#METABOLOMICS WORKBENCH westcoastmetabolomics_20240626_114719 DATATRACK_ID:4957 STUDY_ID:ST003293 ANALYSIS_ID:AN005393 PROJECT_ID:PR002045
VERSION 1
CREATED_ON July 4, 2024, 11:49 am
#PROJECT
PR:PROJECT_TITLE High Fat Feeding Alters Circulating Triglyceride Profile by Decreasing SCD
PR:PROJECT_TITLE Activity and Depleting omega-3 Fatty Acids
PR:PROJECT_SUMMARY The study was to examine, in control and high-fat-fed rats, the effects of acute
PR:PROJECT_SUMMARY feeding (a single meal) on circulating lipid profiles. Acute feeding is expected
PR:PROJECT_SUMMARY to impact circulating lipid profiles due to lipids in chylomicron derived from
PR:PROJECT_SUMMARY the diet, and the acute feeding response may be altered with a HFD to account
PR:PROJECT_SUMMARY for some of the chronic effects of a HFD. The study was to examine the effects
PR:PROJECT_SUMMARY of a high fat diet (HFD) on circulating TG profiles in rats and test the
PR:PROJECT_SUMMARY hypothesis that a HFD reduces TGs composed of long-chain PUFAs, as previously
PR:PROJECT_SUMMARY seen in rats maintained on a HNaLK diet. Thus, we performed lipidomics analysis
PR:PROJECT_SUMMARY on plasma samples collected both in the pre- and postprandial states in the
PR:PROJECT_SUMMARY control and HFD groups. Lipidomics analysis was combined with general
PR:PROJECT_SUMMARY metabolomics analysis, which provides measurements of saturated FFAs and other
PR:PROJECT_SUMMARY metabolic indicators such as glycerol (as lipolysis indicator) or
PR:PROJECT_SUMMARY 3-hydroxybutyrate (ketosis indicator), not measured in our LC-MS-based
PR:PROJECT_SUMMARY lipidomics assay. The results provided novel insights into the differential
PR:PROJECT_SUMMARY behaviors of individual TGs and identified specific changes (i.e., decreased
PR:PROJECT_SUMMARY stearoyl-CoA desaturase [SCD] activity and depletion of omega-3 FFAs) associated
PR:PROJECT_SUMMARY with short-term high-fat feeding.
PR:INSTITUTE University of Southern California
PR:DEPARTMENT Keck School of Medicine USC
PR:LAST_NAME Youn
PR:FIRST_NAME Jang-Hyun
PR:ADDRESS CSC 214, 2250 Alcazar Street, Health Sciences Campus, Los Angeles CA 90033
PR:EMAIL youn@usc.edu
PR:PHONE 5307528129
#STUDY
ST:STUDY_TITLE High Fat Feeding Alters Circulating Triglyceride Profile by Decreasing SCD
ST:STUDY_TITLE Activity and Depleting omega-3 Fatty Acids
ST:STUDY_SUMMARY The study was to examine, in control and high-fat-fed rats, the effects of acute
ST:STUDY_SUMMARY feeding (a single meal) on circulating lipid profiles. Acute feeding is expected
ST:STUDY_SUMMARY to impact circulating lipid profiles due to lipids in chylomicron derived from
ST:STUDY_SUMMARY the diet, and the acute feeding response may be altered with a HFD to account
ST:STUDY_SUMMARY for some of the chronic effects of a HFD. The study was to examine the effects
ST:STUDY_SUMMARY of a high fat diet (HFD) on circulating TG profiles in rats and test the
ST:STUDY_SUMMARY hypothesis that a HFD reduces TGs composed of long-chain PUFAs, as previously
ST:STUDY_SUMMARY seen in rats maintained on a HNaLK diet. Thus, we performed lipidomics analysis
ST:STUDY_SUMMARY on plasma samples collected both in the pre- and postprandial states in the
ST:STUDY_SUMMARY control and HFD groups. Lipidomics analysis was combined with general
ST:STUDY_SUMMARY metabolomics analysis, which provides measurements of saturated FFAs and other
ST:STUDY_SUMMARY metabolic indicators such as glycerol (as lipolysis indicator) or
ST:STUDY_SUMMARY 3-hydroxybutyrate (ketosis indicator), not measured in our LC-MS-based
ST:STUDY_SUMMARY lipidomics assay. The results provided novel insights into the differential
ST:STUDY_SUMMARY behaviors of individual TGs and identified specific changes (i.e., decreased
ST:STUDY_SUMMARY stearoyl-CoA desaturase [SCD] activity and depletion of omega-3 FFAs) associated
ST:STUDY_SUMMARY with short-term high-fat feeding.
