 0.012 0.010 0.011 0.014 0.016 0.014 0.013 0.012 0.009 0.010 0.018 0.024 0.019 0.017 0.013 0.010 0.018 0.017 0.023 0.018 0.017 0.014 0.017 0.013 0.012 0.012 0.014 0.012 0.010 0.011 0.009 0.009 0.009 0.008 0.018 0.016 0.019 0.025 0.016 0.012 0.027 0.020 0.025 0.022 0.016 0.023 0.021 0.015 0.013 0.015 0.011 PC(14:1(9Z)/20:2(11Z,14Z)) 0.046 0.039 0.038 0.036 0.039 0.030 0.021 0.018 0.021 0.021 0.020 0.015 0.068 0.068 0.068 0.063 0.067 0.053 0.054 0.050 0.055 0.053 0.054 0.068 0.054 0.044 0.037 0.028 0.018 0.018 0.016 0.012 0.023 0.024 0.021 0.020 0.027 0.028 0.056 0.052 0.049 0.034 0.030 0.023 0.030 0.028 0.030 0.037 0.027 0.019 0.018 0.017 0.017 0.019 0.022 0.013 0.028 0.032 0.029 0.025 0.020 0.058 0.054 0.054 0.052 0.055 0.052 0.045 0.051 0.057 0.039 0.035 0.039 0.072 0.048 0.051 0.042 0.039 0.038 0.034 0.034 0.033 0.038 0.036 0.034 0.033 0.025 0.032 0.029 0.026 0.032 0.047 0.042 0.035 0.036 0.036 0.029 0.039 0.034 0.036 0.036 0.039 0.025 0.039 0.057 0.028 0.054 0.038 0.036 0.028 0.021 0.028 0.023 0.029 0.029 0.029 0.025 0.022 0.027 0.023 0.024 0.051 0.031 0.055 0.057 0.045 0.037 0.030 0.026 0.027 0.025 0.024 0.030 0.056 0.038 0.034 0.046 0.051 PE-NMe(18:1(9Z)/18:1(9Z)) 0.705 1.100 0.607 0.360 0.530 0.379 0.531 0.377 0.425 0.397 0.299 0.375 0.698 0.685 0.654 0.687 0.561 0.724 0.653 0.440 0.626 0.620 0.683 1.048 0.636 0.494 0.529 0.585 0.391 0.474 0.323 0.368 0.050 0.616 0.470 0.381 0.547 0.487 0.377 0.413 0.515 0.260 0.329 0.311 0.504 0.468 0.314 0.503 0.392 0.319 0.410 0.368 0.313 0.392 0.425 0.343 0.492 0.562 0.468 0.483 0.291 0.626 0.545 0.557 0.296 0.506 0.401 0.611 0.561 0.639 0.504 0.434 0.487 0.870 0.667 0.627 0.468 0.552 0.446 0.568 0.374 0.609 0.538 0.516 0.515 0.490 0.402 0.509 0.305 0.393 0.516 0.838 0.607 0.505 0.515 0.570 0.527 0.544 0.502 0.591 0.526 1.557 0.448 0.642 0.470 0.164 0.622 0.365 0.444 0.435 0.363 0.300 0.285 0.445 0.273 0.505 0.214 0.416 0.295 0.305 0.301 0.608 0.519 0.651 0.720 0.669 0.556 0.430 0.207 0.426 0.196 0.340 0.337 0.741 0.603 0.434 0.579 0.540 7-methylthioheptanaldoxime 0.001 0.008 0.001 0.011 0.001 0.001 0.007 0.000 0.000 0.000 0.000 0.000 0.010 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.006 0.000 0.001 0.001 0.001 0.000 0.010 0.010 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.001 0.008 0.001 0.007 0.000 0.000 0.000 0.008 0.000 0.000 0.001 0.001 0.001 0.001 0.009 0.000 0.001 0.000 0.000 0.001 0.000 0.001 0.001 0.001 0.001 0.000 0.007 0.001 0.001 0.000 0.001 0.000 0.001 0.000 0.000 0.000 0.001 0.001 0.001 0.000 0.010 0.000 0.000 0.009 0.001 0.000 0.001 0.001 0.001 0.001 0.000 0.001 0.000 0.000 0.000 0.000 0.002 0.002 0.008 0.001 0.002 0.007 0.002 0.000 0.002 0.002 0.002 0.001 0.008 0.002 0.002 0.010 0.002 0.010 0.007 0.001 0.002 0.002 0.001 0.001 0.000 0.010 0.001 0.001 0.001 0.000 0.000 0.000 0.001 0.000 0.000 0.001 0.001 0.001 0.000 0.000 0.001 0.001 0.000 0.000 0.001 0.002 0.000 carboxynorspermidine 0.010 0.008 0.010 0.007 0.006 0.006 0.004 0.000 0.000 0.002 0.000 0.000 0.007 0.005 0.009 0.002 0.004 0.004 0.002 0.003 0.002 0.005 0.009 0.012 0.006 0.006 0.008 0.008 0.007 0.003 0.002 0.000 0.003 0.007 0.006 0.006 0.003 0.008 0.007 0.006 0.010 0.005 0.005 0.013 0.006 0.006 0.005 0.004 0.004 0.004 0.003 0.005 0.002 0.003 0.002 0.003 0.007 0.007 0.005 0.005 0.008 0.004 0.001 0.004 0.003 0.004 0.001 0.006 0.005 0.006 0.002 0.008 0.008 0.002 0.003 0.006 0.003 0.001 0.006 0.002 0.004 0.006 0.000 0.006 0.006 0.001 0.007 0.005 0.005 0.006 0.004 0.012 0.008 0.010 0.010 0.006 0.012 0.011 0.012 0.018 0.017 0.015 0.019 0.006 0.010 0.009 0.006 0.007 0.008 0.008 0.009 0.006 0.006 0.010 0.007 0.007 0.009 0.011 0.009 0.011 0.010 0.004 0.002 0.006 0.006 0.007 0.006 0.006 0.005 0.005 0.006 0.004 0.008 0.007 0.004 0.007 0.011 0.009 PE(22:1(13Z)/15:0) 0.719 0.730 0.531 0.529 0.882 0.841 0.988 0.859 0.506 0.492 0.720 0.646 1.056 1.456 0.994 0.984 1.153 1.141 1.061 0.963 1.109 1.136 1.073 1.559 1.243 0.670 0.637 0.461 0.326 0.290 0.411 0.541 0.622 0.524 0.891 0.608 0.497 0.599 0.752 0.893 0.863 0.540 0.493 0.305 0.816 0.668 0.482 0.633 0.635 0.458 0.527 0.315 0.517 0.581 0.434 0.284 0.674 0.772 0.799 0.649 0.368 1.009 1.133 0.717 0.787 0.902 1.093 0.738 1.030 0.799 0.848 0.493 0.710 1.513 0.987 0.803 0.966 0.966 0.773 0.927 0.814 0.797 0.897 0.841 0.713 0.726 0.408 0.651 0.423 0.413 0.479 0.828 1.075 0.877 0.670 0.905 0.581 0.757 0.493 0.614 0.649 0.642 0.430 0.760 0.830 0.703 1.023 0.554 0.734 0.518 0.342 0.389 0.374 0.696 0.421 0.816 0.689 0.662 0.530 0.486 0.438 0.972 0.896 1.004 1.164 0.777 0.961 0.519 0.457 0.707 0.461 0.630 0.590 0.747 0.804 0.500 0.979 0.939 PE(15:0/22:0) 0.068 0.054 0.050 0.050 0.068 0.070 0.079 0.070 0.047 0.047 0.058 0.051 0.100 0.121 0.096 0.097 0.093 0.099 0.080 0.071 0.087 0.089 0.095 0.121 0.100 0.065 0.056 0.040 0.026 0.027 0.027 0.039 0.043 0.050 0.067 0.051 0.045 0.043 0.070 0.075 0.072 0.047 0.039 0.032 0.065 0.053 0.048 0.061 0.052 0.044 0.040 0.030 0.040 0.045 0.040 0.025 0.058 0.068 0.063 0.050 0.035 0.081 0.094 0.070 0.075 0.077 0.090 0.068 0.080 0.076 0.065 0.048 0.069 0.126 0.089 0.076 0.078 0.076 0.071 0.073 0.071 0.061 0.072 0.068 0.053 0.054 0.043 0.062 0.040 0.037 0.046 0.078 0.084 0.068 0.058 0.068 0.054 0.055 0.050 0.048 0.047 0.053 0.049 0.065 0.064 0.059 0.083 0.053 0.057 0.045 0.033 0.039 0.042 0.054 0.040 0.066 0.059 0.054 0.051 0.049 0.043 0.081 0.071 0.079 0.096 0.073 0.076 0.049 0.045 0.058 0.045 0.064 0.056 0.073 0.060 0.047 0.075 0.072 PG(O-36:1) 0.011 0.008 0.008 0.008 0.012 0.012 0.014 0.012 0.007 0.008 0.011 0.009 0.018 0.021 0.016 0.016 0.016 0.015 0.013 0.011 0.014 0.015 0.017 0.021 0.017 0.009 0.010 0.008 0.003 0.004 0.004 0.006 0.006 0.008 0.013 0.007 0.007 0.007 0.014 0.013 0.011 0.006 0.006 0.003 0.010 0.009 0.008 0.010 0.009 0.007 0.006 0.005 0.007 0.007 0.007 0.004 0.009 0.010 0.009 0.007 0.007 0.014 0.016 0.011 0.014 0.012 0.015 0.010 0.014 0.012 0.012 0.007 0.011 0.021 0.014 0.012 0.013 0.012 0.010 0.012 0.010 0.013 0.011 0.014 0.009 0.011 0.007 0.009 0.006 0.005 0.006 0.013 0.014 0.013 0.009 0.011 0.008 0.009 0.008 0.007 0.010 0.007 0.008 0.010 0.009 0.010 0.015 0.008 0.009 0.008 0.004 0.007 0.006 0.009 0.007 0.011 0.009 0.010 0.008 0.007 0.008 0.013 0.012 0.016 0.015 0.012 0.013 0.008 0.007 0.009 0.007 0.009 0.009 0.012 0.010 0.007 0.013 0.012 PE(18:4(6Z,9Z,12Z,15Z)/20:2(11Z,14Z)) 0.002 0.002 0.000 0.002 0.002 0.000 0.001 0.000 0.003 0.000 0.000 0.000 0.005 0.005 0.005 0.005 0.007 0.006 0.005 0.004 0.004 0.005 0.008 0.014 0.008 0.005 0.004 0.006 0.002 0.002 0.003 0.001 0.001 0.003 0.002 0.000 0.002 0.002 0.000 0.001 0.001 0.000 0.000 0.000 0.005 0.005 0.005 0.005 0.005 0.005 0.000 0.001 0.000 0.000 0.001 0.000 0.003 0.000 0.002 0.002 0.000 0.001 0.001 0.003 0.003 0.003 0.003 0.002 0.001 0.004 0.003 0.003 0.002 0.006 0.006 0.006 0.007 0.006 0.004 0.007 0.006 0.003 0.006 0.006 0.005 0.000 0.000 0.000 0.000 0.000 0.000 0.006 0.004 0.003 0.001 0.004 0.003 0.003 0.003 0.002 0.005 0.003 0.002 0.001 0.004 0.000 0.004 0.004 0.007 0.003 0.002 0.004 0.003 0.002 0.002 0.001 0.003 0.000 0.004 0.007 0.001 0.003 0.001 0.002 0.008 0.004 0.000 0.003 0.002 0.005 0.006 0.005 0.002 0.003 0.004 0.003 0.010 0.005 PE(22:5(7Z,10Z,13Z,16Z,19Z)/16:0) 0.002 0.015 0.001 0.000 0.005 0.000 0.002 0.000 0.000 0.001 0.000 0.000 0.012 0.009 0.013 0.006 0.017 0.010 0.008 0.005 0.005 0.009 0.006 0.019 0.010 0.002 0.010 0.010 0.000 0.004 0.000 0.004 0.000 0.006 0.003 0.000 0.007 0.004 0.003 0.006 0.005 0.000 0.000 0.006 0.010 0.007 0.001 0.021 0.015 0.011 0.002 0.001 0.000 0.000 0.000 0.001 0.003 0.000 0.002 0.001 0.000 0.012 0.002 0.000 0.000 0.008 0.004 0.000 0.006 0.009 0.000 0.010 0.009 0.013 0.015 0.015 0.008 0.008 0.005 0.015 0.000 0.007 0.007 0.010 0.013 0.000 0.000 0.000 0.000 0.000 0.000 0.012 0.006 0.000 0.000 0.007 0.004 0.006 0.010 0.004 0.003 0.026 0.003 0.011 0.007 0.000 0.007 0.000 0.005 0.007 0.001 0.008 0.001 0.009 0.000 0.004 0.002 0.002 0.002 0.005 0.001 0.014 0.001 0.006 0.007 0.002 0.003 0.003 0.000 0.006 0.002 0.006 0.004 0.002 0.004 0.000 0.007 0.002 PC(o-16:1(9Z)/20:4(8Z,11Z,14Z,17Z)) 0.027 0.021 0.021 0.019 0.019 0.017 0.030 0.022 0.021 0.022 0.023 0.020 0.032 0.030 0.032 0.023 0.026 0.028 0.036 0.032 0.032 0.029 0.040 0.051 0.034 0.029 0.028 0.022 0.018 0.018 0.014 0.015 0.016 0.016 0.017 0.013 0.013 0.011 0.017 0.016 0.019 0.012 0.010 0.010 0.030 0.024 0.024 0.026 0.024 0.021 0.012 0.011 0.011 0.014 0.014 0.008 0.016 0.019 0.015 0.013 0.012 0.019 0.015 0.017 0.019 0.017 0.017 0.022 0.021 0.022 0.017 0.017 0.020 0.041 0.030 0.033 0.030 0.035 0.033 0.030 0.026 0.023 0.023 0.021 0.021 0.021 0.019 0.021 0.017 0.015 0.016 0.032 0.024 0.024 0.026 0.027 0.022 0.023 0.022 0.019 0.020 0.019 0.017 0.025 0.030 0.015 0.030 0.026 0.021 0.017 0.015 0.014 0.017 0.018 0.017 0.027 0.025 0.022 0.023 0.021 0.021 0.031 0.022 0.029 0.039 0.028 0.025 0.025 0.019 0.022 0.021 0.020 0.025 0.033 0.029 0.023 0.028 0.031 PC(o-18:2(9Z,12Z)/18:2(9Z,12Z)) 0.042 0.031 0.033 0.031 0.032 0.029 0.052 0.038 0.034 0.034 0.037 0.031 0.058 0.052 0.056 0.044 0.044 0.053 0.070 0.062 0.064 0.059 0.059 0.077 0.052 0.041 0.038 0.035 0.028 0.027 0.024 0.026 0.027 0.030 0.033 0.023 0.022 0.021 0.027 0.029 0.035 0.020 0.016 0.017 0.043 0.035 0.032 0.039 0.035 0.030 0.019 0.016 0.016 0.019 0.018 0.013 0.023 0.029 0.023 0.021 0.017 0.032 0.028 0.027 0.028 0.027 0.030 0.031 0.032 0.037 0.028 0.025 0.030 0.061 0.042 0.047 0.041 0.047 0.045 0.038 0.036 0.032 0.030 0.028 0.026 0.031 0.025 0.030 0.025 0.021 0.024 0.052 0.044 0.039 0.040 0.042 0.034 0.037 0.031 0.027 0.029 0.031 0.024 0.041 0.043 0.027 0.048 0.039 0.038 0.026 0.020 0.023 0.023 0.028 0.027 0.039 0.034 0.033 0.032 0.028 0.029 0.046 0.034 0.045 0.057 0.039 0.039 0.034 0.026 0.028 0.030 0.029 0.033 0.050 0.040 0.035 0.042 0.045 PE(18:3(6Z,9Z,12Z)/20:0) 0.002 0.002 0.003 0.002 0.003 0.002 0.001 0.000 0.001 0.001 0.001 0.000 0.002 0.002 0.002 0.001 0.000 0.001 0.004 0.004 0.004 0.002 0.004 0.006 0.002 0.002 0.002 0.001 0.000 0.000 0.001 0.002 0.002 0.000 0.002 0.000 0.001 0.000 0.001 0.001 0.002 0.001 0.001 0.000 0.003 0.003 0.002 0.002 0.001 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.002 0.003 0.002 0.003 0.001 0.002 0.001 0.001 0.002 0.001 0.003 0.003 0.004 0.002 0.002 0.002 0.002 0.004 0.002 0.003 0.001 0.002 0.003 0.002 0.003 0.002 0.002 0.002 0.001 0.001 0.000 0.001 0.000 0.000 0.001 0.003 0.001 0.000 0.000 0.002 0.001 0.002 0.003 0.001 0.001 0.003 0.001 0.004 0.004 0.004 0.004 0.003 0.004 0.002 0.001 0.001 0.001 0.003 0.002 0.003 0.001 0.002 0.000 0.000 0.000 0.002 0.003 0.003 0.002 0.002 0.001 0.002 0.000 0.002 0.001 0.001 0.000 0.002 0.001 0.002 0.003 0.002 PC(o-18:1(11Z)/18:2(9Z,12Z)) 0.007 0.005 0.011 0.010 0.014 0.015 0.020 0.015 0.011 0.010 0.013 0.011 0.019 0.023 0.018 0.016 0.017 0.021 0.030 0.027 0.027 0.029 0.020 0.024 0.019 0.013 0.011 0.014 0.010 0.007 0.010 0.013 0.014 0.011 0.016 0.011 0.005 0.009 0.009 0.010 0.013 0.007 0.001 0.001 0.016 0.012 0.010 0.014 0.011 0.010 0.008 0.004 0.007 0.008 0.008 0.004 0.013 0.013 0.013 0.009 0.007 0.013 0.013 0.011 0.011 0.011 0.014 0.012 0.015 0.013 0.014 0.007 0.011 0.022 0.012 0.011 0.013 0.016 0.012 0.017 0.016 0.012 0.013 0.013 0.009 0.014 0.005 0.013 0.008 0.003 0.010 0.021 0.026 0.018 0.016 0.018 0.013 0.019 0.016 0.012 0.015 0.014 0.012 0.014 0.013 0.013 0.018 0.011 0.014 0.011 0.007 0.003 0.008 0.012 0.008 0.016 0.013 0.013 0.011 0.010 0.003 0.015 0.015 0.014 0.020 0.009 0.018 0.005 0.009 0.012 0.009 0.011 0.007 0.017 0.014 0.010 0.018 0.015 Phosphatidyl glycerophosphate (O-42:2) 0.002 0.000 0.000 0.002 0.003 0.003 0.006 0.002 0.002 0.001 0.002 0.002 0.005 0.006 0.005 0.004 0.004 0.005 0.008 0.010 0.009 0.010 0.005 0.007 0.005 0.003 0.002 0.001 0.002 0.002 0.002 0.004 0.003 0.003 0.005 0.001 0.001 0.001 0.002 0.002 0.003 0.001 0.000 0.000 0.004 0.002 0.002 0.003 0.002 0.001 0.000 0.001 0.000 0.001 0.000 0.000 0.002 0.003 0.002 0.002 0.001 0.001 0.004 0.001 0.002 0.002 0.003 0.003 0.003 0.003 0.003 0.002 0.001 0.004 0.003 0.002 0.004 0.003 0.003 0.002 0.004 0.002 0.002 