ST:INSTITUTE University of Southern California
ST:DEPARTMENT Keck School of Medicine USC
ST:LAST_NAME Youn
ST:FIRST_NAME Jang-Hyun
ST:ADDRESS CSC 214, 2250 Alcazar Street, Health Sciences Campus, Los Angeles CA 90033
ST:EMAIL youn@usc.edu
ST:PHONE 5307528129
#SUBJECT
SU:SUBJECT_TYPE Mammal
SU:SUBJECT_SPECIES Rattus norvegicus
SU:TAXONOMY_ID 10116
#SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data
SUBJECT_SAMPLE_FACTORS - 1373 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn011_MX725215_posLIPIDS_1373--P-033.raw; RAW_FILE_NAME(File ID neg)=Youn011_MX725215_negLIPIDS_1373--P-033.raw
SUBJECT_SAMPLE_FACTORS - 1378 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn066_MX725215_posLIPIDS_1378--P-038.raw; RAW_FILE_NAME(File ID neg)=Youn066_MX725215_negLIPIDS_1378--P-038.raw
SUBJECT_SAMPLE_FACTORS - 1381 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn048_MX725215_posLIPIDS_1381--P-041.raw; RAW_FILE_NAME(File ID neg)=Youn048_MX725215_negLIPIDS_1381--P-041.raw
SUBJECT_SAMPLE_FACTORS - 1386 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn027_MX725215_posLIPIDS_1386--P-046.raw; RAW_FILE_NAME(File ID neg)=Youn027_MX725215_negLIPIDS_1386--P-046.raw
SUBJECT_SAMPLE_FACTORS - 1389 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn024_MX725215_posLIPIDS_1389--P-049.raw; RAW_FILE_NAME(File ID neg)=Youn024_MX725215_negLIPIDS_1389--P-049.raw
SUBJECT_SAMPLE_FACTORS - 1394 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn031_MX725215_posLIPIDS_1394--P-054.raw; RAW_FILE_NAME(File ID neg)=Youn031_MX725215_negLIPIDS_1394--P-054.raw
SUBJECT_SAMPLE_FACTORS - 1397 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn002_MX725215_posLIPIDS_1397--P-057.raw; RAW_FILE_NAME(File ID neg)=Youn002_MX725215_negLIPIDS_1397--P-057.raw
SUBJECT_SAMPLE_FACTORS - 1402 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn045_MX725215_posLIPIDS_1402--P-062.raw; RAW_FILE_NAME(File ID neg)=Youn045_MX725215_negLIPIDS_1402--P-062.raw
SUBJECT_SAMPLE_FACTORS - 1405 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn010_MX725215_posLIPIDS_1405--P-065.raw; RAW_FILE_NAME(File ID neg)=Youn010_MX725215_negLIPIDS_1405--P-065.raw
SUBJECT_SAMPLE_FACTORS - 1410 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn023_MX725215_posLIPIDS_1410--P-070.raw; RAW_FILE_NAME(File ID neg)=Youn023_MX725215_negLIPIDS_1410--P-070.raw
SUBJECT_SAMPLE_FACTORS - 1375 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn042_MX725215_posLIPIDS_1375--P-035.raw; RAW_FILE_NAME(File ID neg)=Youn042_MX725215_negLIPIDS_1375--P-035.raw
SUBJECT_SAMPLE_FACTORS - 1380 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn015_MX725215_posLIPIDS_1380--P-040.raw; RAW_FILE_NAME(File ID neg)=Youn015_MX725215_negLIPIDS_1380--P-040.raw
SUBJECT_SAMPLE_FACTORS - 1383 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn052_MX725215_posLIPIDS_1383--P-043.raw; RAW_FILE_NAME(File ID neg)=Youn052_MX725215_negLIPIDS_1383--P-043.raw
SUBJECT_SAMPLE_FACTORS - 1388 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn028_MX725215_posLIPIDS_1388--P-048.raw; RAW_FILE_NAME(File ID neg)=Youn028_MX725215_negLIPIDS_1388--P-048.raw
SUBJECT_SAMPLE_FACTORS - 1391 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn034_MX725215_posLIPIDS_1391--P-051.raw; RAW_FILE_NAME(File ID neg)=Youn034_MX725215_negLIPIDS_1391--P-051.raw
SUBJECT_SAMPLE_FACTORS - 1396 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn006_MX725215_posLIPIDS_1396--P-056.raw; RAW_FILE_NAME(File ID neg)=Youn006_MX725215_negLIPIDS_1396--P-056.raw
SUBJECT_SAMPLE_FACTORS - 1399 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn003_MX725215_posLIPIDS_1399--P-059.raw; RAW_FILE_NAME(File ID neg)=Youn003_MX725215_negLIPIDS_1399--P-059.raw
SUBJECT_SAMPLE_FACTORS - 1404 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn058_MX725215_posLIPIDS_1404--P-064.raw; RAW_FILE_NAME(File ID neg)=Youn058_MX725215_negLIPIDS_1404--P-064.raw
SUBJECT_SAMPLE_FACTORS - 1407 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn019_MX725215_posLIPIDS_1407--P-067.raw; RAW_FILE_NAME(File ID neg)=Youn019_MX725215_negLIPIDS_1407--P-067.raw
SUBJECT_SAMPLE_FACTORS - 1412 P Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn070_MX725215_posLIPIDS_1412--P-072.raw; RAW_FILE_NAME(File ID neg)=Youn070_MX725215_negLIPIDS_1412--P-072.raw
SUBJECT_SAMPLE_FACTORS - 1374 P Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn059_MX725215_posLIPIDS_1374--P-034.raw; RAW_FILE_NAME(File ID neg)=Youn059_MX725215_negLIPIDS_1374--P-034.raw
SUBJECT_SAMPLE_FACTORS - 1377 P Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn067_MX725215_posLIPIDS_1377--P-037.raw; RAW_FILE_NAME(File ID neg)=Youn067_MX725215_negLIPIDS_1377--P-037.raw
SUBJECT_SAMPLE_FACTORS - 1382 P Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn062_MX725215_posLIPIDS_1382--P-042.raw; RAW_FILE_NAME(File ID neg)=Youn062_MX725215_negLIPIDS_1382--P-042.raw
SUBJECT_SAMPLE_FACTORS - 1385 P Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn032_MX725215_posLIPIDS_1385--P-045.raw; RAW_FILE_NAME(File ID neg)=Youn032_MX725215_negLIPIDS_1385--P-045.raw
SUBJECT_SAMPLE_FACTORS - 1390 P Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn065_MX725215_posLIPIDS_1390--P-050.raw; RAW_FILE_NAME(File ID neg)=Youn065_MX725215_negLIPIDS_1390--P-050.raw
SUBJECT_SAMPLE_FACTORS - 1393 P Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn029_MX725215_posLIPIDS_1393--P-053.raw; RAW_FILE_NAME(File ID neg)=Youn029_MX725215_negLIPIDS_1393--P-053.raw
SUBJECT_SAMPLE_FACTORS - 1398 P Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn039_MX725215_posLIPIDS_1398--P-058.raw; RAW_FILE_NAME(File ID neg)=Youn039_MX725215_negLIPIDS_1398--P-058.raw
SUBJECT_SAMPLE_FACTORS - 1401 P Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn055_MX725215_posLIPIDS_1401--P-061.raw; RAW_FILE_NAME(File ID neg)=Youn055_MX725215_negLIPIDS_1401--P-061.raw
SUBJECT_SAMPLE_FACTORS - 1406 P Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn001_MX725215_posLIPIDS_1406--P-066.raw; RAW_FILE_NAME(File ID neg)=Youn001_MX725215_negLIPIDS_1406--P-066.raw
SUBJECT_SAMPLE_FACTORS - 1409 P Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM RAW_FILE_NAME(File ID pos)=Youn021_MX725215_posLIPIDS_1409--P-069.raw; RAW_FILE_NAME(File ID neg)=Youn021_MX725215_negLIPIDS_1409--P-069.raw
SUBJECT_SAMPLE_FACTORS - 1376 P Sample source:Plasma | Treatment:HFD | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn072_MX725215_posLIPIDS_1376--P-036.raw; RAW_FILE_NAME(File ID neg)=Youn072_MX725215_negLIPIDS_1376--P-036.raw
SUBJECT_SAMPLE_FACTORS - 1379 P Sample source:Plasma | Treatment:HFD | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn007_MX725215_posLIPIDS_1379--P-039.raw; RAW_FILE_NAME(File ID neg)=Youn007_MX725215_negLIPIDS_1379--P-039.raw
SUBJECT_SAMPLE_FACTORS - 1384 P Sample source:Plasma | Treatment:HFD | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn009_MX725215_posLIPIDS_1384--P-044.raw; RAW_FILE_NAME(File ID neg)=Youn009_MX725215_negLIPIDS_1384--P-044.raw
SUBJECT_SAMPLE_FACTORS - 1387 P Sample source:Plasma | Treatment:HFD | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn020_MX725215_posLIPIDS_1387--P-047.raw; RAW_FILE_NAME(File ID neg)=Youn020_MX725215_negLIPIDS_1387--P-047.raw
SUBJECT_SAMPLE_FACTORS - 1392 P Sample source:Plasma | Treatment:HFD | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn060_MX725215_posLIPIDS_1392--P-052.raw; RAW_FILE_NAME(File ID neg)=Youn060_MX725215_negLIPIDS_1392--P-052.raw