0.001 0.001 0.003 0.002 0.002 0.001 0.000 0.002 0.005 0.007 0.004 0.004 0.004 0.004 0.005 0.004 0.003 0.003 0.002 0.003 0.004 0.003 0.003 0.004 0.001 0.003 0.000 0.002 0.000 0.001 0.003 0.001 0.003 0.003 0.002 0.002 0.002 0.002 0.003 0.004 0.004 0.005 0.004 0.006 0.002 0.002 0.003 0.002 0.002 0.003 0.003 0.003 0.002 0.004 0.004 PE-NMe2(18:1(9Z)/18:1(9Z)) 0.031 0.024 0.024 0.023 0.029 0.028 0.021 0.019 0.016 0.015 0.014 0.013 0.017 0.020 0.020 0.016 0.016 0.018 0.041 0.041 0.041 0.040 0.039 0.046 0.035 0.024 0.023 0.020 0.015 0.016 0.014 0.018 0.022 0.015 0.019 0.013 0.014 0.012 0.014 0.014 0.018 0.009 0.008 0.007 0.027 0.021 0.018 0.022 0.018 0.016 0.015 0.012 0.014 0.014 0.013 0.010 0.023 0.025 0.023 0.020 0.014 0.020 0.018 0.018 0.018 0.016 0.021 0.025 0.029 0.025 0.021 0.017 0.022 0.029 0.021 0.022 0.020 0.022 0.018 0.025 0.023 0.021 0.019 0.022 0.020 0.020 0.014 0.020 0.015 0.012 0.014 0.026 0.027 0.020 0.019 0.021 0.017 0.027 0.022 0.021 0.022 0.020 0.017 0.034 0.030 0.032 0.040 0.027 0.030 0.020 0.015 0.018 0.016 0.025 0.018 0.022 0.019 0.019 0.016 0.016 0.014 0.023 0.019 0.023 0.029 0.023 0.022 0.016 0.012 0.015 0.013 0.017 0.016 0.027 0.020 0.016 0.025 0.025 PS(35:0) 0.022 0.047 0.022 0.015 0.023 0.007 0.014 0.007 0.011 0.008 0.003 0.013 0.049 0.045 0.050 0.047 0.041 0.038 0.012 0.007 0.019 0.018 0.010 0.034 0.016 0.021 0.019 0.008 0.000 0.000 0.000 0.000 0.000 0.007 0.003 0.000 0.004 0.009 0.016 0.029 0.036 0.016 0.015 0.019 0.020 0.012 0.011 0.017 0.020 0.008 0.004 0.007 0.003 0.010 0.011 0.004 0.011 0.013 0.012 0.016 0.010 0.027 0.022 0.027 0.005 0.028 0.016 0.009 0.010 0.026 0.018 0.015 0.020 0.044 0.036 0.034 0.021 0.022 0.028 0.015 0.001 0.011 0.017 0.015 0.009 0.018 0.010 0.017 0.009 0.016 0.018 0.027 0.010 0.015 0.013 0.020 0.020 0.012 0.009 0.013 0.010 0.051 0.011 0.023 0.016 0.000 0.025 0.011 0.010 0.008 0.010 0.007 0.005 0.002 0.003 0.019 0.001 0.008 0.007 0.007 0.010 0.023 0.011 0.025 0.024 0.023 0.013 0.015 0.006 0.017 0.003 0.007 0.009 0.016 0.011 0.010 0.015 0.011 PC(14:1(9Z)/22:4(7Z,10Z,13Z,16Z)) 0.153 0.121 0.053 0.047 0.048 0.094 0.113 0.088 0.095 0.036 0.095 0.067 0.085 0.171 0.178 0.147 0.169 0.072 0.097 0.082 0.186 0.166 0.108 0.153 0.199 0.060 0.055 0.104 0.071 0.072 0.063 0.061 0.089 0.107 0.054 0.084 0.095 0.092 0.124 0.032 0.041 0.083 0.072 0.003 0.117 0.098 0.029 0.045 0.093 0.013 0.070 0.065 0.064 0.076 0.080 0.055 0.092 0.108 0.087 0.075 0.065 0.126 0.102 0.110 0.116 0.109 0.111 0.070 0.152 0.166 0.116 0.036 0.128 0.201 0.139 0.154 0.048 0.132 0.048 0.059 0.053 0.126 0.120 0.119 0.124 0.101 0.082 0.103 0.088 0.067 0.086 0.177 0.139 0.128 0.063 0.134 0.116 0.125 0.111 0.108 0.113 0.111 0.078 0.155 0.180 0.022 0.063 0.049 0.135 0.100 0.079 0.086 0.086 0.041 0.038 0.033 0.079 0.017 0.082 0.074 0.071 0.172 0.115 0.169 0.215 0.157 0.125 0.038 0.022 0.026 0.027 0.025 0.043 0.182 0.132 0.047 0.070 0.173 PC(18:2(9Z,12Z)/18:2(9Z,12Z)) 0.758 0.655 0.627 0.630 0.648 0.603 0.656 0.543 0.493 0.525 0.508 0.424 0.829 0.824 0.797 0.674 0.767 0.768 0.735 0.648 0.728 0.663 1.085 1.468 1.046 0.828 0.778 0.450 0.341 0.337 0.302 0.361 0.414 0.431 0.463 0.339 0.372 0.353 0.484 0.539 0.525 0.324 0.298 0.262 0.641 0.526 0.539 0.617 0.548 0.447 0.304 0.294 0.280 0.315 0.377 0.386 0.334 0.367 0.333 0.286 0.283 0.465 0.425 0.443 0.431 0.404 0.465 0.563 0.595 0.584 0.425 0.422 0.471 1.007 0.677 0.746 0.649 0.723 0.733 0.574 0.485 0.543 0.533 0.534 0.512 0.388 0.325 0.391 0.335 0.293 0.315 0.770 0.580 0.571 0.561 0.608 0.529 0.467 0.458 0.425 0.424 0.426 0.314 0.660 0.792 0.487 0.860 0.708 0.625 0.438 0.352 0.396 0.376 0.509 0.471 0.463 0.438 0.393 0.442 0.415 0.397 0.925 0.695 0.853 1.188 0.841 0.758 0.515 0.657 0.450 0.441 0.465 0.588 0.763 0.593 0.524 0.672 0.762 PC(14:1(9Z)/22:2(13Z,16Z)) 0.570 0.450 0.461 0.539 0.456 0.408 0.432 0.345 0.326 0.326 0.328 0.234 0.580 0.578 0.552 0.486 0.527 0.537 0.624 0.580 0.628 0.711 0.734 0.944 0.669 0.506 0.469 0.367 0.369 0.275 0.250 0.250 0.341 0.393 0.419 0.328 0.325 0.307 0.363 0.358 0.383 0.228 0.212 0.172 0.444 0.374 0.357 0.410 0.349 0.282 0.236 0.213 0.240 0.342 0.254 0.187 0.418 0.438 0.421 0.477 0.285 0.449 0.403 0.383 0.410 0.490 0.541 0.470 0.508 0.494 0.381 0.331 0.385 0.681 0.479 0.499 0.427 0.480 0.549 0.516 0.464 0.477 0.465 0.468 0.428 0.305 0.253 0.306 0.246 0.224 0.246 0.632 0.675 0.468 0.442 0.483 0.399 0.601 0.408 0.506 0.397 0.364 0.313 0.475 0.542 0.329 0.578 0.441 0.441 0.385 0.294 0.333 0.315 0.413 0.349 0.458 0.424 0.387 0.388 0.354 0.325 0.542 0.407 0.525 0.663 0.498 0.430 0.330 0.280 0.319 0.286 0.316 0.469 0.498 0.373 0.308 0.410 0.441 PC(18:1(9Z)/18:1(9Z)) 0.813 0.566 0.532 0.502 0.757 0.784 0.727 0.631 0.376 0.355 0.393 0.343 0.681 0.864 0.615 0.642 0.627 0.759 0.977 0.898 0.931 0.950 0.963 1.153 1.015 0.492 0.461 0.561 0.341 0.381 0.342 0.481 0.670 0.627 0.879 0.575 0.518 0.456 0.413 0.475 0.470 0.234 0.239 0.150 0.636 0.504 0.359 0.450 0.343 0.308 0.428 0.285 0.415 0.419 0.310 0.246 0.586 0.640 0.643 0.459 0.296 0.739 0.864 0.564 0.631 0.568 0.824 0.839 1.038 0.776 0.796 0.454 0.629 1.014 0.703 0.569 0.565 0.556 0.458 0.818 0.773 0.627 0.735 0.707 0.660 0.575 0.356 0.568 0.336 0.293 0.374 0.716 0.884 0.592 0.492 0.577 0.435 0.815 0.639 0.619 0.606 0.543 0.496 0.660 0.549 0.662 0.690 0.428 0.588 0.584 0.348 0.415 0.362 0.614 0.404 0.719 0.672 0.648 0.500 0.444 0.389 0.643 0.729 0.673 0.728 0.668 0.729 0.375 0.320 0.506 0.319 0.454 0.410 0.752 0.650 0.383 0.755 0.651 PE(24:1(15Z)/15:0) 0.083 0.058 0.054 0.050 0.075 0.082 0.072 0.064 0.037 0.035 0.040 0.031 0.070 0.087 0.063 0.068 0.066 0.073 0.094 0.087 0.090 0.095 0.094 0.113 0.101 0.050 0.047 0.055 0.033 0.039 0.035 0.048 0.066 0.064 0.091 0.056 0.053 0.046 0.043 0.046 0.043 0.024 0.022 0.013 0.061 0.048 0.038 0.046 0.035 0.031 0.041 0.027 0.038 0.039 0.042 0.021 0.055 0.061 0.061 0.047 0.029 0.075 0.088 0.057 0.064 0.058 0.081 0.081 0.107 0.081 0.081 0.045 0.067 0.101 0.064 0.057 0.057 0.056 0.046 0.077 0.077 0.065 0.070 0.068 0.062 0.054 0.036 0.053 0.032 0.028 0.037 0.073 0.089 0.061 0.051 0.062 0.045 0.080 0.062 0.061 0.064 0.055 0.054 0.064 0.057 0.075 0.077 0.044 0.063 0.065 0.035 0.039 0.038 0.059 0.041 0.076 0.068 0.061 0.050 0.042 0.039 0.064 0.075 0.071 0.074 0.068 0.073 0.039 0.033 0.047 0.034 0.048 0.042 0.078 0.066 0.038 0.075 0.069 PC(o-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.012 0.009 0.009 0.010 0.011 0.008 0.015 0.011 0.011 0.012 0.011 0.010 0.015 0.015 0.015 0.012 0.012 0.015 0.021 0.019 0.018 0.015 0.021 0.025 0.018 0.014 0.014 0.012 0.011 0.010 0.009 0.009 0.009 0.010 0.010 0.008 0.008 0.007 0.007 0.006 0.009 0.004 0.005 0.005 0.014 0.010 0.010 0.011 0.010 0.009 0.007 0.006 0.008 0.009 0.007 0.005 0.009 0.010 0.008 0.008 0.007 0.010 0.008 0.008 0.010 0.009 0.010 0.014 0.014 0.013 0.010 0.010 0.013 0.019 0.013 0.013 0.013 0.016 0.015 0.017 0.015 0.015 0.012 0.013 0.011 0.010 0.009 0.011 0.009 0.007 0.009 0.016 0.013 0.012 0.013 0.013 0.011 0.014 0.013 0.016 0.012 0.013 0.011 0.015 0.015 0.010 0.017 0.014 0.015 0.008 0.007 0.007 0.007 0.010 0.009 0.015 0.013 0.013 0.015 0.012 0.012 0.017 0.011 0.016 0.020 0.014 0.013 0.013 0.011 0.013 0.011 0.013 0.014 0.018 0.015 0.013 0.016 0.017 1-18:2-2-18:3-monogalactosyldiacylglycerol 0.002 0.001 0.002 0.001 0.002 0.002 0.003 0.002 0.000 0.002 0.002 0.001 0.001 0.002 0.003 0.002 0.002 0.002 0.000 0.002 0.002 0.002 0.002 0.005 0.004 0.002 0.002 0.001 0.001 0.001 0.001 0.000 0.000 0.000 0.002 0.001 0.000 0.001 0.000 0.002 0.001 0.001 0.001 0.001 0.002 0.000 0.000 0.001 0.000 0.001 0.000 0.000 0.001 0.000 0.001 0.000 0.002 0.002 0.001 0.000 0.000 0.002 0.000 0.002 0.003 0.000 0.001 0.002 0.002 0.000 0.002 0.002 0.002 0.002 0.002 0.001 0.000 0.000 0.002 0.002 0.000 0.000 0.002 0.002 0.000 0.001 0.001 0.002 0.001 0.001 0.000 0.003 0.002 0.002 0.002 0.000 0.002 0.003 0.000 0.000 0.002 0.002 0.001 0.003 0.002 0.002 0.003 0.002 0.002 0.001 0.002 0.002 0.000 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.003 0.003 0.000 0.001 0.001 0.001 0.002 0.000 0.001 0.003 0.001 0.000 0.002 0.003 PC(o-18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) 0.041 0.032 0.036 0.032 0.030 0.026 0.044 0.032 0.031 0.035 0.034 0.028 0.051 0.044 0.049 0.038 0.042 0.045 0.057 0.049 0.051 0.046 0.055 0.072 0.045 0.038 0.039 0.036 0.032 0.025 0.024 0.024 0.027 0.029 0.032 0.022 0.022 0.022 0.024 0.022 0.028 0.017 0.015 0.016 0.043 0.033 0.036 0.039 0.035 0.031 0.019 0.019 0.019 0.022 0.022 0.017 0.024 0.028 0.022 0.019 0.019 0.029 0.025 0.025 0.027 0.023 0.027 0.032 0.033 0.034 0.027 0.026 0.031 0.050 0.036 0.041 0.036 0.045 0.044 0.040 0.033 0.033 0.030 0.028 0.027 0.030 0.028 0.034 0.029 0.024 0.026 0.055 0.042 0.041 0.045 0.044 0.041 0.041 0.039 0.035 0.036 0.037 0.034 0.041 0.043 0.028 0.044 0.041 0.039 0.029 0.024 0.024 0.026 0.029 0.026 0.044 0.043 0.039 0.043 0.037 0.037 0.049 0.039 0.047 0.064 0.044 0.044 0.040 0.031 0.032 0.033 0.037 0.038 0.049 0.038 0.036 0.042 0.045 PC(o-18:0/20:4(8Z,11Z,14Z,17Z)) 0.018 0.012 0.012 0.013 0.016 0.019 0.023 0.020 0.012 0.012 0.014 0.013 0.018 0.019 0.019 0.016 0.018 0.020 0.029 0.026 0.027 0.027 0.022 0.026 0.021 0.014 0.013 0.013 0.006 0.009 0.010 0.011 0.014 0.012 0.017 0.010 0.011 0.010 0.014 0.013 0.015 0.006 0.006 0.006 0.018 0.014 0.012 0.015 0.014 0.012 0.006 0.005 0.007 0.007 0.009 0.004 0.012 0.013 0.014 0.012 0.007 0.019 0.016 0.012 0.011 0.011 0.018 0.014 0.018 0.013 0.018 0.010 0.014 0.023 0.014 0.015 0.016 0.019 0.016 0.017 0.017 0.013 0.015 0.014 0.011 0.015 0.010 0.016 0.010 0.009 0.009 0.020 0.025 0.018 0.018 0.017 0.014 0.017 0.019 0.012 0.018 0.018 0.010 0.018 0.013 0.018 0.022 0.013 0.016 0.013 0.010 0.011 0.010 0.015 0.009 0.016 0.014 0.013 0.013 0.010 0.011 0.017 0.016 0.020 0.022 0.014 0.022 0.012 0.009 0.013 0.011 0.013 0.013 0.016 0.018 0.011 0.019 0.016 Glucose 2.046 1.883 2.433 1.966 3.982 1.800 2.326 1.867 1.944 1.787 2.266 2.270 2.650 2.321 2.185 1.853 3.463 2.491 2.056 2.169 1.978 5.035 1.887 2.600 1.900 2.161 2.964 2.382 2.606 2.673 2.120 3.524 4.178 2.570 2.498 1.786 2.517 2.460 3.247 2.077 2.582 2.021 2.924 2.824 1.996 1.785 1.896 2.095 2.856 2.061 2.419 2.480 1.760 2.648 3.239 2.633 1.975 2.116 1.846 4.732 1.535 1.974 2.259 2.058 1.718 4.123 1.818 2.205 1.795 2.347 1.798 4.828 2.508 2.520 2.206 2.467 2.738 2.459 2.019 2.459 2.752 2.264 2.129 4.401 2.510 2.269 2.887 3.106 2.334 4.773 2.339 2.276 2.371 1.647 2.619 1.868 2.545 2.150 3.369 2.254 1.842 3.499 3.239 2.246 2.206 1.199 2.034 3.291 3.200 2.482 2.420 2.864 2.562 5.785 2.401 1.989 1.698 2.121 1.919 5.218 2.756 2.703 2.650 2.496 2.335 3.208 2.166 2.162 1.707 2.514 1.722 3.199 3.561 2.307 2.881 3.204 4.637 1.911 PE(18:3(6Z,9Z,12Z)/22:0) 0.007 0.007 0.007 0.006 0.007 0.009 0.003 0.007 0.005 0.004 0.004 0.004 0.005 0.006 0.005 0.004 0.005 0.005 0.010 0.010 0.010 0.010 0.006 0.012 0.008 0.001 0.007 0.004 0.002 0.003 0.003 0.004 0.004 0.004 0.005 0.004 0.003 0.003 0.004 0.006 0.005 0.003 0.002 0.001 0.008 0.004 0.006 0.005 0.003 0.001 0.003 0.003 0.003 0.004 0.003 0.002 0.007 0.006 0.006 0.006 0.004 0.005 0.005 0.004 0.004 0.004 0.006 0.005 0.006 0.006 0.003 0.004 0.006 0.007 0.005 0.005 0.004 0.006 0.003 0.005 0.007 0.007 0.006 0.008 0.005 0.003 0.003 0.004 0.003 0.003 0.003 0.006 0.007 0.005 0.004 0.003 0.004 0.007 0.005 0.005 0.005 0.002 0.005 0.010 0.009 0.011 0.012 0.009 0.008 0.005 0.004 0.005 0.004 0.007 0.005 0.004 0.005 0.006 0.005 0.005 0.004 0.007 0.005 0.006 0.004 0.006 0.006 0.004 0.004 0.004 0.003 0.005 0.004 0.005 0.005 0.003 0.005 0.005 N-(2-hydroxy-tetracosanoyl)-1-beta-glucosyl-4E,6E-hexadecasphingadienine 0.006 0.006 0.006 0.005 0.003 0.005 0.005 0.006 0.005 0.005 0.005 0.004 0.008 0.008 0.008 0.007 0.005 0.007 0.007 0.006 0.008 0.007 0.007 0.009 0.006 0.007 0.007 0.006 0.004 0.003 0.004 0.004 0.003 0.003 0.006 0.003 0.004 0.004 0.005 0.002 0.004 0.003 0.003 0.003 0.008 0.006 0.006 0.004 0.005 0.005 0.004 0.004 0.004 0.004 0.002 0.003 0.005 0.005 0.005 0.004 0.003 0.007 0.003 0.004 0.005 0.005 0.006 0.006 0.008 0.007 0.003 0.004 