SUBJECT_SAMPLE_FACTORS - 1395 P Sample source:Plasma | Treatment:HFD | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn026_MX725215_posLIPIDS_1395--P-055.raw; RAW_FILE_NAME(File ID neg)=Youn026_MX725215_negLIPIDS_1395--P-055.raw
SUBJECT_SAMPLE_FACTORS - 1400 P Sample source:Plasma | Treatment:HFD | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn053_MX725215_posLIPIDS_1400--P-060.raw; RAW_FILE_NAME(File ID neg)=Youn053_MX725215_negLIPIDS_1400--P-060.raw
SUBJECT_SAMPLE_FACTORS - 1403 P Sample source:Plasma | Treatment:HFD | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn063_MX725215_posLIPIDS_1403--P-063.raw; RAW_FILE_NAME(File ID neg)=Youn063_MX725215_negLIPIDS_1403--P-063.raw
SUBJECT_SAMPLE_FACTORS - 1408 P Sample source:Plasma | Treatment:HFD | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn008_MX725215_posLIPIDS_1408--P-068.raw; RAW_FILE_NAME(File ID neg)=Youn008_MX725215_negLIPIDS_1408--P-068.raw
SUBJECT_SAMPLE_FACTORS - 1411 P Sample source:Plasma | Treatment:HFD | sub treatment:AfterM RAW_FILE_NAME(File ID pos)=Youn025_MX725215_posLIPIDS_1411--P-071.raw; RAW_FILE_NAME(File ID neg)=Youn025_MX725215_negLIPIDS_1411--P-071.raw
SUBJECT_SAMPLE_FACTORS - PoolQC001 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 RAW_FILE_NAME(File ID pos)=PoolQC001_MX725215_posLIPIDS_preYoun001.raw; RAW_FILE_NAME(File ID neg)=PoolQC001_MX725215_negLIPIDS_preYoun001.raw
SUBJECT_SAMPLE_FACTORS - PoolQC002 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 RAW_FILE_NAME(File ID pos)=PoolQC002_MX725215_posLIPIDS_negtYoun010.raw; RAW_FILE_NAME(File ID neg)=PoolQC002_MX725215_negLIPIDS_negtYoun010.raw
SUBJECT_SAMPLE_FACTORS - PoolQC003 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 RAW_FILE_NAME(File ID pos)=PoolQC003_MX725215_posLIPIDS_negtYoun020.raw; RAW_FILE_NAME(File ID neg)=PoolQC003_MX725215_negLIPIDS_negtYoun020.raw
SUBJECT_SAMPLE_FACTORS - PoolQC004 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 RAW_FILE_NAME(File ID pos)=PoolQC004_MX725215_posLIPIDS_negtYoun030.raw; RAW_FILE_NAME(File ID neg)=PoolQC004_MX725215_negLIPIDS_negtYoun030.raw
SUBJECT_SAMPLE_FACTORS - PoolQC005 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 RAW_FILE_NAME(File ID pos)=PoolQC005_MX725215_posLIPIDS_negtYoun040.raw; RAW_FILE_NAME(File ID neg)=PoolQC005_MX725215_negLIPIDS_negtYoun040.raw
SUBJECT_SAMPLE_FACTORS - PoolQC006 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 RAW_FILE_NAME(File ID pos)=PoolQC006_MX725215_posLIPIDS_negtYoun050.raw; RAW_FILE_NAME(File ID neg)=PoolQC006_MX725215_negLIPIDS_negtYoun050.raw
SUBJECT_SAMPLE_FACTORS - PoolQC007 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 RAW_FILE_NAME(File ID pos)=PoolQC007_MX725215_posLIPIDS_negtYoun060.raw; RAW_FILE_NAME(File ID neg)=PoolQC007_MX725215_negLIPIDS_negtYoun060.raw
SUBJECT_SAMPLE_FACTORS - PoolQC008 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 RAW_FILE_NAME(File ID pos)=PoolQC008_MX725215_posLIPIDS_negtYoun070.raw; RAW_FILE_NAME(File ID neg)=PoolQC008_MX725215_negLIPIDS_negtYoun070.raw
SUBJECT_SAMPLE_FACTORS - PoolQC009 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 RAW_FILE_NAME(File ID pos)=PoolQC009_MX725215_posLIPIDS_negtYoun072.raw; RAW_FILE_NAME(File ID neg)=PoolQC009_MX725215_negLIPIDS_negtYoun072.raw
SUBJECT_SAMPLE_FACTORS - MtdBlank001 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 RAW_FILE_NAME(File ID pos)=MtdBlank001_MX725215_posLIPIDS_preYoun001.raw; RAW_FILE_NAME(File ID neg)=MtdBlank001_MX725215_negLIPIDS_preYoun001.raw
SUBJECT_SAMPLE_FACTORS - MtdBlank002 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 RAW_FILE_NAME(File ID pos)=MtdBlank002_MX725215_posLIPIDS_negtYoun010.raw; RAW_FILE_NAME(File ID neg)=MtdBlank002_MX725215_negLIPIDS_negtYoun010.raw
SUBJECT_SAMPLE_FACTORS - MtdBlank003 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 RAW_FILE_NAME(File ID pos)=MtdBlank003_MX725215_posLIPIDS_negtYoun020.raw; RAW_FILE_NAME(File ID neg)=MtdBlank003_MX725215_negLIPIDS_negtYoun020.raw
SUBJECT_SAMPLE_FACTORS - MtdBlank004 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 RAW_FILE_NAME(File ID pos)=MtdBlank004_MX725215_posLIPIDS_negtYoun030.raw; RAW_FILE_NAME(File ID neg)=MtdBlank004_MX725215_negLIPIDS_negtYoun030.raw
SUBJECT_SAMPLE_FACTORS - MtdBlank005 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 RAW_FILE_NAME(File ID pos)=MtdBlank005_MX725215_posLIPIDS_negtYoun040.raw; RAW_FILE_NAME(File ID neg)=MtdBlank005_MX725215_negLIPIDS_negtYoun040.raw
SUBJECT_SAMPLE_FACTORS - MtdBlank006 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 RAW_FILE_NAME(File ID pos)=MtdBlank006_MX725215_posLIPIDS_negtYoun050.raw; RAW_FILE_NAME(File ID neg)=MtdBlank006_MX725215_negLIPIDS_negtYoun050.raw
SUBJECT_SAMPLE_FACTORS - MtdBlank007 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 RAW_FILE_NAME(File ID pos)=MtdBlank007_MX725215_posLIPIDS_negtYoun060.raw; RAW_FILE_NAME(File ID neg)=MtdBlank007_MX725215_negLIPIDS_negtYoun060.raw
SUBJECT_SAMPLE_FACTORS - MtdBlank008 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 RAW_FILE_NAME(File ID pos)=MtdBlank008_MX725215_posLIPIDS_negtYoun070.raw; RAW_FILE_NAME(File ID neg)=MtdBlank008_MX725215_negLIPIDS_negtYoun070.raw
SUBJECT_SAMPLE_FACTORS - MtdBlank009 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 RAW_FILE_NAME(File ID pos)=MtdBlank009_MX725215_posLIPIDS_negtYoun072.raw; RAW_FILE_NAME(File ID neg)=MtdBlank009_MX725215_negLIPIDS_negtYoun072.raw
#COLLECTION
CO:COLLECTION_SUMMARY blood samples were collected through cardiac puncture. Blood samples were
CO:COLLECTION_SUMMARY rapidly spun, and plasmas were isolated and stored at -80°C until analysis
CO:SAMPLE_TYPE Blood (plasma)
#TREATMENT
TR:TREATMENT_SUMMARY control low fat diet (LFD) before meal, control low fat diet after meal, high
TR:TREATMENT_SUMMARY fat diet (HDF) before meal, high fat diet after meal
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY SOP blood-lipidomics-02272019, Matyash extraction and the organic layer was
SP:SAMPLEPREP_SUMMARY dried, reconstituted, and injected
SP:SAMPLEPREP_PROTOCOL_FILENAME SOP_blood-lipidomics-02272019.pdf
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE Reversed phase
CH:INSTRUMENT_NAME Agilent 1290
CH:COLUMN_NAME Waters ACQUITY UPLC BEH C18 (50 x 2.1mm,1.7um)
CH:SOLVENT_A 60% acetonitrile/40% water; 10 mM Ammonium Acetate
CH:SOLVENT_B 90% Isopropyl alcohol/10% acetonitrile; 10 mM Ammonium Acetate
CH:FLOW_GRADIENT 0 min 15% B, 0–0.75 min 30% B, 0.75-0.98 min 48% B, 0.98-4.00 min 82% B,
CH:FLOW_GRADIENT 4.00-4.13 min 99% B, 4.13-4.50 min 99% B, 4.50-4.58 min 15% B, 4.58-5.50 min 15%
CH:FLOW_GRADIENT B
CH:FLOW_RATE 0.8 mL/min
CH:COLUMN_TEMPERATURE 65
#ANALYSIS
AN:ANALYSIS_TYPE MS
#MS
MS:INSTRUMENT_NAME Thermo Q Exactive Orbitrap
MS:INSTRUMENT_TYPE Orbitrap
MS:MS_TYPE ESI
MS:ION_MODE NEGATIVE
MS:MS_COMMENTS The quadrupole/time-of-flight (QTOF) mass spectrometers are operated with
MS:MS_COMMENTS electrospray ionization (ESI) performing full scan in the mass range m/z
MS:MS_COMMENTS 65–1700. Equipped with a dual JetStream Source. modes producing both unique
MS:MS_COMMENTS and complementary spectra. Instrument parameters are as follows (positive mode)
MS:MS_COMMENTS Gas Temp 320°C, Gas Flow 8 l/min, Nebulizer 35 psi, Sheath Gas 350°C, Sheath
MS:MS_COMMENTS Gas Flow 11, Capillary Voltage 3500 V, Nozzle Voltage 1000V, Fragmentor 175V,
MS:MS_COMMENTS Skimmer 65V. Data (both profile and centroid) are collected at a rate of 5 scans
MS:MS_COMMENTS per second. In negative ion mode, Gas Temp 360°C, Gas Flow 9 l/min, Fragmentor