0.006 0.007 0.006 0.004 0.005 0.006 0.006 0.007 0.006 0.007 0.006 0.006 0.006 0.004 0.004 0.004 0.004 0.003 0.005 0.007 0.007 0.007 0.006 0.006 0.005 0.008 0.008 0.007 0.008 0.009 0.008 0.008 0.007 0.005 0.009 0.008 0.007 0.005 0.005 0.005 0.005 0.006 0.005 0.007 0.004 0.007 0.006 0.005 0.007 0.008 0.004 0.008 0.010 0.008 0.008 0.006 0.005 0.006 0.005 0.007 0.005 0.009 0.005 0.006 0.007 0.009 Luteolin 7,4'-diglucuronide-3'-glucoside 0.019 0.000 0.014 0.001 0.011 0.012 0.023 0.014 0.017 0.013 0.000 0.000 0.012 0.005 0.047 0.023 0.000 0.012 0.015 0.000 0.005 0.019 0.014 0.018 0.011 0.011 0.000 0.017 0.000 0.008 0.000 0.023 0.000 0.014 0.000 0.000 0.000 0.006 0.000 0.000 0.010 0.006 0.000 0.008 0.006 0.008 0.000 0.023 0.016 0.006 0.000 0.008 0.000 0.012 0.006 0.002 0.006 0.011 0.012 0.002 0.003 0.005 0.000 0.018 0.000 0.000 0.000 0.000 0.009 0.017 0.012 0.003 0.004 0.033 0.000 0.017 0.000 0.009 0.020 0.000 0.000 0.028 0.008 0.010 0.000 0.014 0.000 0.000 0.000 0.004 0.022 0.025 0.011 0.007 0.003 0.022 0.019 0.005 0.000 0.020 0.000 0.047 0.014 0.015 0.019 0.000 0.000 0.007 0.004 0.012 0.010 0.000 0.000 0.001 0.000 0.016 0.000 0.017 0.000 0.008 0.001 0.000 0.015 0.016 0.018 0.008 0.004 0.000 0.000 0.014 0.000 0.000 0.000 0.013 0.001 0.006 0.009 0.003 PC(18:4(6Z,9Z,12Z,15Z)/20:4(8Z,11Z,14Z,17Z)) 0.002 0.002 0.001 0.002 0.002 0.000 0.000 0.000 0.001 0.000 0.001 0.000 0.001 0.002 0.004 0.001 0.002 0.002 0.003 0.002 0.002 0.001 0.004 0.004 0.004 0.003 0.003 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.001 0.002 0.001 0.001 0.001 0.001 0.000 0.003 0.002 0.000 0.001 0.000 0.001 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.001 0.001 0.000 0.000 0.002 0.000 0.003 0.002 0.003 0.001 0.001 0.002 0.003 0.002 0.001 0.001 0.002 0.002 0.002 0.002 0.002 0.001 0.000 0.002 0.001 0.000 0.000 0.000 0.000 0.001 0.001 0.002 0.002 0.001 0.002 0.002 0.001 0.000 0.000 0.001 0.001 0.000 0.002 0.003 0.002 0.005 0.004 0.003 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.002 0.004 0.002 0.002 0.002 0.001 0.002 0.002 0.004 0.002 0.000 0.002 0.001 0.000 0.003 PS(37:2) 0.012 0.028 0.012 0.004 0.012 0.004 0.008 0.005 0.007 0.004 0.000 0.001 0.020 0.026 0.021 0.025 0.017 0.021 0.016 0.008 0.010 0.014 0.013 0.024 0.013 0.010 0.010 0.009 0.001 0.003 0.001 0.006 0.000 0.005 0.000 0.000 0.007 0.005 0.013 0.014 0.014 0.005 0.006 0.006 0.008 0.012 0.007 0.008 0.009 0.005 0.005 0.001 0.000 0.001 0.000 0.001 0.003 0.010 0.006 0.008 0.001 0.019 0.021 0.018 0.006 0.011 0.011 0.014 0.011 0.018 0.012 0.008 0.006 0.028 0.019 0.017 0.012 0.007 0.012 0.013 0.003 0.012 0.011 0.012 0.009 0.011 0.003 0.006 0.005 0.008 0.009 0.013 0.010 0.007 0.009 0.009 0.008 0.008 0.005 0.010 0.009 0.043 0.007 0.014 0.011 0.000 0.017 0.008 0.011 0.003 0.005 0.004 0.005 0.005 0.000 0.011 0.000 0.006 0.004 0.000 0.006 0.014 0.010 0.016 0.014 0.014 0.011 0.009 0.001 0.005 0.001 0.007 0.007 0.018 0.011 0.007 0.009 0.008 PC(18:3(6Z,9Z,12Z)/20:3(8Z,11Z,14Z)) 0.165 0.129 0.129 0.136 0.126 0.094 0.151 0.116 0.122 0.131 0.131 0.091 0.154 0.149 0.158 0.137 0.149 0.135 0.163 0.148 0.171 0.149 0.291 0.396 0.264 0.218 0.204 0.113 0.082 0.085 0.079 0.082 0.084 0.124 0.130 0.106 0.122 0.100 0.080 0.075 0.073 0.039 0.038 0.027 0.122 0.090 0.094 0.114 0.101 0.092 0.067 0.069 0.067 0.085 0.094 0.058 0.101 0.098 0.089 0.086 0.080 0.139 0.118 0.125 0.137 0.126 0.126 0.150 0.144 0.148 0.101 0.114 0.133 0.207 0.156 0.167 0.138 0.171 0.175 0.170 0.152 0.179 0.166 0.175 0.156 0.057 0.051 0.066 0.055 0.055 0.063 0.159 0.107 0.117 0.115 0.131 0.110 0.161 0.165 0.159 0.158 0.170 0.138 0.162 0.199 0.106 0.200 0.185 0.141 0.111 0.078 0.088 0.089 0.122 0.103 0.132 0.130 0.123 0.139 0.130 0.117 0.204 0.147 0.198 0.272 0.201 0.153 0.136 0.125 0.136 0.130 0.143 0.160 0.210 0.162 0.131 0.181 0.203 PC(20:3(8Z,11Z,14Z)/18:2(9Z,12Z)) 0.172 0.143 0.143 0.144 0.142 0.145 0.149 0.128 0.118 0.121 0.116 0.085 0.178 0.170 0.179 0.148 0.168 0.166 0.175 0.164 0.181 0.168 0.240 0.332 0.229 0.184 0.174 0.093 0.069 0.067 0.062 0.077 0.073 0.089 0.104 0.079 0.082 0.078 0.106 0.112 0.110 0.064 0.060 0.050 0.123 0.104 0.104 0.126 0.112 0.092 0.046 0.044 0.043 0.055 0.066 0.039 0.087 0.094 0.088 0.079 0.072 0.103 0.095 0.102 0.102 0.098 0.106 0.132 0.134 0.138 0.095 0.106 0.121 0.193 0.135 0.152 0.125 0.152 0.154 0.131 0.117 0.131 0.118 0.133 0.114 0.077 0.068 0.081 0.068 0.068 0.073 0.172 0.126 0.123 0.124 0.129 0.123 0.118 0.114 0.110 0.108 0.111 0.092 0.161 0.184 0.155 0.209 0.177 0.149 0.102 0.170 0.092 0.095 0.121 0.106 0.141 0.133 0.124 0.135 0.124 0.122 0.203 0.144 0.191 0.263 0.188 0.160 0.124 0.110 0.117 0.119 0.125 0.144 0.160 0.123 0.110 0.146 0.173 PC(18:2(9Z,12Z)/20:2(11Z,14Z)) 0.384 0.325 0.343 0.328 0.344 0.463 0.326 0.320 0.228 0.241 0.221 0.173 0.355 0.323 0.331 0.276 0.298 0.312 0.305 0.265 0.312 0.297 0.425 0.601 0.426 0.330 0.327 0.173 0.139 0.115 0.108 0.172 0.156 0.177 0.225 0.149 0.147 0.148 0.169 0.166 0.173 0.103 0.095 0.087 0.232 0.191 0.192 0.234 0.201 0.169 0.105 0.099 0.096 0.111 0.134 0.083 0.152 0.159 0.154 0.141 0.131 0.224 0.217 0.211 0.200 0.200 0.224 0.237 0.250 0.235 0.173 0.179 0.204 0.398 0.281 0.314 0.258 0.304 0.330 0.273 0.229 0.248 0.249 0.260 0.235 0.122 0.122 0.136 0.118 0.157 0.120 0.326 0.245 0.238 0.241 0.246 0.252 0.238 0.223 0.218 0.224 0.218 0.184 0.293 0.314 0.463 0.374 0.321 0.274 0.212 0.221 0.198 0.198 0.245 0.221 0.287 0.281 0.263 0.285 0.258 0.257 0.403 0.320 0.370 0.528 0.376 0.344 0.209 0.188 0.186 0.189 0.201 0.244 0.278 0.209 0.185 0.250 0.288 PC(22:2(13Z,16Z)/16:1(9Z)) 0.108 0.080 0.082 0.079 0.152 0.179 0.131 0.127 0.052 0.050 0.083 0.070 0.079 0.143 0.116 0.077 0.070 0.119 0.143 0.133 0.150 0.149 0.157 0.136 0.161 0.062 0.061 0.064 0.019 0.046 0.044 0.067 0.068 0.084 0.115 0.075 0.045 0.066 0.055 0.086 0.086 0.028 0.025 0.017 0.096 0.075 0.039 0.082 0.043 0.042 0.056 0.023 0.055 0.058 0.054 0.018 0.098 0.106 0.112 0.070 0.047 0.091 0.130 0.076 0.085 0.105 0.132 0.100 0.126 0.109 0.098 0.048 0.102 0.167 0.114 0.075 0.110 0.113 0.074 0.151 0.136 0.125 0.139 0.149 0.115 0.067 0.027 0.046 0.030 0.027 0.034 0.086 0.123 0.101 0.054 0.071 0.054 0.120 0.096 0.058 0.099 0.064 0.082 0.123 0.113 0.158 0.155 0.069 0.113 0.067 0.042 0.059 0.049 0.109 0.053 0.122 0.109 0.109 0.064 0.058 0.055 0.076 0.122 0.126 0.101 0.078 0.127 0.041 0.041 0.092 0.039 0.087 0.087 0.057 0.083 0.026 0.094 0.048 PC(18:1(9Z)/20:1(11Z)) 0.013 0.010 0.010 0.008 0.013 0.017 0.012 0.014 0.006 0.006 0.006 0.005 0.009 0.013 0.010 0.009 0.008 0.010 0.012 0.013 0.015 0.015 0.012 0.019 0.014 0.007 0.007 0.004 0.002 0.002 0.003 0.004 0.005 0.008 0.011 0.007 0.006 0.002 0.006 0.009 0.007 0.003 0.002 0.002 0.008 0.008 0.005 0.006 0.006 0.004 0.004 0.002 0.004 0.006 0.003 0.002 0.009 0.010 0.011 0.010 0.006 0.011 0.013 0.010 0.010 0.009 0.015 0.009 0.012 0.010 0.009 0.005 0.009 0.018 0.009 0.009 0.009 0.009 0.010 0.016 0.014 0.014 0.016 0.014 0.012 0.005 0.003 0.006 0.002 0.002 0.003 0.011 0.014 0.007 0.007 0.008 0.007 0.011 0.009 0.007 0.008 0.006 0.007 0.011 0.011 0.017 0.016 0.010 0.012 0.008 0.004 0.008 0.007 0.012 0.006 0.009 0.011 0.010 0.007 0.007 0.005 0.010 0.011 0.011 0.012 0.009 0.011 0.005 0.006 0.007 0.004 0.006 0.007 0.008 0.007 0.004 0.009 0.007 PC(P-18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 0.068 0.121 0.054 0.038 0.061 0.042 0.060 0.049 0.051 0.051 0.035 0.045 0.061 0.067 0.055 0.062 0.046 0.065 0.058 0.040 0.064 0.063 0.088 0.147 0.093 0.070 0.078 0.052 0.033 0.041 0.029 0.050 0.008 0.052 0.051 0.039 0.058 0.046 0.037 0.033 0.039 0.016 0.028 0.032 0.058 0.042 0.034 0.047 0.051 0.044 0.033 0.032 0.028 0.043 0.041 0.036 0.043 0.048 0.041 0.043 0.030 0.061 0.061 0.060 0.027 0.056 0.046 0.053 0.053 0.062 0.051 0.048 0.055 0.103 0.073 0.066 0.054 0.069 0.066 0.075 0.042 0.077 0.072 0.076 0.057 0.031 0.022 0.039 0.020 0.032 0.040 0.079 0.047 0.039 0.036 0.053 0.044 0.070 0.069 0.069 0.060 0.185 0.057 0.084 0.062 0.027 0.084 0.060 0.055 0.041 0.034 0.026 0.031 0.041 0.027 0.069 0.031 0.060 0.050 0.052 0.048 0.075 0.061 0.073 0.092 0.074 0.064 0.049 0.032 0.065 0.028 0.057 0.049 0.074 0.068 0.046 0.067 0.057 PC(P-18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) 0.006 0.004 0.003 0.004 0.005 0.002 0.005 0.004 0.004 0.005 0.005 0.004 0.007 0.005 0.007 0.005 0.006 0.005 0.008 0.007 0.007 0.006 0.011 0.010 0.007 0.006 0.005 0.005 0.005 0.005 0.004 0.004 0.004 0.005 0.004 0.004 0.003 0.002 0.004 0.002 0.004 0.003 0.002 0.002 0.005 0.005 0.005 0.005 0.004 0.004 0.004 0.004 0.004 0.004 0.004 0.001 0.005 0.003 0.004 0.004 0.003 0.005 0.005 0.005 0.003 0.004 0.004 0.006 0.007 0.006 0.004 0.006 0.004 0.007 0.005 0.006 0.005 0.006 0.005 0.008 0.007 0.006 0.004 0.006 0.006 0.002 0.003 0.005 0.004 0.003 0.003 0.008 0.007 0.006 0.006 0.006 0.005 0.007 0.008 0.007 0.007 0.007 0.006 0.008 0.007 0.005 0.009 0.007 0.007 0.004 0.004 0.004 0.004 0.005 0.004 0.007 0.006 0.007 0.007 0.006 0.006 0.007 0.006 0.005 0.011 0.006 0.004 0.006 0.005 0.006 0.005 0.004 0.006 0.006 0.006 0.005 0.007 0.008 PS(P-39:0) 0.007 0.004 0.005 0.003 0.005 0.004 0.005 0.005 0.003 0.004 0.004 0.004 0.010 0.010 0.009 0.007 0.007 0.008 0.007 0.008 0.007 0.007 0.007 0.012 0.008 0.005 0.005 0.004 0.002 0.002 0.002 0.002 0.004 0.004 0.006 0.003 0.004 0.004 0.005 0.005 0.004 0.003 0.003 0.001 0.005 0.004 0.003 0.005 0.004 0.003 0.002 0.002 0.002 0.003 0.002 0.002 0.004 0.005 0.004 0.003 0.002 0.008 0.006 0.006 0.008 0.006 0.007 0.005 0.006 0.007 0.005 0.004 0.006 0.012 0.007 0.011 0.006 0.006 0.006 0.006 0.005 0.005 0.005 0.005 0.004 0.004 0.003 0.005 0.002 0.003 0.003 0.008 0.006 0.006 0.005 0.006 0.005 0.004 0.004 0.003 0.003 0.004 0.003 0.005 0.005 0.004 0.006 0.004 0.005 0.003 0.003 0.004 0.002 0.004 0.004 0.005 0.004 0.004 0.004 0.003 0.004 0.006 0.005 0.006 0.007 0.006 0.005 0.004 0.003 0.004 0.004 0.004 0.005 0.006 0.006 0.003 0.006 0.005 Glycerophosphocholine (38:6) 0.161 0.255 0.167 0.116 0.165 0.156 0.151 0.130 0.109 0.105 0.066 0.085 0.132 0.148 0.141 0.132 0.104 0.170 0.120 0.073 0.131 0.133 0.143 0.242 0.175 0.121 0.130 0.082 0.054 0.066 0.041 0.077 0.019 0.086 0.093 0.053 0.078 0.066 0.058 0.077 0.091 0.044 0.062 0.046 0.130 0.096 0.074 0.117 0.108 0.082 0.064 0.056 0.048 0.068 0.081 0.052 0.077 0.085 0.090 0.086 0.058 0.110 0.124 0.106 0.038 0.093 0.088 0.096 0.111 0.104 0.102 0.078 0.096 0.197 0.143 0.142 0.105 0.135 0.132 0.125 0.065 0.124 0.121 0.138 0.099 0.076 0.053 0.072 0.038 0.063 0.082 0.161 0.125 0.080 0.082 0.099 0.114 0.115 0.097 0.113 0.096 0.298 0.090 0.161 0.131 0.090 0.174 0.112 0.120 0.072 0.075 0.071 0.062 0.114 0.059 0.152 0.069 0.150 0.118 0.114 0.102 0.164 0.138 0.156 0.198 0.166 0.153 0.085 0.053 0.109 0.041 0.088 0.094 0.114 0.103 0.062 0.108 0.088 PI(O-20:0/14:1(9Z)) 0.021 0.051 0.018 0.011 0.016 0.014 0.021 0.015 0.015 0.015 0.005 0.016 0.029 0.035 0.024 0.029 0.025 0.038 0.026 0.015 0.026 0.024 0.021 0.038 0.024 0.018 0.016 0.013 0.006 0.008 0.006 0.011 0.000 0.020 0.014 0.009 0.021 0.018 0.013 0.017 0.018 0.008 0.009 0.011 0.024 0.016 0.010 0.015 0.020 0.014 0.011 0.005 0.010 0.010 0.011 0.011 0.018 0.023 0.023 0.017 0.004 0.023 0.036 0.033 0.013 0.027 0.016 0.024 0.020 0.020 0.023 0.013 0.022 0.042 0.029 0.012 0.018 0.019 0.025 0.026 0.011 0.025 0.025 0.025 0.014 0.018 0.008 0.017 0.003 0.016 0.016 0.025 0.025 0.016 0.012 0.022 0.021 0.022 0.015 0.016 0.011 0.055 0.004 0.026 0.019 0.003 0.026 0.011 0.022 0.010 0.012 0.010 0.004 0.015 0.003 0.028 0.012 0.024 0.015 0.015 0.009 0.022 0.020 0.026 0.029 0.021 0.024 0.011 0.006 0.015 0.001 0.016 0.013 0.022 0.020 0.007 0.019 0.010 PS(39:4) 0.027 0.068 0.022 0.012 0.018 0.015 0.017 0.014 0.032 0.031 0.007 0.011 0.043 0.020 0.024 0.026 0.036 0.028 0.024 0.011 0.031 0.023 0.024 0.041 0.025 0.022 0.022 0.018 0.012 0.015 0.009 0.013 0.000 0.019 0.012 0.006 0.010 0.015 0.022 0.015 0.019 0.008 0.014 0.010 0.026 0.038 0.012 0.023 0.021 0.015 0.008 0.011 0.008 0.012 0.031 0.012 0.034 0.019 0.021 0.014 0.009 0.020 0.025 0.020 0.005 0.037 0.010 0.014 0.017 0.022 0.018 0.012 0.033 0.033 0.025 0.022 0.033 0.015 0.020 0.038 0.007 0.025 0.022 0.028 0.017 0.017 0.011 0.016 0.006 0.010 0.019 0.031 0.021 0.031 0.016 0.019 0.018 0.039 0.018 0.015 0.021 0.056 0.014 0.031 0.018 0.003 0.046 0.017 0.036 0.013 0.011 0.011 0.002 0.032 0.006 0.023 0.008 0.019 0.032 0.016 0.013 0.019 0.017 0.018 0.025 0.040 0.020 0.017 0.015 0.019 0.002 0.027 0.013 0.021 0.018 0.027 0.019 0.030 Succinic acid semialdehyde 0.002 0.001 0.003 0.003 0.002 0.003 0.004 0.003 0.002 0.003 0.001 0.001 0.002 0.001 0.001 0.002 0.002 0.003 0.003 0.002 0.002 0.002 0.002 0.003 0.003 0.001 0.002 0.002 0.001 0.001 0.002 0.002 0.003 0.002 0.001 0.001 0.001 0.003 0.003 0.004 0.003 0.003 0.002 0.004 0.003 0.002 0.002 0.003 0.001 0.001 0.003 0.002 0.003 0.002 0.002 0.002 0.004 0.003 0.003 0.004 0.004 0.003 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.003 0.001 0.002 0.003 0.004 0.003 0.003 0.003 0.002 0.004 0.002 0.002 0.002 0.002 0.002 0.003 0.001 0.001 0.001 0.002 0.001 0.003 0.004 0.004 0.003 0.003 0.003 0.003 0.002 0.002 0.001 0.003 0.002 0.003 0.003 0.002 0.002 0.004 0.002 0.003 0.003 0.002 0.002 0.001 0.002 0.003 0.002 0.001 0.001 0.001 0.001 0.002 0.003 0.002 0.003 0.004 0.002 0.002 0.003 0.003 0.003 0.003 0.002 0.003 0.004 0.002 0.002 0.002 0.002 Glycerophosphocholine (40:6) 0.031 0.053 0.023 0.016 0.035 0.026 0.025 0.021 0.018 0.015 0.007 0.011 0.022 0.035 0.022 0.027 0.022 0.034 0.032 0.021 0.032 0.038 0.027 0.048 0.031 0.016 0.011 0.023 0.010 0.016 0.010 0.017 0.002 0.025 0.025 0.012 0.020 0.021 0.010 0.015 0.015 0.007 0.010 0.004 0.030 0.023 0.009 0.022 0.019 0.010 0.016 0.003 0.014 0.015 0.017 0.007 0.021 0.021 0.025 0.021 0.009 0.033 0.037 0.034 0.013 0.024 0.025 0.028 0.034 0.029 0.031 0.013 0.022 0.045 0.027 0.022 0.018 0.021 0.013 0.033 0.019 0.030 0.033 0.028 0.020 0.030 0.012 0.020 0.009 0.016 0.021 0.030 0.030 0.018 0.011 0.022 0.014 0.034 0.022 0.029 0.021 0.072 0.025 0.028 0.022 0.011 0.030 0.013 0.019 0.013 0.011 0.012 0.006 0.020 0.009 0.036 0.014 0.030 0.020 0.014 0.011 0.029 0.031 0.023 0.026 0.025 0.023 0.005 0.004 0.022 0.002 0.012 0.014 0.029 0.022 0.008 0.029 0.016 PI(16:1(9Z)/18:1(11Z)) 0.009 0.024 0.011 0.012 0.012 0.005 0.009 0.008 0.009 0.005 0.003 0.004 0.016 0.016 0.016 0.021 0.018 0.021 0.007 0.011 0.012 0.009 0.010 0.020 0.015 0.013 0.008 0.010 0.011 0.010 0.008 0.002 0.004 0.008 0.003 0.008 0.009 0.009 0.007 0.011 0.010 0.007 0.016 0.012 0.006 0.014 0.007 0.011 0.013 0.008 0.005 0.004 0.003 0.008 0.007 0.011 0.011 0.018 0.010 0.014 0.005 0.011 0.011 0.013 0.007 0.013 0.002 0.009 0.012 0.012 0.012 0.011 0.007 0.019 0.013 0.012 0.007 0.014 0.008 0.009 0.007 0.006 0.013 0.011 0.008 0.010 0.012 0.010 0.012 0.017 0.019 0.014 0.010 0.013 0.013 0.008 0.009 0.007 0.007 0.017 0.007 0.031 0.001 0.009 0.016 0.003 0.016 0.007 0.011 0.008 0.003 0.005 0.010 0.007 0.002 0.010 0.006 0.006 0.009 0.007 0.009 0.010 0.006 0.013 0.015 0.012 0.010 0.007 0.006 0.003 0.004 0.004 0.005 0.013 0.008 0.006 0.011 0.012 PC(20:3(8Z,11Z,14Z)/20:2(11Z,14Z)) 0.035 0.028 0.030 0.029 0.028 0.043 0.028 0.030 0.022 0.023 0.019 0.014 0.034 0.032 0.032 0.030 0.027 0.028 0.031 0.026 0.030 0.030 0.037 0.050 0.037 0.030 0.028 0.015 0.012 0.011 0.009 0.017 0.012 0.020 0.027 0.016 0.016 0.016 0.018 0.016 0.015 0.010 0.011 0.008 0.021 0.016 0.016 0.019 0.015 0.013 0.008 0.009 0.010 0.008 0.012 0.007 0.020 0.021 0.017 0.017 0.015 0.029 0.030 0.024 0.026 0.026 0.026 0.027 0.026 0.028 0.022 0.019 0.022 0.037 0.027 0.030 0.026 0.030 0.030 0.027 0.026 0.025 0.028 0.025 0.023 0.013 0.013 0.015 0.014 0.013 0.015 0.031 0.023 0.023 0.023 0.025 0.023 0.025 0.023 0.024 0.025 0.024 0.019 0.023 0.028 0.054 0.031 0.028 0.024 0.020 0.016 0.019 0.018 0.022 0.020 0.025 0.024 0.023 0.025 0.025 0.024 0.034 0.028 0.034 0.044 0.035 0.030 0.021 0.019 0.020 0.020 0.022 0.024 0.027 0.020 0.018 0.023 0.030 PC(20:3(8Z,11Z,14Z)/20:1(11Z)) 0.006 0.005 0.004 0.004 0.011 0.017 0.012 0.013 0.003 0.003 0.008 0.003 0.007 0.013 0.006 0.006 0.006 0.006 0.006 0.011 0.011 0.011 0.008 0.010 0.013 0.005 0.004 0.003 0.001 0.002 0.004 0.008 0.006 0.006 0.010 0.002 0.001 0.005 0.003 0.008 0.008 0.002 0.001 0.001 0.005 0.006 0.003 0.006 0.006 0.003 0.000 0.001 0.004 0.002 0.001 0.000 0.004 0.008 0.009 0.003 0.002 0.009 0.010 0.004 0.008 0.004 0.005 0.004 0.010 0.004 0.008 0.003 0.008 0.014 0.006 0.005 0.010 0.006 0.006 0.006 0.005 0.008 0.009 0.006 0.004 0.006 0.002 0.003 0.002 0.001 0.005 0.007 0.011 0.009 0.004 0.009 0.004 0.006 0.004 0.004 0.008 0.003 0.007 0.010 0.005 0.023 0.014 0.006 0.010 0.004 0.002 0.004 0.003 0.005 0.004 0.010 0.009 0.009 0.004 0.004 0.004 0.006 0.013 0.012 0.008 0.006 0.007 0.003 0.003 0.004 0.003 0.004 0.006 0.004 0.008 0.002 0.009 0.005 PI(O-36:2) 0.020 0.031 0.013 0.004 0.018 0.013 0.014 0.007 0.005 0.007 0.005 0.004 0.006 0.020 0.012 0.015 0.013 0.020 0.020 0.009 0.016 0.017 0.014 0.026 0.019 0.005 0.011 0.011 0.005 0.006 0.002 0.001 0.000 0.013 0.005 0.007 0.011 0.013 0.002 0.008 0.009 0.002 0.006 0.002 0.018 0.012 0.001 0.014 0.008 0.005 0.009 0.004 0.001 0.009 0.004 0.003 0.011 0.014 0.012 0.013 0.004 0.021 0.018 0.017 0.003 0.016 0.011 0.015 0.017 0.017 0.019 0.008 0.010 0.024 0.013 0.013 0.007 0.010 0.008 0.016 0.009 0.013 0.014 0.014 0.008 0.011 0.004 0.010 0.002 0.005 0.010 0.016 0.013 0.009 0.007 0.013 0.011 0.014 0.011 0.014 0.013 0.034 0.012 0.015 0.010 0.002 0.010 0.003 0.012 0.011 0.009 0.004 0.001 0.010 0.002 0.016 0.006 0.018 0.007 0.012 0.004 0.018 0.007 0.014 0.016 0.014 0.009 0.002 0.001 0.013 0.000 0.004 0.002 0.013 0.018 0.000 0.012 0.006 PG(42:6) 0.202 0.233 0.198 0.144 0.171 0.115 0.155 0.141 0.172 0.154 0.124 0.102 0.236 0.207 0.208 0.187 0.186 0.206 0.190 0.139 0.177 0.188 0.210 0.316 0.198 0.152 0.168 0.142 0.109 0.135 0.093 0.105 0.066 0.170 0.144 0.142 0.181 0.155 0.083 0.072 0.080 0.052 0.068 0.066 0.138 0.122 0.111 0.138 0.143 0.092 0.124 0.082 0.097 0.114 0.133 0.097 0.107 0.136 0.122 0.139 0.088 0.171 0.139 0.161 0.114 0.179 0.126 0.179 0.161 0.179 0.149 0.158 0.157 0.237 0.166 0.178 0.137 0.155 0.141 0.170 0.112 0.156 0.160 0.189 0.155 0.130 0.108 0.119 0.101 0.132 0.132 0.206 0.154 0.130 0.144 0.153 0.165 0.149 0.134 0.170 0.158 0.441 0.122 0.191 0.158 0.083 0.202 0.155 0.146 0.112 0.107 0.114 0.111 0.183 0.105 0.210 0.132 0.183 0.184 0.164 0.142 0.237 0.142 0.212 0.243 0.217 0.163 0.107 0.084 0.142 0.091 0.137 0.131 0.147 0.128 0.108 0.145 0.176 PS(41:4) 0.065 0.117 0.067 0.044 0.055 0.045 0.064 0.041 0.049 0.044 0.022 0.038 0.058 0.072 0.065 0.055 0.050 0.065 0.055 0.031 0.059 0.064 0.068 0.120 0.074 0.058 0.061 0.033 0.020 0.028 0.010 0.035 0.005 0.037 0.032 0.025 0.035 0.028 0.032 0.034 0.044 0.015 0.027 0.028 0.055 0.041 0.028 0.054 0.050 0.034 0.024 0.010 0.010 0.029 0.030 0.014 0.031 0.041 0.036 0.039 0.025 0.049 0.046 0.042 0.012 0.042 0.031 0.040 0.045 0.049 0.044 0.039 0.048 0.088 0.059 0.062 0.041 0.055 0.054 0.048 0.026 0.051 0.047 0.057 0.037 0.033 0.022 0.032 0.016 0.031 0.040 0.076 0.050 0.036 0.036 0.041 0.042 0.048 0.041 0.049 0.037 0.150 0.040 0.073 0.052 0.026 0.076 0.056 0.047 0.024 0.031 0.024 0.022 0.046 0.022 0.058 0.026 0.056 0.043 0.041 0.041 0.067 0.053 0.063 0.085 0.074 0.054 0.048 0.029 0.053 0.018 0.044 0.034 0.050 0.050 0.037 0.056 0.040 Propanoylagmatine 0.001 0.001 0.001 0.001 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.001 0.001 0.002 0.001 0.001 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.002 0.002 0.001 0.001 0.002 0.002 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.002 0.001 0.001 0.002 0.001 0.001 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.001 0.001 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.001 0.002 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.002 0.002 0.001 0.002 0.001 0.001 0.001 0.002 PS(41:2) 0.059 0.061 0.030 0.040 0.065 0.042 0.033 0.048 0.025 0.017 0.014 0.014 0.044 0.045 0.041 0.050 0.023 0.061 0.054 0.024 0.040 0.041 0.055 0.057 0.040 0.024 0.039 0.019 0.019 0.024 0.006 0.011 0.002 0.037 0.037 0.024 0.016 0.034 0.014 0.017 0.039 0.004 0.030 0.015 0.051 0.020 0.026 0.023 0.021 0.012 0.016 0.009 0.010 0.010 0.016 0.022 0.031 0.034 0.036 0.049 0.025 0.038 0.041 0.039 0.023 0.034 0.031 0.028 0.029 0.024 0.046 0.031 0.032 0.050 0.034 0.032 0.023 0.047 0.033 0.046 0.026 0.039 0.044 0.045 0.033 0.016 0.020 0.019 0.012 0.015 0.015 0.033 0.052 0.023 0.032 0.021 0.035 0.034 0.041 0.030 0.022 0.088 0.025 0.063 0.047 0.017 0.041 0.020 0.028 0.015 0.026 0.020 0.022 0.031 0.005 0.061 0.015 0.035 0.021 0.038 0.032 0.036 0.029 0.049 0.033 0.030 0.032 0.025 0.005 0.024 0.013 0.018 0.012 0.041 0.035 0.015 0.020 0.008 N(6)-Trimethyl-L-lysine 0.003 0.003 0.003 0.003 0.002 0.003 0.003 0.002 0.003 0.003 0.003 0.002 0.005 0.004 0.004 0.003 0.003 0.004 0.006 0.004 0.005 0.004 0.003 0.003 0.002 0.002 0.002 0.005 0.003 0.003 0.003 0.003 0.003 0.004 0.003 0.003 0.003 0.003 0.003 0.003 0.003 0.002 0.003 0.002 0.004 0.003 0.003 0.003 0.003 0.003 0.003 0.004 0.003 0.003 0.003 0.003 0.003 0.003 0.002 0.002 0.003 0.004 0.003 0.003 0.003 0.003 0.003 0.005 0.005 0.004 0.004 0.004 0.003 0.003 0.003 0.003 0.003 0.003 0.003 0.005 0.004 0.005 0.004 0.004 0.005 0.003 0.003 0.003 0.003 0.003 0.004 0.005 0.004 0.003 0.003 0.004 0.003 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.003 0.003 0.003 0.003 0.002 0.003 0.003 0.003 0.003 0.003 0.004 0.002 0.002 0.002 0.002 0.002 0.002 0.003 0.002 0.002 0.003 0.002 0.002 0.004 0.003 0.003 0.003 0.003 0.002 0.007 0.004 0.003 0.003 0.003 PI (36:0) 0.021 0.027 0.022 0.015 0.023 0.014 0.015 0.012 0.019 0.016 0.008 0.009 0.016 0.021 0.015 0.021 0.005 0.021 0.015 0.011 0.021 0.015 0.025 0.032 0.025 0.018 0.019 0.014 0.001 0.008 0.004 0.010 0.001 0.014 0.010 0.012 0.012 0.016 0.008 0.009 0.010 0.001 0.004 0.005 0.002 0.012 0.006 0.013 0.012 0.010 0.012 0.009 0.005 0.011 0.018 0.011 0.019 0.012 0.008 0.010 0.010 0.024 0.027 0.018 0.012 0.020 0.017 0.014 0.017 0.018 0.015 0.014 0.013 0.043 0.028 0.028 0.016 0.020 0.021 0.026 0.016 0.023 0.026 0.024 0.022 0.008 0.005 0.012 0.002 0.010 0.012 0.017 0.013 0.010 0.007 0.014 0.013 0.026 0.022 0.028 0.022 0.053 0.022 0.023 0.018 0.007 0.028 0.014 0.017 0.009 0.006 0.008 0.008 0.013 0.004 0.027 0.013 0.028 0.020 0.023 0.009 0.019 0.014 0.022 0.022 0.028 0.019 0.012 0.006 0.018 0.001 0.016 0.013 0.022 0.017 0.008 0.016 0.015 PI(18:2(9Z,12Z)/20:1(11Z)) 0.037 0.051 0.043 0.022 0.029 0.012 0.020 0.017 0.035 0.012 0.009 0.013 0.045 0.035 0.033 0.039 0.025 0.048 0.033 0.019 0.032 0.034 0.036 0.065 0.030 0.026 0.025 0.010 0.000 0.014 0.001 0.002 0.000 0.034 0.017 0.019 0.031 0.027 0.000 0.000 0.007 0.000 0.000 0.000 0.027 0.006 0.015 0.012 0.022 0.004 0.019 0.003 0.000 0.006 0.005 0.008 0.015 0.027 0.016 0.020 0.005 0.035 0.017 0.036 0.014 0.039 0.016 0.027 0.017 0.028 0.021 0.033 0.024 0.040 0.021 0.024 0.018 0.019 0.018 0.020 0.017 0.026 0.027 0.041 0.018 0.010 0.012 0.009 0.005 0.021 0.017 0.042 0.025 0.015 0.025 0.020 0.029 0.020 0.024 0.030 0.027 0.076 0.009 0.032 0.033 0.000 0.042 0.023 0.018 0.007 0.010 0.008 0.011 0.038 0.009 0.034 0.014 0.025 0.020 0.024 0.012 0.035 0.009 0.027 0.043 0.034 0.022 0.003 0.004 0.020 0.012 0.014 0.011 0.016 0.012 0.004 0.009 0.021 Isocitric acid 0.019 0.005 0.019 0.011 0.012 0.004 0.012 0.007 0.025 0.018 0.018 0.019 0.040 0.031 0.044 0.019 0.022 0.034 0.021 0.017 0.021 0.025 0.025 0.035 0.010 0.018 0.008 0.022 0.023 0.013 0.013 0.000 0.049 0.030 0.028 0.030 0.026 0.029 0.015 0.009 0.022 0.008 0.030 0.033 0.026 0.011 0.017 0.020 0.017 0.006 0.006 0.011 0.007 0.015 0.018 0.017 0.011 0.006 0.018 0.005 0.015 0.034 0.022 0.035 0.033 0.036 0.026 0.023 0.023 0.036 0.027 0.021 0.027 0.028 0.024 0.032 0.020 0.028 0.027 0.026 0.034 0.018 0.031 0.026 0.032 0.026 0.034 0.032 0.032 0.020 0.041 0.035 0.030 0.021 0.027 0.013 0.024 0.015 0.023 0.023 0.014 0.016 0.016 0.013 0.014 0.000 0.012 0.020 0.014 0.023 0.028 0.023 0.019 0.010 0.019 0.027 0.019 0.019 0.024 0.012 0.035 0.031 0.019 0.021 0.034 0.036 0.015 0.026 0.016 0.024 0.028 0.014 0.027 0.004 0.017 0.009 0.000 0.026 Phosphocreatinine 