MS:MS_COMMENTS 120V, with the other parameters identical to positive ion mode. A reference
MS:MS_COMMENTS solution generating ions of 121.050 and 922.007 m/z in positive mode and 119.036
MS:MS_COMMENTS and 966.0007 m/z in negative mode, and these are used for continuous mass
MS:MS_COMMENTS correction.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS Peak height
MS_METABOLITE_DATA_START
Samples 1373 P 1378 P 1381 P 1386 P 1389 P 1394 P 1397 P 1402 P 1405 P 1410 P 1375 P 1380 P 1383 P 1388 P 1391 P 1396 P 1399 P 1404 P 1407 P 1412 P 1374 P 1377 P 1382 P 1385 P 1390 P 1393 P 1398 P 1401 P 1406 P 1409 P 1376 P 1379 P 1384 P 1387 P 1392 P 1395 P 1400 P 1403 P 1408 P 1411 P PoolQC001 PoolQC002 PoolQC003 PoolQC004 PoolQC005 PoolQC006 PoolQC007 PoolQC008 PoolQC009 MtdBlank001 MtdBlank002 MtdBlank003 MtdBlank004 MtdBlank005 MtdBlank006 MtdBlank007 MtdBlank008 MtdBlank009
Factors Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:BeforeM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM Sample source:Plasma | Treatment:CtrlDiet | sub treatment:AfterM Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM Sample source:Plasma | Treatment:HFD | sub treatment:BeforeM Sample source:Plasma | Treatment:HFD | sub treatment:AfterM Sample source:Plasma | Treatment:HFD | sub treatment:AfterM Sample source:Plasma | Treatment:HFD | sub treatment:AfterM Sample source:Plasma | Treatment:HFD | sub treatment:AfterM Sample source:Plasma | Treatment:HFD | sub treatment:AfterM Sample source:Plasma | Treatment:HFD | sub treatment:AfterM Sample source:Plasma | Treatment:HFD | sub treatment:AfterM Sample source:Plasma | Treatment:HFD | sub treatment:AfterM Sample source:Plasma | Treatment:HFD | sub treatment:AfterM Sample source:Plasma | Treatment:HFD | sub treatment:AfterM Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 Sample source:Plasma | Treatment:QC1 | sub treatment:QC1 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2 Sample source:QC2 | Treatment:QC2 | sub treatment:QC2
13-HODE 304455 157603 307954 303948 144640 255942 294242 238020 278672 253591 413354 237873 67436 52101 155984 324617 312510 351051 126523 60554 239673 189119 290571 111202 155120 160716 154694 167328 420591 285252 258689 217098 443327 291975 253140 348588 279581 334853 286163 266396 261589 239418 230811 191026 159168 811803 209623 181373 195184 61487 84143 110389 160895 58039 15017 74083 70959 61444
13-KODE 115805 96237 133339 118525 107604 119329 159450 156014 112870 105767 186119 189810 19616 23855 67116 108581 178257 164944 68719 10252 101654 70716 143003 48979 85216 47629 46045 70567 145558 136911 68565 60206 137893 126300 98651 112383 129281 93793 63386 51308 106487 96325 77595 85939 87853 178810 89159 103662 77060 11419 32123 57418 75564 43202 18145 30360 48860 37170
15-oxo-5Z,8Z,11Z,13E-eicosatetraenoic acid 42393 149538 17683 103475 93420 66159 72544 71090 31548 198838 81561 29920 63635 73930 83137 98457 41446 64415 54813 80586 103755 69727 59129 66928 103310 132537 86820 20231 112924 118405 54915 49427 83611 49028 189083 157930 135773 66141 49705 72836 48409 43887 39583 42884 39870 44124 38726 53307 51798 na na na na na na na 2377 na
15-PAHSA 7905 6740 15201 14799 4846 10870 10992 16067 19649 1844 42454 na na na 10255 14849 17890 30081 na na 26938 6849 20981 na 7916 11927 10365 na 44526 10805 25431 na 23539 23984 14465 20203 8331 21044 16851 6429 13260 7139 5123 9631 6460 5552 26747 11178 14539 na na na na na na na na 3176
2-OAHSA 498173 493694 670974 1189633 190640 771623 741120 913427 627707 499211 2556088 12946 12437 na 270781 571032 255074 1060057 104782 na 1578071 526638 799097 73887 395489 211385 382451 283685 1175610 746893 1547014 261979 697419 861130 560280 985402 461406 1387288 548940 570643 316913 321667 265842 322073 314586 387010 411248 368345 343200 na na na na na na 2712 na na