0.002 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.002 0.000 0.001 0.001 0.001 0.000 0.000 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.002 0.001 0.002 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.002 0.001 0.002 0.001 0.001 0.002 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.002 0.002 0.001 Tartronate semialdehyde 0.014 0.020 0.012 0.003 0.008 0.000 0.000 0.000 0.014 0.011 0.000 0.007 0.009 0.014 0.017 0.019 0.017 0.017 0.005 0.000 0.002 0.000 0.000 0.032 0.010 0.001 0.005 0.013 0.006 0.014 0.000 0.000 0.000 0.011 0.000 0.002 0.014 0.023 0.000 0.005 0.004 0.000 0.014 0.009 0.016 0.015 0.000 0.018 0.018 0.006 0.014 0.000 0.003 0.003 0.005 0.007 0.002 0.013 0.006 0.010 0.013 0.011 0.000 0.020 0.000 0.018 0.000 0.007 0.000 0.010 0.002 0.005 0.002 0.023 0.012 0.023 0.000 0.000 0.002 0.015 0.000 0.007 0.003 0.015 0.006 0.007 0.000 0.006 0.000 0.007 0.026 0.002 0.000 0.003 0.005 0.010 0.000 0.013 0.012 0.027 0.016 0.006 0.024 0.012 0.019 0.000 0.013 0.008 0.007 0.000 0.005 0.009 0.000 0.008 0.000 0.018 0.000 0.013 0.009 0.008 0.003 0.012 0.000 0.014 0.014 0.017 0.005 0.000 0.000 0.010 0.000 0.000 0.000 0.013 0.023 0.000 0.002 0.000 TG(15:0/20:0/20:0) 0.005 0.004 0.005 0.005 0.004 0.005 0.005 0.004 0.004 0.005 0.003 0.004 0.005 0.005 0.004 0.004 0.006 0.005 0.003 0.002 0.004 0.005 0.003 0.007 0.005 0.004 0.008 0.003 0.004 0.005 0.003 0.005 0.003 0.006 0.004 0.004 0.007 0.007 0.002 0.004 0.006 0.003 0.005 0.007 0.006 0.007 0.004 0.006 0.004 0.003 0.005 0.005 0.005 0.004 0.004 0.005 0.005 0.004 0.003 0.005 0.005 0.005 0.005 0.006 0.004 0.005 0.003 0.004 0.003 0.006 0.003 0.006 0.006 0.005 0.005 0.005 0.005 0.004 0.006 0.007 0.004 0.005 0.006 0.005 0.004 0.005 0.005 0.004 0.005 0.005 0.006 0.004 0.003 0.002 0.005 0.006 0.006 0.005 0.004 0.004 0.005 0.006 0.004 0.004 0.006 0.002 0.006 0.005 0.003 0.005 0.003 0.006 0.003 0.006 0.003 0.005 0.003 0.005 0.006 0.005 0.005 0.003 0.005 0.005 0.007 0.005 0.004 0.003 0.003 0.003 0.002 0.003 0.003 0.005 0.004 0.004 0.005 0.006 4-Hydroxybutyric acid 0.017 0.022 0.018 0.006 0.003 0.018 0.043 0.005 0.006 0.028 0.086 0.023 0.000 0.000 0.008 0.012 0.003 0.000 0.000 0.025 0.017 0.003 0.000 0.017 0.005 0.000 0.000 0.017 0.028 0.054 0.000 0.024 0.000 0.003 0.017 0.022 0.015 0.000 0.003 0.003 0.000 0.017 0.022 0.000 0.005 0.000 0.016 0.000 0.045 0.010 0.000 0.008 0.014 0.035 0.013 0.000 0.014 0.036 0.022 0.000 0.000 0.000 0.005 0.004 0.005 0.000 0.000 0.000 0.000 0.008 0.007 0.000 0.002 0.006 0.001 0.006 0.000 0.000 0.000 0.008 0.014 0.000 0.007 0.003 0.000 0.000 0.007 0.022 0.007 0.004 0.000 0.021 0.047 0.030 0.027 0.032 0.046 0.000 0.013 0.000 0.000 0.009 0.000 0.000 0.011 0.000 0.009 0.003 0.000 0.006 0.020 0.011 0.036 0.000 0.000 0.003 0.022 0.035 0.029 0.000 0.016 0.000 0.007 0.000 0.006 0.004 0.000 0.000 0.000 0.003 0.000 0.029 0.002 0.008 0.025 0.004 0.013 0.022 Xanthine-8-carboxylate 0.001 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.001 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.000 0.001 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.000 0.001 0.001 0.000 0.000 0.000 0.000 0.001 0.001 0.000 0.001 0.001 0.000 0.000 0.001 0.001 0.000 0.001 0.000 0.000 0.001 0.000 0.000 0.001 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 Glycerophosphoinositol (41:6) 0.006 0.003 0.001 0.000 0.000 0.000 0.000 0.000 0.002 0.007 0.002 0.001 0.005 0.004 0.002 0.002 0.006 0.011 0.000 0.000 0.004 0.000 0.003 0.005 0.000 0.003 0.000 0.004 0.003 0.003 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.003 0.000 0.000 0.001 0.003 0.000 0.000 0.007 0.003 0.005 0.002 0.006 0.006 0.000 0.005 0.000 0.005 0.001 0.003 0.005 0.002 0.000 0.002 0.004 0.007 0.001 0.003 0.000 0.004 0.000 0.005 0.001 0.000 0.000 0.000 0.001 0.006 0.006 0.000 0.004 0.000 0.005 0.003 0.000 0.001 0.002 0.003 0.000 0.001 0.002 0.002 0.001 0.000 0.000 0.009 0.007 0.005 0.002 0.004 0.000 0.004 0.003 0.002 0.003 0.009 0.006 0.003 0.005 0.000 0.005 0.002 0.002 0.000 0.004 0.000 0.003 0.000 0.002 0.000 0.000 0.000 0.006 0.005 0.004 0.008 0.000 0.006 0.003 0.003 0.000 0.002 0.000 0.002 0.000 0.000 0.002 0.008 0.002 0.000 0.001 0.002 Glyceric acid 0.000 0.000 0.000 0.000 0.003 0.001 0.002 0.000 0.001 0.000 0.002 0.000 0.002 0.002 0.001 0.002 0.002 0.000 0.000 0.001 0.001 0.002 0.000 0.001 0.000 0.000 0.000 0.002 0.001 0.001 0.000 0.001 0.007 0.001 0.004 0.001 0.001 0.000 0.001 0.000 0.000 0.000 0.002 0.001 0.000 0.001 0.000 0.000 0.002 0.001 0.000 0.001 0.000 0.000 0.002 0.001 0.000 0.001 0.000 0.005 0.000 0.003 0.002 0.002 0.001 0.003 0.000 0.002 0.002 0.001 0.002 0.003 0.003 0.000 0.000 0.000 0.001 0.001 0.001 0.001 0.002 0.002 0.000 0.005 0.000 0.001 0.002 0.004 0.001 0.006 0.002 0.001 0.000 0.000 0.000 0.000 0.001 0.000 0.004 0.003 0.000 0.004 0.001 0.002 0.000 0.000 0.000 0.002 0.001 0.000 0.002 0.000 0.000 0.005 0.002 0.001 0.000 0.001 0.002 0.004 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.001 0.001 0.000 0.002 0.008 0.000 0.000 0.003 0.004 0.000 2-Hydroxyundecanoate 0.001 0.001 0.001 0.000 0.001 0.000 0.001 0.000 0.001 0.000 0.002 0.007 0.010 0.009 0.009 0.008 0.007 0.019 0.004 0.003 0.003 0.003 0.004 0.006 0.004 0.003 0.003 0.007 0.005 0.005 0.005 0.004 0.025 0.020 0.014 0.014 0.010 0.019 0.002 0.002 0.002 0.002 0.002 0.002 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.008 0.008 0.008 0.007 0.005 0.005 0.004 0.004 0.005 0.004 0.003 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.007 0.006 0.007 0.006 0.016 0.011 0.001 0.001 0.001 0.001 0.000 0.001 0.007 0.005 0.004 0.004 0.004 0.004 0.007 0.006 0.006 0.006 0.006 0.005 0.000 0.000 0.000 0.000 0.000 0.000 0.004 0.004 0.004 0.004 0.004 0.002 0.003 0.003 0.003 0.003 0.002 0.002 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.001 0.000 cis-(homo)2aconitate 0.024 0.021 0.024 0.021 0.036 0.026 0.024 0.021 0.021 0.025 0.024 0.026 0.033 0.023 0.023 0.023 0.041 0.023 0.021 0.024 0.025 0.032 0.023 0.027 0.019 0.026 0.030 0.026 0.025 0.028 0.031 0.034 0.024 0.027 0.022 0.023 0.027 0.025 0.036 0.026 0.028 0.026 0.030 0.027 0.022 0.021 0.026 0.024 0.033 0.024 0.021 0.026 0.024 0.028 0.037 0.024 0.024 0.024 0.024 0.041 0.020 0.021 0.022 0.020 0.021 0.038 0.023 0.030 0.025 0.021 0.019 0.047 0.028 0.023 0.027 0.029 0.029 0.028 0.025 0.027 0.023 0.027 0.020 0.042 0.026 0.025 0.029 0.029 0.027 0.045 0.021 0.029 0.026 0.026 0.026 0.028 0.030 0.025 0.027 0.030 0.029 0.036 0.033 0.024 0.029 0.028 0.028 0.037 0.037 0.023 0.031 0.029 0.035 0.050 0.028 0.021 0.022 0.023 0.030 0.049 0.027 0.023 0.026 0.028 0.026 0.033 0.029 0.026 0.022 0.022 0.023 0.026 0.029 0.029 0.022 0.028 0.049 0.027 N3-fumaramoyl-L-2,3-diaminopropanoate 0.016 0.010 0.023 0.019 0.073 0.006 0.007 0.004 0.000 0.034 0.057 0.037 0.035 0.082 0.081 0.041 0.100 0.040 0.007 0.134 0.022 0.133 0.013 0.029 0.020 0.012 0.032 0.011 0.140 0.121 0.035 0.050 0.303 0.105 0.446 0.255 0.045 0.124 0.108 0.098 0.219 0.022 0.035 0.061 0.000 0.010 0.019 0.056 0.035 0.026 0.008 0.107 0.050 0.083 0.045 0.091 0.067 0.186 0.155 0.123 0.061 0.091 0.118 0.126 0.123 0.209 0.063 0.034 0.033 0.073 0.059 0.134 0.052 0.067 0.031 0.019 0.108 0.100 0.090 0.034 0.065 0.061 0.027 0.299 0.054 0.075 0.238 0.409 0.142 0.255 0.143 0.011 0.009 0.000 0.018 0.001 0.013 0.000 0.026 0.014 0.018 0.051 0.059 0.017 0.000 0.000 0.022 0.066 0.052 0.008 0.144 0.025 0.047 0.087 0.004 0.029 0.138 0.113 0.054 0.102 0.041 0.016 0.020 0.021 0.031 0.112 0.038 0.028 0.019 0.038 0.056 0.028 0.116 0.008 0.014 0.022 0.265 0.013 Dimethylarginine 0.002 0.001 0.002 0.002 0.002 0.002 0.003 0.002 0.003 0.002 0.002 0.001 0.003 0.002 0.002 0.002 0.002 0.002 0.003 0.002 0.002 0.002 0.003 0.004 0.002 0.002 0.002 0.003 0.003 0.002 0.002 0.003 0.003 0.002 0.001 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.001 0.002 0.002 0.001 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.001 0.003 0.002 0.002 0.002 0.002 0.002 0.003 0.002 0.003 0.002 0.003 0.002 0.001 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.003 0.003 0.002 0.002 0.002 0.002 0.003 0.003 0.002 0.002 0.002 0.003 0.002 0.002 0.003 0.002 0.002 0.002 0.003 0.002 0.003 0.002 0.003 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.003 0.004 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.003 0.002 0.001 0.002 0.002 L-Acetylcarnitine 0.426 0.435 0.444 0.407 0.191 0.447 0.584 0.577 0.524 0.497 0.422 0.253 0.350 0.471 0.557 0.335 0.138 0.122 0.239 0.384 0.353 0.137 0.296 0.370 0.203 0.153 0.073 0.337 0.391 0.395 0.289 0.141 0.109 0.260 0.425 0.287 0.193 0.129 0.320 0.176 0.217 0.344 0.279 0.097 0.288 0.237 0.348 0.357 0.335 0.183 0.114 0.242 0.323 0.281 0.159 0.059 0.327 0.750 0.467 0.152 0.086 0.144 0.137 0.216 0.168 0.087 0.102 0.152 0.174 0.202 0.182 0.101 0.117 0.399 0.257 0.213 0.151 0.130 0.113 0.304 0.268 0.359 0.205 0.106 0.100 0.247 0.269 0.404 0.210 0.071 0.071 0.687 0.564 0.522 0.449 0.375 0.370 0.380 0.419 0.397 0.284 0.241 0.076 0.206 0.185 0.271 0.222 0.142 0.097 0.414 0.446 0.361 0.456 0.159 0.134 0.259 0.327 0.388 0.249 0.081 0.155 0.202 0.150 0.163 0.166 0.111 0.160 0.309 0.155 0.162 0.131 0.223 0.086 0.347 0.269 0.225 0.123 0.305 Epimedin K 0.009 0.007 0.014 0.009 0.010 0.009 0.008 0.008 0.011 0.010 0.008 0.009 0.011 0.013 0.010 0.011 0.009 0.012 0.008 0.008 0.010 0.010 0.011 0.012 0.009 0.011 0.009 0.011 0.010 0.013 0.010 0.009 0.006 0.009 0.009 0.011 0.009 0.010 0.008 0.009 0.010 0.009 0.011 0.011 0.008 0.009 0.009 0.011 0.011 0.009 0.010 0.010 0.008 0.010 0.010 0.011 0.011 0.010 0.014 0.009 0.009 0.011 0.010 0.011 0.007 0.011 0.009 0.008 0.008 0.011 0.010 0.009 0.010 0.011 0.012 0.010 0.009 0.010 0.009 0.009 0.007 0.014 0.010 0.010 0.009 0.009 0.011 0.013 0.011 0.009 0.011 0.012 0.009 0.010 0.008 0.009 0.009 0.008 0.010 0.012 0.010 0.011 0.012 0.010 0.011 0.006 0.012 0.008 0.009 0.008 0.011 0.009 0.010 0.009 0.008 0.009 0.009 0.010 0.012 0.011 0.011 0.010 0.011 0.010 0.010 0.012 0.008 0.009 0.009 0.012 0.008 0.009 0.009 0.010 0.008 0.010 0.012 0.013 Triradylglycero (60:5) 0.001 0.002 0.001 0.001 0.003 0.001 0.001 0.002 0.002 0.005 0.000 0.004 0.002 0.004 0.003 0.004 0.002 0.002 0.001 0.001 0.002 0.004 0.003 0.001 0.003 0.002 0.004 0.002 0.003 0.002 0.002 0.003 0.000 0.001 0.001 0.003 0.002 0.005 0.003 0.003 0.002 0.002 0.002 0.002 0.002 0.002 0.000 0.004 0.003 0.002 0.001 0.000 0.002 0.002 0.003 0.002 0.003 0.002 0.003 0.002 0.000 0.003 0.002 0.005 0.002 0.005 0.002 0.001 0.002 0.005 0.003 0.000 0.002 0.003 0.002 0.003 0.002 0.003 0.003 0.004 0.002 0.002 0.003 0.002 0.002 0.001 0.001 0.003 0.002 0.002 0.004 0.001 0.003 0.001 0.001 0.002 0.002 0.003 0.004 0.002 0.002 0.003 0.003 0.005 0.003 0.000 0.004 0.003 0.002 0.001 0.001 0.002 0.001 0.002 0.004 0.003 0.001 0.003 0.005 0.004 0.005 0.002 0.001 0.002 0.003 0.004 0.004 0.002 0.001 0.002 0.002 0.001 0.000 0.001 0.001 0.001 0.002 0.002 Triradylglycerol (61:8) 0.005 0.004 0.007 0.008 0.006 0.004 0.005 0.004 0.006 0.004 0.003 0.007 0.006 0.006 0.008 0.004 0.005 0.008 0.005 0.004 0.004 0.004 0.005 0.005 0.004 0.007 0.005 0.006 0.006 0.006 0.004 0.005 0.002 0.007 0.004 0.005 0.007 0.005 0.006 0.006 0.004 0.006 0.007 0.008 0.007 0.006 0.005 0.007 0.006 0.005 0.007 0.009 0.005 0.006 0.008 0.007 0.007 0.004 0.006 0.004 0.008 0.005 0.007 0.006 0.003 0.007 0.005 0.006 0.006 0.005 0.007 0.006 0.005 0.006 0.008 0.008 0.004 0.007 0.007 0.005 0.005 0.004 0.004 0.006 0.005 0.008 0.006 0.006 0.005 0.007 0.008 0.006 0.005 0.005 0.005 0.006 0.007 0.006 0.007 0.006 0.005 0.004 0.006 0.006 0.008 0.003 0.006 0.005 0.006 0.005 0.006 0.007 0.006 0.004 0.005 0.006 0.004 0.005 0.006 0.006 0.004 0.006 0.005 0.006 0.006 0.007 0.007 0.004 0.005 0.008 0.005 0.005 0.004 0.005 0.006 0.006 0.009 0.005 CDP-DG(16:0/20:4(5Z,8Z,11Z,14Z)) 0.002 0.002 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.003 0.002 0.002 0.002 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.002 0.001 0.002 0.002 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.001 0.002 0.001 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.001 0.001 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.003 0.002 0.002 0.002 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.001 0.001 0.002 0.001 0.001 0.001 0.002 0.001 0.001 0.002 0.002 0.001 0.002 0.001 0.002 0.001 0.001 0.001 0.001 0.002 0.001 0.002 0.002 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.002 0.002 0.001 0.002 CDP-Glycerophospholipid (18:1(9Z)/18:2(9Z,12Z)) 0.048 0.081 0.040 0.014 0.043 0.033 0.045 0.020 0.019 0.021 0.014 0.034 0.034 0.067 0.032 0.035 0.034 0.056 0.044 0.030 0.030 0.029 0.045 0.070 0.049 0.023 0.019 0.018 0.009 0.012 0.007 0.015 0.003 0.019 0.031 0.010 0.018 0.019 0.019 0.032 0.026 0.025 0.017 0.013 0.028 0.038 0.012 0.028 0.041 0.018 0.015 0.009 0.011 0.016 0.020 0.012 0.020 0.023 0.041 0.028 0.014 0.033 0.037 0.031 0.013 0.030 0.032 0.043 0.043 0.026 0.043 0.018 0.025 0.071 0.029 0.036 0.026 0.029 0.026 0.028 0.012 0.028 0.029 0.043 0.016 0.042 0.012 0.026 0.010 0.037 0.042 0.027 0.048 0.036 0.033 0.024 0.017 0.045 0.021 0.018 0.017 0.091 0.015 0.028 0.040 0.006 0.034 0.031 0.020 0.013 0.011 0.012 0.006 0.019 0.010 0.028 0.010 0.042 0.017 0.019 0.026 0.034 0.024 0.028 0.035 0.031 0.047 0.019 0.008 0.024 0.004 0.018 0.034 0.043 0.026 0.010 0.027 0.019 Glycerophosphocholine (52:4) 0.012 0.008 0.014 0.009 0.012 0.008 0.009 0.011 0.011 0.013 0.009 0.011 0.013 0.010 0.010 0.012 0.008 0.010 0.009 0.008 0.009 0.010 0.011 0.008 0.010 0.013 0.011 0.010 0.011 0.011 0.010 0.009 0.007 0.011 0.008 0.010 0.010 0.010 0.006 0.012 0.009 0.009 0.013 0.013 0.009 0.010 0.009 0.013 0.010 0.012 0.011 0.009 0.009 0.009 0.010 0.012 0.009 0.009 0.008 0.010 0.010 0.014 0.012 0.011 0.009 0.012 0.009 0.011 0.010 0.013 0.008 0.010 0.010 0.012 0.011 0.012 0.008 0.010 0.011 0.012 0.008 0.010 0.011 0.009 0.008 0.010 0.013 0.009 0.011 0.013 0.009 0.010 0.010 0.010 0.010 0.012 0.009 0.008 0.011 0.011 0.009 0.009 0.011 0.011 0.012 0.005 0.012 0.007 0.011 0.008 0.010 0.011 0.007 0.009 0.010 0.013 0.008 0.009 0.012 0.011 0.011 0.010 0.009 0.011 0.013 0.011 0.010 0.011 0.009 0.011 0.008 0.009 0.011 0.010 0.009 0.010 0.010 0.010 CDP-Glycerophospholipid (38:6) 0.041 0.062 0.036 0.021 0.030 0.019 0.031 0.017 0.026 0.026 0.011 0.022 0.038 0.045 0.038 0.032 0.028 0.039 0.032 0.017 0.031 0.025 0.037 0.061 0.044 0.031 0.035 0.025 0.016 0.021 0.015 0.017 0.004 0.020 0.018 0.008 0.019 0.018 0.016 0.024 0.026 0.015 0.016 0.015 0.035 0.030 0.017 0.033 0.035 0.022 0.019 0.014 0.010 0.013 0.025 0.018 0.015 0.022 0.016 0.018 0.014 0.027 0.023 0.026 0.010 0.025 0.015 0.023 0.022 0.030 0.023 0.021 0.022 0.052 0.036 0.040 0.026 0.033 0.030 0.022 0.009 0.023 0.026 0.029 0.026 0.022 0.015 0.021 0.014 0.021 0.021 0.037 0.027 0.017 0.023 0.029 0.026 0.021 0.020 0.026 0.018 0.075 0.018 0.036 0.029 0.008 0.040 0.025 0.027 0.018 0.020 0.010 0.014 0.025 0.016 0.027 0.009 0.023 0.018 0.019 0.016 0.034 0.025 0.038 0.044 0.040 0.032 0.020 0.018 0.020 0.010 0.022 0.023 0.030 0.030 0.021 0.026 0.026 CDP-Glycerophospholipid (38:5) 0.021 0.035 0.031 0.006 0.024 0.019 0.024 0.006 0.020 0.018 0.010 0.017 0.032 0.034 0.028 0.035 0.013 0.020 0.019 0.016 0.021 0.021 0.031 0.037 0.023 0.014 0.024 0.025 0.011 0.010 0.000 0.015 0.000 0.025 0.000 0.005 0.021 0.024 0.015 0.018 0.016 0.010 0.017 0.010 0.027 0.025 0.019 0.013 0.017 0.015 0.006 0.013 0.008 0.006 0.025 0.011 0.011 0.026 0.024 0.022 0.000 0.019 0.015 0.019 0.000 0.020 0.017 0.026 0.020 0.028 0.012 0.017 0.024 0.030 0.019 0.032 0.009 0.018 0.010 0.018 0.013 0.024 0.029 0.028 0.020 0.001 0.004 0.007 0.009 0.021 0.021 0.033 0.014 0.017 0.014 0.020 0.021 0.010 0.012 0.015 0.021 0.050 0.007 0.021 0.016 0.003 0.019 0.019 0.016 0.019 0.016 0.016 0.014 0.022 0.010 0.015 0.008 0.018 0.016 0.021 0.020 0.017 0.019 0.027 0.032 0.030 0.020 0.020 0.005 0.019 0.004 0.007 0.006 0.025 0.016 0.006 0.024 0.008 CDP-Glycerophospholipid (38:4) 0.024 0.040 0.019 0.009 0.020 0.017 0.017 0.015 0.009 0.009 0.005 0.010 0.020 0.030 0.015 0.019 0.016 0.022 0.030 0.017 0.026 0.027 0.023 0.035 0.028 0.014 0.012 0.017 0.009 0.015 0.006 0.009 0.001 0.021 0.019 0.011 0.015 0.020 0.011 0.012 0.013 0.005 0.008 0.005 0.020 0.017 0.005 0.020 0.016 0.008 0.016 0.005 0.011 0.009 0.011 0.009 0.015 0.019 0.020 0.018 0.003 0.026 0.026 0.026 0.013 0.021 0.016 0.026 0.034 0.016 0.024 0.016 0.019 0.036 0.025 0.023 0.016 0.016 0.017 0.026 0.012 0.019 0.021 0.023 0.017 0.017 0.005 0.014 0.005 0.013 0.018 0.022 0.024 0.013 0.012 0.015 0.008 0.023 0.020 0.022 0.018 0.052 0.016 0.023 0.018 0.004 0.026 0.005 0.017 0.011 0.005 0.014 0.006 0.014 0.005 0.030 0.012 0.032 0.009 0.012 0.005 0.021 0.021 0.021 0.022 0.024 0.019 0.010 0.004 0.018 0.004 0.011 0.010 0.017 0.021 0.008 0.023 0.014 Dehydrotomatine 0.020 0.039 0.021 0.013 0.017 0.014 0.013 0.010 0.017 0.016 0.007 0.011 0.024 0.025 0.021 0.024 0.020 0.024 0.024 0.012 0.019 0.015 0.022 0.041 0.024 0.020 0.026 0.015 0.008 0.007 0.006 0.009 0.001 0.013 0.008 0.008 0.010 0.008 0.010 0.013 0.015 0.005 0.011 0.012 0.022 0.018 0.012 0.019 0.019 0.016 0.010 0.009 0.004 0.010 0.013 0.007 0.010 0.013 0.010 0.012 0.004 0.016 0.016 0.019 0.002 0.015 0.013 0.018 0.015 0.018 0.013 0.011 0.014 0.037 0.022 0.023 0.020 0.019 0.017 0.016 0.004 0.023 0.023 0.020 0.015 0.013 0.007 0.011 0.005 0.007 0.016 0.028 0.014 0.010 0.013 0.014 0.018 0.015 0.010 0.015 0.012 0.044 0.011 0.025 0.018 0.005 0.025 0.017 0.019 0.008 0.007 0.007 0.006 0.014 0.008 0.017 0.003 0.014 0.009 0.011 0.012 0.025 0.019 0.028 0.032 0.030 0.022 0.015 0.003 0.014 0.002 0.012 0.010 0.020 0.018 0.013 0.019 0.016 Triradylglycerol (65:6) 0.008 0.006 0.011 0.008 0.007 0.008 0.009 0.009 0.007 0.008 0.007 0.008 0.007 0.008 0.010 0.006 0.007 0.008 0.007 0.009 0.007 0.009 0.008 0.012 0.009 0.009 0.007 0.007 0.008 0.009 0.007 0.006 0.004 0.008 0.007 0.007 0.008 0.006 0.006 0.009 0.007 0.009 0.010 0.008 0.010 0.007 0.007 0.008 0.011 0.009 0.007 0.009 0.008 0.009 0.010 0.006 0.009 0.007 0.009 0.008 0.008 0.007 0.008 0.008 0.007 0.009 0.007 0.009 0.006 0.008 0.008 0.010 0.008 0.010 0.008 0.011 0.009 0.011 0.010 0.009 0.008 0.008 0.009 0.009 0.007 0.007 0.008 0.009 0.009 0.009 0.011 0.007 0.009 0.006 0.005 0.010 0.009 0.009 0.009 0.010 0.009 0.012 0.009 0.007 0.009 0.005 0.007 0.009 0.006 0.007 0.007 0.009 0.008 0.008 0.007 0.008 0.009 0.012 0.010 0.010 0.006 0.009 0.010 0.008 0.009 0.009 0.006 0.009 0.009 0.008 0.007 0.008 0.008 0.007 0.008 0.007 0.007 0.007 Galactaric acid 0.001 0.000 0.001 0.001 0.000 0.000 0.001 0.000 0.000 0.001 0.001 0.000 0.010 0.004 0.005 0.004 0.000 0.006 0.002 0.001 0.003 0.002 0.002 0.007 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.011 0.006 0.002 0.020 0.003 0.004 0.018 0.000 0.001 0.000 0.000 0.004 0.002 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.001 0.000 0.000 0.007 0.001 0.006 0.003 0.006 0.004 0.002 0.001 0.006 0.003 0.001 0.007 0.004 0.003 0.003 0.004 0.001 0.007 0.003 0.003 0.004 0.003 0.003 0.006 0.004 0.009 0.005 0.006 0.003 0.007 0.004 0.002 0.000 0.003 0.000 0.004 0.001 0.004 0.001 0.000 0.001 0.000 0.001 0.004 0.000 0.003 0.003 0.000 0.002 0.000 0.002 0.001 0.000 0.003 0.000 0.004 0.001 0.000 0.000 0.001 0.007 0.002 0.001 0.009 0.003 0.002 0.003 0.002 0.003 0.005 0.003 0.002 0.000 0.002 0.000 0.000 0.002 Sedoheptulose 0.038 0.042 0.060 0.047 0.047 0.048 0.037 0.028 0.034 0.032 0.026 0.025 0.049 0.052 0.055 0.047 0.044 0.056 0.031 0.021 0.026 0.036 0.026 0.047 0.037 0.023 0.040 0.019 0.011 0.015 0.013 0.007 0.007 0.035 0.030 0.014 0.023 0.039 0.024 0.021 0.028 0.012 0.023 0.023 0.040 0.033 0.040 0.032 0.034 0.032 0.039 0.054 0.034 0.053 0.053 0.057 0.036 0.043 0.041 0.040 0.052 0.053 0.033 0.035 0.035 0.054 0.038 0.023 0.012 0.019 0.025 0.034 0.021 0.051 0.036 0.035 0.034 0.030 0.040 0.030 0.025 0.027 0.022 0.044 0.020 0.034 0.025 0.034 0.029 0.037 0.047 0.051 0.045 0.027 0.053 0.035 0.047 0.032 0.027 0.020 0.023 0.032 0.011 0.032 0.028 0.005 0.036 0.023 0.024 0.018 0.040 0.041 0.023 0.030 0.026 0.024 0.013 0.022 0.026 0.020 0.036 0.046 0.048 0.039 0.048 0.035 0.029 0.018 0.013 0.028 0.014 0.023 0.023 0.037 0.031 0.040 0.029 0.024 Kaempferol 3-rhamnosyl-(1->2)-[glucosyl-(1->3)-(4'''-p-coumaroylrhamnosyl)-(1->6)-galactoside] 0.005 0.006 0.008 0.004 0.004 0.005 0.005 0.004 0.007 0.006 0.005 0.006 0.007 0.005 0.006 0.003 0.004 0.006 0.004 0.005 0.003 0.005 0.004 0.006 0.004 0.004 0.005 0.004 0.006 0.006 0.003 0.005 0.002 0.005 0.003 0.004 0.007 0.006 0.004 0.004 0.006 0.004 0.005 0.006 0.005 0.004 0.006 0.006 0.006 0.005 0.007 0.005 0.003 0.005 0.005 0.005 0.004 0.007 0.005 0.005 0.004 0.005 0.005 0.003 0.004 0.004 0.006 0.005 0.004 0.005 0.004 0.004 0.004 0.005 0.006 0.004 0.005 0.005 0.007 0.005 0.002 0.005 0.005 0.007 0.006 0.005 0.005 0.004 0.005 0.006 0.005 0.005 0.004 0.004 0.006 0.004 0.004 0.004 0.005 0.008 0.005 0.004 0.004 0.005 0.006 0.003 0.006 0.003 0.005 0.005 0.006 0.005 0.004 0.005 0.004 0.005 0.003 0.007 0.005 0.006 0.003 0.005 0.005 0.006 0.004 0.006 0.005 0.005 0.004 0.007 0.003 0.004 0.005 0.004 0.004 0.005 0.005 0.004 CDP-Glycerophospholipid(40:6) 0.028 0.047 0.029 0.015 0.023 0.014 0.024 0.014 0.015 0.015 0.015 0.016 0.024 0.028 0.028 0.030 0.022 0.027 0.028 0.014 0.024 0.026 0.023 0.035 0.021 0.020 0.020 0.021 0.016 0.018 0.014 0.012 0.001 0.027 0.017 0.015 0.025 0.024 0.014 0.016 0.018 0.011 0.015 0.011 0.024 0.018 0.015 0.021 0.023 0.014 0.013 0.017 0.012 0.014 0.021 0.015 0.022 0.021 0.023 0.020 0.013 0.026 0.025 0.022 0.008 0.024 0.013 0.027 0.019 0.025 0.016 0.020 0.018 0.033 0.020 0.027 0.020 0.018 0.015 0.024 0.013 0.021 0.026 0.022 0.023 0.022 0.019 0.021 0.012 0.019 0.028 0.032 0.026 0.020 0.019 0.023 0.023 0.027 0.020 0.028 0.027 0.046 0.017 0.028 0.021 0.005 0.023 0.014 0.022 0.016 0.015 0.012 0.010 0.018 0.010 0.018 0.007 0.020 0.015 0.017 0.011 0.028 0.018 0.022 0.029 0.026 0.021 0.019 0.006 0.018 0.008 0.014 0.014 0.029 0.021 0.018 0.022 0.019 Glycerophosphoserine (55:0) 0.004 0.004 0.004 0.004 0.004 0.003 0.005 0.004 0.006 0.004 0.003 0.004 0.003 0.006 0.005 0.005 0.002 0.003 0.003 0.002 0.003 0.004 0.003 0.003 0.003 0.003 0.004 0.004 0.004 0.006 0.004 0.003 0.000 0.003 0.002 0.004 0.004 0.004 0.002 0.004 0.002 0.002 0.004 0.003 0.003 0.003 0.003 0.004 0.005 0.003 0.001 0.004 0.003 0.004 0.003 0.002 0.003 0.004 0.004 0.003 0.003 0.003 0.003 0.009 0.002 0.004 0.002 0.003 0.004 0.003 0.005 0.002 0.004 0.004 0.004 0.004 0.002 0.002 0.003 0.002 0.003 0.003 0.005 0.003 0.002 0.002 0.003 0.003 0.003 0.004 0.004 0.003 0.003 0.002 0.002 0.004 0.005 0.005 0.003 0.004 0.003 0.004 0.005 0.004 0.004 0.002 0.004 0.003 0.004 0.002 0.004 0.005 0.003 0.003 0.003 0.004 0.001 0.004 0.002 0.002 0.005 0.005 0.003 0.004 0.002 0.003 0.003 0.003 0.002 0.005 0.003 0.003 0.003 0.005 0.004 0.002 0.003 0.003 Beta-1,4-D-Mannosylchitobiosyldiphosphodolichol 0.004 0.004 0.004 0.004 0.005 0.003 0.004 0.004 0.002 0.004 0.003 0.004 0.004 0.005 0.005 0.005 0.004 0.006 0.003 0.004 0.005 0.005 0.007 0.005 0.004 0.006 0.006 0.005 0.005 0.006 0.005 0.005 0.003 0.004 0.003 0.004 0.005 0.004 0.004 0.004 0.004 0.004 0.005 0.006 0.004 0.004 0.003 0.004 0.004 0.005 0.003 0.005 0.004 0.005 0.004 0.004 0.005 0.003 0.005 0.004 0.006 0.005 0.004 0.006 0.004 0.003 0.005 0.004 0.004 0.006 0.004 0.006 0.005 0.006 0.005 0.005 0.005 0.005 0.006 0.006 0.002 0.005 0.006 0.005 0.004 0.006 0.004 0.006 0.006 0.005 0.006 0.003 0.004 0.002 0.003 0.004 0.004 0.004 0.005 0.005 0.006 0.006 0.004 0.004 0.004 0.002 0.004 0.004 0.005 0.004 0.004 0.004 0.004 0.004 0.004 0.005 0.005 0.004 0.007 0.007 0.007 0.005 0.004 0.005 0.005 0.005 0.004 0.005 0.005 0.005 0.005 0.004 0.004 0.003 0.005 0.003 0.006 0.006 Phosphocreatine 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 UDP-N-acetylmuramoyl-L-Ala-D-gamma-Glu-6-carboxy-L-Lys-D-Ala 0.008 0.011 0.012 0.009 0.010 0.008 0.009 0.009 0.011 0.010 0.006 0.009 0.010 0.009 0.011 0.011 0.010 0.010 0.006 0.007 0.008 0.009 0.009 0.009 0.008 0.008 0.011 0.010 0.008 0.011 0.009 0.009 0.004 0.007 0.008 0.008 0.009 0.009 0.008 0.009 0.009 0.008 0.010 0.011 0.009 0.010 0.008 0.011 0.012 0.009 0.010 0.007 0.008 0.007 