3-hydroxymyristic acid 32475 21125 41140 45277 10348 25409 32468 35676 24739 25874 34732 14726 6414 4893 20801 25657 9544 30298 16976 41447 23791 15999 38337 7157 28010 na 14761 11756 42169 32468 30180 11448 26815 17740 16272 13505 8055 20627 23166 13728 36706 24807 14273 19634 15862 17612 20421 24103 19235 5210 16151 4203 8932 6576 na 16013 10840 4992
4-Hydroxy-5E,7Z,10Z,13Z,16Z,19Z-docosahexaenoic acid na 10151 na 7183 na 6128 na na 3272 na 2032 na na na na na na na na na na na na na na na na na na na na na na na na na na na na na na 5711 na na na 2451 na 6676 na na na na na na na na na na
5-hydroxy-6E,8Z,11Z,14Z-eicosatetraenoic acid 13740 37509 18428 46034 6091 29746 382592 53953 42642 29286 13667 4349 6549 na 4465 13255 5103 22021 22369 4843 20792 12549 18053 na 13303 4626 3124 7104 63424 22430 4735 11727 4543 16855 17309 8058 5918 8589 15398 14075 31322 28659 7955 25504 18641 8506 26098 19069 18465 na na na na 15387 na na na na
8,15-DiHETE 3093 33088 1986 14086 18973 13762 85102 17387 10967 45280 3947 5655 49284 18622 15283 28558 4763 8728 10512 19076 21272 6959 19296 8867 4803 10875 17131 8626 20234 28592 3562 4415 65355 6877 19338 34843 34192 5453 na 12629 8244 3551 5472 16726 7397 10878 9659 15250 5753 3161 na na na na na 1862 2915 na
Cer [NS] d34:1 416979 510468 328734 751511 353488 931006 363750 764475 767425 379309 889385 421247 670601 828315 1144062 575322 932737 648951 742089 559293 530030 551579 410224 305088 390071 482339 526487 355833 631060 481098 506219 484827 747604 925864 835729 669389 1081626 594474 825029 492630 482799 534770 480933 560846 522265 579986 571685 515091 534796 na 4877 6843 na na 5893 5279 4771 na
Cer [NS] d38:1 7930 14323 5116 20692 8851 48445 10906 35418 18331 17381 27182 4816 11238 20990 49565 na 29274 12100 17244 23331 31600 24529 9809 10654 22773 25032 21219 10595 25644 29671 16688 34805 34291 43901 60979 34289 62961 29510 45552 16286 19363 17401 17222 12372 20743 25062 28468 21645 17016 na na na na na na na na na
Cer [NS] d40:2 21501 29594 19490 27331 16392 58169 18836 30064 51193 5825 29417 8358 26462 14001 65604 11023 65574 27762 44165 21914 9723 11878 10126 na 3222 6211 3285 na 7677 3356 9599 9858 11238 6858 9881 12820 14263 4736 13037 2709 14113 9957 14849 10275 12325 11845 13782 8166 11091 na na na na na na na 2708 na
Cer [NS] d42:2 7218 4729 4337 18631 3599 14879 3625 14951 13571 3355 8025 na 4449 1980 23952 9577 6015 7189 6407 2812 5224 3419 1084 789 2872 562 907 1920 5442 4686 na na 3410 1275 2522 na 4715 na 2464 na 3756 4602 6814 5680 8822 5643 4190 2972 7669 na na na na na na na na na
Cer [NS] d42:3 75888 83776 48743 102257 38163 126997 48934 114623 94654 61571 77600 30742 64664 66936 122408 59362 96010 68615 97803 62284 41116 51738 22053 15817 26204 15280 43803 31459 41995 33171 12407 30431 40667 38019 48379 29940 40819 19771 41858 20284 53846 55209 52697 69359 49157 55891 53995 48532 57987 na na na na na na na na na
Cer 14:2;3O/22:0 na na na 3142 2499 na na 3084 na na na na 2688 na na 3132 na na na na na na na na na na na 2406 na na 12171 na 13125 17471 8967 13566 29295 11192 46644 4681 2904 na na na na na na 1795 2656 na na na na na 19396 na 2917 na
Cer 18:0;2O_24:0;(2OH) na na na na na 3107 na na 2854 na 2142 3985 8078 9294 9251 10394 3940 na na 5267 na 5087 3182 2727 na na 2538 6483 3212 3605 8297 4042 11122 14566 17031 14596 11305 8163 5700 7812 5532 7663 5502 5398 3562 6901 4667 6558 7413 na na na na na 6463 na na na
Cer 18:0;3O/24:1 12656 9440 7537 24565 7581 17990 6357 7011 18507 2925 6661 6481 19327 16098 15169 21717 37511 10262 12044 21864 14140 33953 17206 16521 14645 15152 10127 13584 24760 16788 16491 22232 37729 25848 39703 30714 52204 15456 37612 18601 30015 28490 23286 30661 18268 30069 24499 24652 18233 na na na 4720 na 56303 4279 2189 3240