0.011 0.009 0.010 0.009 0.010 0.010 0.009 0.010 0.008 0.010 0.008 0.010 0.006 0.008 0.008 0.011 0.010 0.011 0.008 0.009 0.009 0.010 0.009 0.010 0.009 0.012 0.008 0.008 0.010 0.010 0.009 0.009 0.008 0.010 0.009 0.009 0.011 0.009 0.008 0.006 0.009 0.009 0.009 0.010 0.010 0.012 0.010 0.010 0.012 0.010 0.013 0.005 0.009 0.010 0.009 0.008 0.008 0.008 0.008 0.009 0.008 0.008 0.007 0.010 0.010 0.008 0.010 0.010 0.010 0.010 0.011 0.007 0.010 0.009 0.009 0.011 0.007 0.009 0.009 0.009 0.009 0.008 0.010 0.010 N-(2-hydroxyhexacosanoyl)-eicosasphinganine-1-O-[D-mannopyranosyl-alpha1-2-myo-inositol-1-phosphate] 0.008 0.007 0.007 0.005 0.008 0.005 0.003 0.004 0.006 0.008 0.004 0.008 0.007 0.008 0.008 0.009 0.006 0.007 0.006 0.005 0.006 0.006 0.006 0.005 0.006 0.006 0.009 0.007 0.006 0.009 0.004 0.007 0.002 0.005 0.005 0.004 0.004 0.007 0.005 0.006 0.008 0.006 0.007 0.006 0.008 0.007 0.005 0.009 0.008 0.005 0.006 0.007 0.007 0.007 0.006 0.005 0.006 0.007 0.007 0.006 0.005 0.007 0.007 0.006 0.003 0.007 0.005 0.005 0.007 0.007 0.007 0.007 0.008 0.005 0.005 0.006 0.005 0.007 0.006 0.006 0.006 0.006 0.007 0.006 0.005 0.004 0.007 0.007 0.005 0.007 0.007 0.006 0.004 0.005 0.007 0.007 0.004 0.006 0.007 0.008 0.008 0.005 0.007 0.007 0.006 0.005 0.006 0.007 0.007 0.006 0.008 0.008 0.007 0.006 0.005 0.003 0.003 0.007 0.006 0.008 0.004 0.007 0.007 0.005 0.007 0.008 0.005 0.006 0.004 0.005 0.003 0.005 0.005 0.007 0.004 0.008 0.006 0.005 Trihexosylceramide (d18:1/24:0) 0.004 0.006 0.005 0.003 0.004 0.002 0.004 0.004 0.005 0.005 0.004 0.005 0.004 0.004 0.006 0.006 0.004 0.005 0.003 0.003 0.004 0.004 0.004 0.005 0.005 0.003 0.004 0.004 0.002 0.004 0.005 0.004 0.002 0.006 0.003 0.004 0.004 0.004 0.004 0.004 0.003 0.005 0.004 0.004 0.003 0.005 0.006 0.004 0.006 0.005 0.004 0.004 0.004 0.005 0.003 0.005 0.004 0.004 0.004 0.004 0.003 0.004 0.003 0.007 0.004 0.004 0.004 0.004 0.005 0.004 0.004 0.004 0.004 0.004 0.005 0.005 0.004 0.004 0.004 0.004 0.003 0.004 0.003 0.004 0.004 0.002 0.003 0.004 0.004 0.006 0.005 0.005 0.004 0.004 0.004 0.005 0.006 0.004 0.004 0.005 0.004 0.004 0.005 0.003 0.004 0.002 0.005 0.003 0.005 0.005 0.004 0.004 0.005 0.004 0.003 0.003 0.005 0.004 0.004 0.004 0.006 0.005 0.003 0.006 0.005 0.006 0.005 0.004 0.004 0.003 0.003 0.005 0.002 0.005 0.003 0.003 0.004 0.004 Iodipamide 0.000 0.013 0.001 0.002 0.005 0.001 0.017 0.001 0.004 0.004 0.000 0.013 0.007 0.012 0.020 0.008 0.010 0.023 0.017 0.000 0.017 0.006 0.007 0.011 0.007 0.004 0.002 0.000 0.000 0.001 0.000 0.001 0.000 0.002 0.000 0.008 0.003 0.016 0.010 0.013 0.016 0.002 0.003 0.000 0.015 0.016 0.000 0.018 0.005 0.011 0.003 0.000 0.000 0.011 0.002 0.000 0.001 0.017 0.004 0.003 0.002 0.006 0.010 0.020 0.000 0.005 0.013 0.004 0.003 0.019 0.016 0.011 0.001 0.020 0.004 0.006 0.009 0.004 0.009 0.003 0.009 0.005 0.007 0.015 0.001 0.003 0.000 0.003 0.000 0.000 0.003 0.007 0.006 0.002 0.002 0.003 0.003 0.002 0.003 0.001 0.000 0.039 0.000 0.005 0.015 0.000 0.010 0.000 0.003 0.000 0.000 0.001 0.000 0.010 0.004 0.008 0.005 0.003 0.001 0.003 0.002 0.017 0.014 0.018 0.021 0.019 0.016 0.003 0.000 0.004 0.000 0.002 0.002 0.005 0.003 0.000 0.016 0.000 N-(2-hydroxyhexacosanoyl)-4R-hydroxyeicosasphinganine-1-O-[D-mannopyranosyl-alpha1-2-myo-inositol-1-phosphate] 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 3S-hydroxyhexacosanoyl-CoA 0.026 0.041 0.028 0.017 0.022 0.019 0.021 0.016 0.021 0.020 0.013 0.015 0.029 0.024 0.026 0.024 0.020 0.026 0.021 0.016 0.024 0.021 0.025 0.038 0.025 0.024 0.024 0.018 0.015 0.016 0.012 0.012 0.000 0.019 0.015 0.013 0.015 0.017 0.014 0.016 0.019 0.014 0.016 0.014 0.023 0.021 0.016 0.021 0.023 0.018 0.011 0.013 0.012 0.012 0.018 0.013 0.013 0.019 0.015 0.012 0.012 0.022 0.015 0.019 0.008 0.017 0.014 0.016 0.020 0.019 0.017 0.018 0.022 0.033 0.027 0.027 0.022 0.024 0.023 0.018 0.012 0.025 0.019 0.020 0.020 0.019 0.013 0.017 0.012 0.014 0.018 0.028 0.022 0.016 0.016 0.019 0.020 0.020 0.017 0.020 0.013 0.042 0.016 0.030 0.020 0.007 0.028 0.018 0.021 0.014 0.015 0.013 0.013 0.019 0.012 0.023 0.014 0.019 0.014 0.017 0.018 0.027 0.021 0.026 0.034 0.027 0.021 0.020 0.012 0.018 0.010 0.019 0.018 0.021 0.020 0.016 0.017 0.017 Psidinin C 0.001 0.000 0.000 0.001 0.001 0.000 0.000 0.001 0.000 0.001 0.001 0.000 0.003 0.001 0.002 0.001 0.002 0.001 0.000 0.000 0.001 0.001 0.000 0.002 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.001 0.001 0.000 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.000 0.000 0.002 0.000 0.002 0.000 0.000 0.002 0.001 0.001 0.001 0.000 0.002 0.000 0.001 0.001 0.000 0.001 0.002 0.000 0.001 0.001 0.002 0.002 0.002 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.000 0.002 0.000 0.001 0.002 0.002 0.001 0.001 0.001 0.003 0.001 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.001 0.000 0.002 0.000 0.002 0.002 0.001 0.002 0.002 0.001 0.001 0.002 0.000 0.000 0.001 0.000 0.001 0.000 0.001 0.001 0.001 0.001 0.002 0.001 0.002 Ganglioside GM3 (d18:0/20:0) 0.007 0.007 0.008 0.006 0.006 0.005 0.006 0.007 0.006 0.005 0.005 0.005 0.007 0.006 0.007 0.006 0.005 0.006 0.004 0.005 0.004 0.003 0.005 0.007 0.006 0.007 0.006 0.007 0.007 0.004 0.007 0.005 0.003 0.006 0.005 0.006 0.008 0.006 0.005 0.005 0.006 0.007 0.006 0.006 0.006 0.007 0.006 0.007 0.007 0.006 0.004 0.009 0.005 0.007 0.006 0.006 0.006 0.005 0.007 0.007 0.005 0.005 0.006 0.007 0.004 0.005 0.005 0.008 0.006 0.007 0.005 0.006 0.006 0.008 0.006 0.006 0.006 0.007 0.006 0.007 0.006 0.006 0.006 0.006 0.006 0.006 0.005 0.006 0.007 0.008 0.008 0.007 0.005 0.004 0.007 0.007 0.008 0.006 0.005 0.007 0.009 0.006 0.007 0.007 0.004 0.004 0.006 0.006 0.004 0.005 0.008 0.007 0.007 0.004 0.006 0.007 0.006 0.005 0.005 0.006 0.007 0.006 0.004 0.006 0.008 0.007 0.010 0.005 0.006 0.005 0.005 0.006 0.004 0.006 0.007 0.006 0.004 0.006 Tetrahexosylceramide (d18:1/16:0) 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.000 0.001 0.001 0.000 0.001 0.000 0.001 0.000 0.000 0.001 0.000 0.000 0.000 0.001 0.000 0.000 0.000 0.000 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.000 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.001 0.000 0.001 0.000 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.000 0.000 0.000 0.000 0.001 0.001 0.001 0.001 0.000 0.001 0.001 Ganglioside GM3 (d18:1/24:1(15Z)) 0.005 0.005 0.005 0.002 0.003 0.001 0.001 0.001 0.003 0.003 0.002 0.000 0.005 0.002 0.002 0.003 0.003 0.004 0.003 0.002 0.002 0.002 0.003 0.005 0.003 0.002 0.003 0.002 0.001 0.001 0.000 0.001 0.000 0.003 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.003 0.002 0.001 0.003 0.003 0.001 0.002 0.003 0.003 0.002 0.004 0.002 0.002 0.002 0.004 0.003 0.002 0.002 0.003 0.002 0.001 0.002 0.001 0.003 0.002 0.004 0.003 0.003 0.002 0.004 0.003 0.003 0.002 0.004 0.001 0.002 0.001 0.003 0.003 0.003 0.002 0.002 0.003 0.002 0.001 0.003 0.003 0.004 0.003 0.002 0.002 0.003 0.004 0.003 0.003 0.004 0.004 0.004 0.003 0.003 0.004 0.001 0.003 0.003 0.003 0.003 0.002 0.002 0.003 0.005 0.001 0.003 0.002 0.004 0.003 0.003 0.003 0.003 0.002 0.005 0.004 0.005 0.003 0.003 0.002 0.004 0.002 0.002 0.002 0.003 0.003 0.002 0.003 0.003 beta-D-Glucosyl-1,4-N-acetyl-D-glucosaminyldiphosphoundecaprenol 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.002 N-(tetracosanoyl)-sphinganine-1-O-[myo-inositol-1-phosphoryl-6-D-mannopyranosyl-alpha1-2-myo-inositol-1-phosphate] 0.005 0.005 0.009 0.006 0.005 0.004 0.006 0.004 0.007 0.006 0.004 0.006 0.005 0.006 0.008 0.005 0.006 0.005 0.004 0.004 0.004 0.004 0.007 0.006 0.007 0.005 0.006 0.006 0.006 0.005 0.006 0.005 0.002 0.004 0.005 0.007 0.004 0.006 0.004 0.003 0.005 0.006 0.005 0.006 0.005 0.005 0.006 0.008 0.006 0.005 0.005 0.007 0.004 0.008 0.006 0.004 0.005 0.006 0.003 0.005 0.006 0.006 0.005 0.006 0.004 0.005 0.005 0.006 0.005 0.005 0.006 0.006 0.004 0.004 0.005 0.004 0.006 0.004 0.007 0.005 0.004 0.004 0.004 0.004 0.004 0.008 0.005 0.007 0.004 0.009 0.004 0.005 0.006 0.006 0.007 0.006 0.007 0.005 0.006 0.006 0.006 0.005 0.005 0.005 0.006 0.002 0.006 0.007 0.005 0.004 0.005 0.005 0.005 0.004 0.004 0.006 0.006 0.008 0.007 0.005 0.006 0.006 0.005 0.004 0.006 0.005 0.007 0.005 0.004 0.007 0.003 0.005 0.006 0.005 0.007 0.004 0.005 0.005 5-(3-Buten-1-ynyl)-2,2'-bithienyl 0.001 0.001 0.001 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.001 0.002 0.001 0.001 0.001 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.001 0.001 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.001 0.001 0.002 0.001 0.001 0.001 0.002 0.002 0.002 0.001 0.001 0.002 0.002 0.002 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.001 0.002 0.002 0.001 0.001 0.001 0.001 0.001 0.002 0.002 0.001 0.002 0.002 0.001 0.001 0.001 0.002 0.001 0.001 0.002 0.001 0.002 0.002 0.002 0.002 0.002 0.001 0.001 0.001 0.001 0.002 0.002 0.001 0.001 0.002 0.002 0.001 0.001 0.002 0.001 0.001 0.001 0.002 0.001 0.002 0.001 0.002 0.001 0.001 0.001 0.002 0.002 0.001 0.001 0.001 0.002 0.001 0.002 0.002 0.002 0.002 0.001 0.002 0.002 0.002 0.002 0.002 N3-(4-methoxyfumaroyl)-L-2,3-diaminopropanoate 0.033 0.017 0.038 0.041 0.097 0.022 0.026 0.029 0.029 0.044 0.070 0.050 0.056 0.086 0.085 0.047 0.092 0.049 0.032 0.126 0.037 0.126 0.032 0.045 0.036 0.033 0.052 0.035 0.120 0.101 0.056 0.047 0.274 0.102 0.350 0.209 0.054 0.113 0.102 0.087 0.184 0.040 0.044 0.073 0.025 0.023 0.035 0.067 0.032 0.038 0.034 0.099 0.060 0.090 0.070 0.090 0.074 0.158 0.151 0.126 0.061 0.082 0.106 0.100 0.126 0.178 0.063 0.040 0.055 0.088 0.072 0.137 0.073 0.066 0.049 0.054 0.102 0.088 0.091 0.049 0.073 0.070 0.042 0.236 0.067 0.071 0.207 0.337 0.139 0.213 0.126 0.027 0.023 0.025 0.033 0.028 0.033 0.026 0.022 0.026 0.029 0.058 0.063 0.033 0.024 0.016 0.027 0.064 0.053 0.023 0.132 0.035 0.064 0.089 0.030 0.032 0.126 0.110 0.074 0.113 0.061 0.042 0.038 0.025 0.056 0.104 0.059 0.051 0.043 0.050 0.068 0.042 0.114 0.029 0.031 0.050 0.222 0.043 Iodixanol 0.004 0.004 0.005 0.004 0.005 0.004 0.005 0.003 0.005 0.005 0.002 0.004 0.004 0.005 0.002 0.006 0.003 0.005 0.004 0.003 0.004 0.004 0.003 0.004 0.003 0.003 0.003 0.005 0.006 0.005 0.004 0.003 0.001 0.004 0.003 0.004 0.005 0.005 0.003 0.003 0.005 0.002 0.005 0.003 0.006 0.004 0.005 0.004 0.005 0.006 0.003 0.004 0.004 0.005 0.001 0.004 0.005 0.005 0.003 0.003 0.004 0.004 0.004 0.004 0.004 0.005 0.002 0.005 0.004 0.003 0.004 0.005 0.004 0.003 0.003 0.005 0.003 0.004 0.003 0.003 0.003 0.003 0.003 0.003 0.003 0.003 0.004 0.004 0.005 0.004 0.005 0.005 0.003 0.002 0.005 0.003 0.003 0.004 0.002 0.005 0.003 0.004 0.003 0.004 0.005 0.002 0.004 0.003 0.004 0.003 0.005 0.003 0.005 0.004 0.004 0.004 0.002 0.003 0.002 0.005 0.005 0.004 0.004 0.004 0.005 0.003 0.004 0.005 0.003 0.004 0.003 0.004 0.004 0.003 0.004 0.004 0.004 0.002 Propionylcarnitine 0.009 0.008 0.008 0.008 0.012 0.005 0.010 0.008 0.007 0.015 0.006 0.027 0.007 0.004 0.005 0.003 0.007 0.005 0.017 0.007 0.009 0.013 0.008 0.010 0.005 0.004 0.007 0.009 0.005 0.004 0.004 0.004 0.006 0.006 0.005 0.006 0.003 0.003 0.010 0.007 0.010 0.007 0.005 0.006 0.018 0.005 0.004 0.006 0.012 0.004 0.011 0.009 0.007 0.010 0.006 0.012 0.011 0.009 0.011 0.014 0.009 0.007 0.009 0.012 0.007 0.035 0.008 0.013 0.010 0.009 0.010 0.006 0.007 0.008 0.041 0.009 0.007 0.005 0.005 0.015 0.012 0.006 0.005 0.008 0.008 0.006 0.006 0.006 0.012 0.005 0.005 0.022 0.017 0.008 0.009 0.006 0.006 0.015 0.013 0.012 0.012 0.011 0.008 0.013 0.018 0.010 0.011 0.018 0.011 0.009 0.006 0.009 0.008 0.008 0.008 0.006 0.004 0.017 0.007 0.005 0.003 0.007 0.014 0.006 0.010 0.016 0.008 0.022 0.016 0.012 0.011 0.008 0.019 0.014 0.008 0.007 0.008 0.007 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name KEGG ID HMDB ID Map Creatinine C00791 HMDB00562 Lactams Deoxycytidine C00881 HMDB00014 Nucleosids, Nucleotids and Derivatives Leucyl-Proline HMDB28937 Peptides Di-2-thienyl disulfide HMDB37173 Thiophenes N(alpha)-t-Butoxycarbonyl-L-leucine C04301 Unknown Chinomethionat C14514 Unknown (2Z,4'Z)-2-(5-Methylthio-4-penten-2-ynylidene)-1,6-dioxaspiro[4.4]non-3-ene HMDB32660 Oxolanes Acetic acid C00033 HMDB00042 Carboxylic Acids and Derivatives Urea C00086 HMDB00294 Ureas Diphenylcarbazide C11232 Unknown Prolyl-Gamma-glutamate HMDB29031 Peptides Lenticin C09213 HMDB61115 Unknown 2,3-Butanediol glucoside HMDB40822 Glycosyl Compounds 5-Aminopentanoic acid C00431 HMDB03355 Amino Acids and Derivatives Glycerophosphocholine C00670 HMDB00086 Glycerophospholipids 6-Phosphonoglucono-D-lactone C01236 HMDB01127 Monosaccharides Imidazoleacetic acid riboside C05131 HMDB02331 Nucleosids, Nucleotids and Derivatives Methyl 3-hydroxybutyrate HMDB41603 Hydroxy Acids and Derivatives Diisopropyl sulfide HMDB29579 Thioethers 5,8-Dihydro-6-(4-methyl-3-pentenyl)-1,2,3,4-tetrathiocin HMDB38142 Prenol Lipids 5'-Dehydroadenosine C11500 Unknown Adenosine C00212 HMDB00050 Nucleosids, Nucleotids and Derivatives 3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid HMDB00425 Monosaccharides Di-2-propenyl hexasulfide HMDB39460 Organic Trisulfides N-(2-formyl-3-chlorophenyl)anthranilic acid HMDB60006 Benzene and Substituted Derivatives 5-(4-Acetoxy-1-butynyl)-2,2'-bithiophene C04485 HMDB34454 Thiophenes hexane-6-keto-1,3,4,6-tetracarboxylate Unknown Ranunculin C08512 Unknown 1-Pyrrolinium HMDB60246 Pyrrolines 3'-O-Methyladenosine HMDB06023 Nucleosids, Nucleotids and Derivatives Probenecid C07372 HMDB15166 Benzoic Acid and Derivatives 1,6-Naphthalenedisulfonic acid C16193 Xenobiotics Biodegradation and Metabolism Pyrrolidine HMDB31641 Pyrrolidines D-Sedoheptulose 7-phosphate C00281 HMDB01068 Disaccharides 1-Octen-3-yl glucoside HMDB32959 Alkyl Glycosides 5-Hexyltetrahydro-2-furanoctanoic acid HMDB31127 Eicosanoids 4'-Methoxy-2',3,7-trihydroxyisoflavanone HMDB41673 Flavonoids L-Cyclo(alanylglycyl) HMDB31547 Piperazines Narciclasine C08533 Unknown Pipecolic acid C00408 HMDB00070 Amino Acids and Derivatives 5-Ethoxy-4,5-dihydro-2(3H)furanone HMDB31214 Lactones Niclosamide HMDB15679 Anilides Moracin Unknown 2,2,4-Trimethyl-3-(4-fluorophenyl)-2H-1-benzopyran-7-ol acetate C15056 Unknown Creatine C00300 HMDB00064 Amino Acids and Derivatives Lysyl-Tryptophan HMDB28962 Peptides [FA hydroxy(4:0)] 1,9S,11R,15S-tetrahydroxy-13E-prostaene Fatty Acyls Prostaglandin F1a C06475 HMDB02685 Eicosanoids [PR trimethyl,methyl,methyl(5:0/15:0)] 2,6,14-trimethyl-6,7-epoxy-10-methylene-9-(3-methylpent-4-enyl)-pentadec-2-ene Prenols N-[2-(4-Chloro-phenyl)-acetyl]-N'-(4,7-dimethyl-quinazolin-2-yl)- guanidine C11562 Unknown 3-O-Caffeoyl-4-O-methylquinic acid HMDB39960 Cyclic Alcohols and Derivatives Kanzonol R HMDB41099 Flavonoids [6]-Gingerdiol 3,5-diacetate HMDB40568 Phenols and Derivatives Erucicoyl-EA Fatty Acyls Artonin K HMDB40673 Flavonoids Trihydroxy-3,6,7,4'-tetramethoxyflavone Polyketides 3-Amino-1,2,4-triazole C11261 Unknown Proline betaine C10172 HMDB04827 Pyrrolidines Piperidine C01746 HMDB34301 Piperidines hydroxymethyl-dCDP Unknown FA amino(7:0) aminoheptanoic acid Fatty Acyls Glutamine C00064 Amino Acids and Derivatives 2,3-Dimethylbenzofuran HMDB33176 Cinnamaldehydes Sorbitan stearate HMDB29888 Monosaccharides 6-Hydroxyluteolin 6-xyloside HMDB37595 Flavonoids 6-Deoxodolichosterone HMDB34332 Steroids and Steroid Derivatives Pyruvic acid C00022 HMDB00243 Keto-Acids and Derivatives Deoxyuridine triphosphate C00460 HMDB01191 Nucleosids, Nucleotids and Derivatives Camelliagenin A HMDB34528 Prenol Lipids (2alpha,3alpha,5alpha,22R,23R)-2,3,22,23-Tetrahydroxy-25-methylergost-24(28)en-6-one HMDB39443 Steroids and Steroid Derivatives LysoPE(18:0/0:0) HMDB11130 Glycerophospholipids Oxolucidine B C09891 Unknown Prenol 30,32-dihydroxy-2b-methyl-bishomohopane Prenols Lumequoylacetone HMDB35956 Carbonyl Compounds LysoPC(16:0) C04230 HMDB10382 Glycerophospholipids L-Histidine C00135 HMDB00177 Amino Acids and Derivatives Lactic acid C00186 Hydroxy Acids and Derivatives 1,2,4,8-Tetraacetoxy-7-hydroxy-3-(4-hydroxyphenyl)dibenzofuran HMDB34700 Benzofurans LysoPE(20:0/0:0) HMDB11511 Glycerophospholipids Didodecyl thiobispropanoate HMDB40172 Fatty Acids and Conjugates LysoPC(18:2(9Z,12Z)) C04230 HMDB10386 Glycerophospholipids Epoxymurin B HMDB40922 Dihydrofurans [FA amino(8:0)] 3-amino-octanoic acid Amino Acids and Derivatives LysoPC(20:5(5Z,8Z,11Z,14Z,17Z)) C04230 HMDB10397 Glycerophospholipids LysoPC(20:4(8Z,11Z,14Z,17Z)) C04230 HMDB10396 Glycerophospholipids L-Carnitine C15025 HMDB00062 Alkylamines PS(21:0/0:0) Glycerophospholipids Cer(d18:0/20:0) HMDB11764 Sphingolipids Gnidicin C09095 Unknown Uric acid C00366 HMDB00289 Imidazopyrimidines Cer(d18:1/24:1(15Z)) C00195 HMDB04953 Sphingolipids N-(2-hydroxytetracosanoyl)-4,8-sphingadienine Unknown PE(P-18:1(9Z)/14:1(9Z)) HMDB11435 Glycerophospholipids PE(P-18:1(9Z)/14:0) HMDB11434 Glycerophospholipids Hymenocardine C10004 Unknown Bruceoside A C08753 Unknown SM(d33:1) Sphingolipids Spirolide B HMDB30492 Azepines SM(d34:2) Sphingolipids SM(d18:0/16:1(9Z)) C00550 HMDB13464 Sphingolipids [ST (20:4)] cholest-5-en-3beta-yl (15S-hydroperoxy-5Z,8Z,12E,14Z-eicosatetraenoate) Sterol Lipids PE-NMe(16:0/16:0) HMDB10567 Glycerophospholipids SM(d18:0/16:0) C00550 HMDB10168 Sphingolipids TG(41:0) Glycerolipids DG(43:5) Glycerolipids Tin chloride (SnCl4) HMDB36546 Post-transition Metal Salts PG(16:0/16:0) HMDB10570 Glycerophospholipids PE(P-18:1(9Z)/18:3(6Z,9Z,12Z)) HMDB11443 Glycerophospholipids SM(d18:1/18:1(11Z)) C00550 HMDB12100 Sphingolipids PE(20:2(11Z,14Z)/15:0) C00350 HMDB09285 Glycerophospholipids PE(18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z)) C00350 HMDB09195 Glycerophospholipids PE-NMe(16:0/18:1(9Z)) HMDB10569 Glycerophospholipids PC(P-18:0/15:0) HMDB11238 Glycerophospholipids N-desmethylclarithromycin HMDB61020 Macrolides and Analogues PC(16:0/16:0) C00157 HMDB00564 Glycerophospholipids Stenopalustroside A Unknown PC(o-16:1(9Z)/18:2(9Z,12Z)) HMDB13413 Glycerophospholipids Hordatine B glucoside HMDB30460 Glycosyl Compounds PC(O-16:0/18:2(9Z,12Z)) HMDB11151 Glycerophospholipids PE(P-18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)) HMDB11453 Glycerophospholipids PE(P-18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) HMDB11452 Glycerophospholipids Arginine C00062 Amino Acids and Derivatives PC(14:1(9Z)/20:2(11Z,14Z)) C00157 HMDB07913 Glycerophospholipids PE-NMe(18:1(9Z)/18:1(9Z)) HMDB10565 Glycerophospholipids 7-methylthioheptanaldoxime C17249 Unknown carboxynorspermidine Unknown PE(22:1(13Z)/15:0) C00350 HMDB09516 Glycerophospholipids PE(15:0/22:0) C00350 HMDB08907 Glycerophospholipids PG(O-36:1) Glycerophospholipids PE(18:4(6Z,9Z,12Z,15Z)/20:2(11Z,14Z)) C00350 HMDB09198 Glycerophospholipids PE(22:5(7Z,10Z,13Z,16Z,19Z)/16:0) C00350 HMDB09649 Glycerophospholipids PC(o-16:1(9Z)/20:4(8Z,11Z,14Z,17Z)) HMDB13415 Glycerophospholipids PC(o-18:2(9Z,12Z)/18:2(9Z,12Z)) HMDB13435 Glycerophospholipids PE(18:3(6Z,9Z,12Z)/20:0) C00350 HMDB09130 Glycerophospholipids PC(o-18:1(11Z)/18:2(9Z,12Z)) HMDB13425 Glycerophospholipids Phosphatidyl glycerophosphate (O-42:2) Unknown PE-NMe2(18:1(9Z)/18:1(9Z)) HMDB10564 Organic Phosphoric Acids and Derivatives PS(35:0) Glycerophospholipids PC(14:1(9Z)/22:4(7Z,10Z,13Z,16Z)) C00157 HMDB07922 Glycerophospholipids PC(18:2(9Z,12Z)/18:2(9Z,12Z)) C00157 HMDB08138 Glycerophospholipids PC(14:1(9Z)/22:2(13Z,16Z)) C00157 HMDB07921 Glycerophospholipids PC(18:1(9Z)/18:1(9Z)) C00157 HMDB00593 Glycerophospholipids PE(24:1(15Z)/15:0) C00350 HMDB09747 Glycerophospholipids PC(o-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) HMDB13409 Glycerophospholipids 1-18:2-2-18:3-monogalactosyldiacylglycerol Unknown PC(o-18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) HMDB13432 Glycerophospholipids PC(o-18:0/20:4(8Z,11Z,14Z,17Z)) HMDB13420 Glycerophospholipids Glucose Monosaccharides PE(18:3(6Z,9Z,12Z)/22:0) C00350 HMDB09138 Glycerophospholipids N-(2-hydroxy-tetracosanoyl)-1-beta-glucosyl-4E,6E-hexadecasphingadienine Sphingolipids Luteolin 7,4'-diglucuronide-3'-glucoside Polyketides PC(18:4(6Z,9Z,12Z,15Z)/20:4(8Z,11Z,14Z,17Z)) C00157 HMDB08247 Glycerophospholipids PS(37:2) Glycerophospholipids PC(18:3(6Z,9Z,12Z)/20:3(8Z,11Z,14Z)) C00157 HMDB08179 Glycerophospholipids PC(20:3(8Z,11Z,14Z)/18:2(9Z,12Z)) C00157 HMDB08402 Glycerophospholipids PC(18:2(9Z,12Z)/20:2(11Z,14Z)) C00157 HMDB08145 Glycerophospholipids PC(22:2(13Z,16Z)/16:1(9Z)) C00157 HMDB08594 Glycerophospholipids PC(18:1(9Z)/20:1(11Z)) C00157 HMDB08110 Glycerophospholipids PC(P-18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) HMDB11295 Glycerophospholipids PC(P-18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) HMDB11294 Glycerophospholipids PS(P-39:0) Glycerophospholipids Glycerophosphocholine (38:6) Glycerophospholipids PI(O-20:0/14:1(9Z)) Glycerophospholipids PS(39:4) Glycerophospholipids Succinic acid semialdehyde C00232 HMDB01259 Fatty Acids and Conjugates Glycerophosphocholine (40:6) Glycerophospholipids PI(16:1(9Z)/18:1(11Z)) C00626 HMDB09800 Glycerophospholipids PC(20:3(8Z,11Z,14Z)/20:2(11Z,14Z)) C00157 HMDB08407 Glycerophospholipids PC(20:3(8Z,11Z,14Z)/20:1(11Z)) HMDB11201 Glycerophospholipids PI(O-36:2) Glycerophospholipids PG(42:6) Glycerophospholipids PS(41:4) Glycerophospholipids Propanoylagmatine C02581 Unknown PS(41:2) Glycerophospholipids N(6)-Trimethyl-L-lysine Amino Acids and Derivatives PI (36:0) Glycerophospholipids PI(18:2(9Z,12Z)/20:1(11Z)) C00626 HMDB09852 Glycerophospholipids Isocitric acid C00311 HMDB00193 Carboxylic Acids and Derivatives Phosphocreatinine HMDB41624 Organic Phosphoric Acids and Derivatives Tartronate semialdehyde C01146 HMDB06938 Hydroxy Acids and Derivatives TG(15:0/20:0/20:0) HMDB43079 Glycerolipids 4-Hydroxybutyric acid C00989 HMDB00710 Hydroxy Acids and Derivatives Xanthine-8-carboxylate C03314 Unknown Glycerophosphoinositol (41:6) Glycerophospholipids Glyceric acid C00258 HMDB00139 Sugar Acids and Derivatives 2-Hydroxyundecanoate HMDB59736 Hydroxy Acids and Derivatives cis-(homo)2aconitate Metabolism of Cofactors and Vitamins N3-fumaramoyl-L-2,3-diaminopropanoate Unknown Dimethylarginine Unknown L-Acetylcarnitine C02571 HMDB00201 Fatty Acid Esters Epimedin K Polyketides Triradylglycero (60:5) Glycerolipids Triradylglycerol (61:8) Glycerolipids CDP-DG(16:0/20:4(5Z,8Z,11Z,14Z)) HMDB06973 Glycerophospholipids CDP-Glycerophospholipid (18:1(9Z)/18:2(9Z,12Z)) Glycerophospholipids Glycerophosphocholine (52:4) Glycerophospholipids CDP-Glycerophospholipid (38:6) Glycerophospholipids CDP-Glycerophospholipid (38:5) Glycerophospholipids CDP-Glycerophospholipid (38:4) Glycerophospholipids Dehydrotomatine HMDB32002 Prenol Lipids Triradylglycerol (65:6) Glycerolipids Galactaric acid C00879 HMDB00639 Sugar Acids and Derivatives Sedoheptulose C02076 HMDB03219 Monosaccharides Kaempferol 3-rhamnosyl-(1->2)-[glucosyl-(1->3)-(4'''-p-coumaroylrhamnosyl)-(1->6)-galactoside] Polyketides CDP-Glycerophospholipid(40:6) Glycerophospholipids Glycerophosphoserine (55:0) Glycerophospholipids Beta-1,4-D-Mannosylchitobiosyldiphosphodolichol C05860 HMDB11673 Prenol Lipids Phosphocreatine C02305 HMDB01511 Amino Acids and Derivatives UDP-N-acetylmuramoyl-L-Ala-D-gamma-Glu-6-carboxy-L-Lys-D-Ala C04804 Unknown N-(2-hydroxyhexacosanoyl)-eicosasphinganine-1-O-[D-mannopyranosyl-alpha1-2-myo-inositol-1-phosphate] Sphingolipids Trihexosylceramide (d18:1/24:0) C04737 HMDB04886 Sphingolipids Iodipamide HMDB15581 Peptides N-(2-hydroxyhexacosanoyl)-4R-hydroxyeicosasphinganine-1-O-[D-mannopyranosyl-alpha1-2-myo-inositol-1-phosphate] Sphingolipids 3S-hydroxyhexacosanoyl-CoA Fatty Acyls Psidinin C HMDB39628 Complex Tannins Ganglioside GM3 (d18:0/20:0) HMDB11919 Sphingolipids Tetrahexosylceramide (d18:1/16:0) C03272 HMDB04960 Sphingolipids Ganglioside GM3 (d18:1/24:1(15Z)) C04730 HMDB04848 Sphingolipids beta-D-Glucosyl-1,4-N-acetyl-D-glucosaminyldiphosphoundecaprenol C04830 Unknown N-(tetracosanoyl)-sphinganine-1-O-[myo-inositol-1-phosphoryl-6-D-mannopyranosyl-alpha1-2-myo-inositol-1-phosphate] Sphingolipids 5-(3-Buten-1-ynyl)-2,2'-bithienyl C08397 Unknown N3-(4-methoxyfumaroyl)-L-2,3-diaminopropanoate Unknown Iodixanol HMDB15379 Anilides Propionylcarnitine C03017 HMDB00824 Fatty Acid Esters METABOLITES_END #END