Cer 18:1;2O/16:0 434578 421353 306542 601296 365019 770358 392266 603143 668118 348726 743466 426875 574473 724317 819270 533307 842207 593239 653946 485768 418920 444355 327893 285461 328321 404403 454603 292263 613009 387190 503334 503284 707609 745123 648395 562776 827248 485793 758255 429814 489707 494081 447449 472649 463689 452190 498205 471222 450446 na na na na na na na 3329 na
Cer 18:1;2O/16:0;(2OH) na na na 3296 na na na na na na 9395 na 4229 5928 na na na na na na na na na na 4311 na na na na 3691 6761 6397 5799 na na na 3594 na 4011 na 5680 4188 5334 na na 2405 na na na 8589 na na na 5673 na 6668 8617 na
Cer 18:1;2O/18:0 32513 22913 14377 67947 11735 98549 24890 64736 66439 21005 79234 31236 42728 54960 83870 23933 60236 42472 55130 39344 85070 88484 55213 45315 62073 40983 71940 47320 79861 81783 56398 84490 103612 146123 120919 113736 140124 88977 88706 75624 33729 38224 58094 28408 39986 42120 51648 51067 44609 na na na na na na na na na
Cer 18:2;2O/23:0 6861 4278 4389 9392 2778 23300 na 10582 10579 4274 6090 na 4523 3117 11180 6251 3427 6533 5939 3550 3209 4420 4580 na 4289 2738 2596 na 9151 2767 na 3265 3708 2649 3310 na 5233 na 8134 na 4191 8136 8036 10349 4510 4032 6895 5691 7088 na na na na na 6480 na na na
Cer 18:2;2O/24:1 na 4686 na na na 5250 na 15146 4057 2619 8311 4937 na 4749 11469 3466 na na na na na 4360 na na na na na na na na na na na na na na 3093 na na na 2919 4156 na na na na na na na na na na na na na na na na
Cer 18:2;2O_24:0 441427 344211 151586 780758 63113 968852 407922 680752 870465 167583 594785 60621 200868 376914 987464 280966 831575 275182 519811 43136 49235 163971 61858 14971 13712 23049 32450 28017 117939 59452 39825 32330 90012 67441 68557 57231 138911 27692 49126 6853 270874 211683 144025 169249 150493 168656 165746 212318 80083 na na na na na 8122 na na na
Cer d33:1 na na 5372 na na na na na na na na 5199 na na na na na na na na na na na na na na na na na 6636 17484 na na na 7468 6872 na 6967 8461 na na na 7440 na na na na na na na na na na na na na na na
Cer d34:0 19024 30375 7235 36947 12791 34753 15719 23567 26706 37657 37745 27471 54208 39927 30476 20395 18611 29363 20934 37240 16609 9586 3697 7116 14112 8161 15789 8452 6793 4379 30416 16619 31892 40965 32766 33299 50785 19693 67194 40691 17240 17137 21219 24753 20241 14571 24769 31066 19981 3564 na na na 8368 na 3267 6235 na
Cer d34:1 84193 78357 54358 72167 87573 96522 71831 83414 87326 59314 104744 104815 96268 90302 103739 71981 103421 96254 114519 107266 58905 71682 85961 74034 71529 52918 81039 74298 67138 66639 102423 109543 102015 94896 94234 98288 97774 93922 114680 96185 73382 65475 83403 72642 92880 76410 95920 93647 85099 na 3311 na na na na 3552 8319 10777
Cer d34:2 9472 12529 na 11011 na 20653 4725 11194 9574 9184 9788 na na 7427 9528 8214 8005 5974 na 8046 8468 na na 5057 4328 na 5255 na 4863 10498 14798 9303 12782 16181 8007 6221 15997 na 9342 na 9947 na 8620 8351 na 10865 na 14497 4884 4462 na na na na 10689 na na na
Cer d36:1 46451 35793 17879 22525 16594 52420 10600 48901 62665 42468 62503 19838 29038 73834 68781 8237 37962 29900 58091 35893 84293 76158 69237 61225 52195 43549 67547 34875 71474 74452 71248 97511 83904 99033 105525 75394 90654 74808 84565 59354 30571 23463 31989 35255 31372 26846 33906 35516 44164 na na na na na na na na na
Cer d38:1 39994 24445 17114 39801 18298 74691 8536 60494 34870 20315 46870 20205 24620 46951 55125 13232 42739 32478 56594 29942 32286 46145 20242 33860 34761 26243 40850 23358 27411 44394 32847 51218 58919 74108 62670 46973 86511 39273 65194 36983 15783 22560 37303 25165 27363 34154 31136 37694 39208 na na na na na na na 2502 na
Cer d39:1 4743 3579 3463 12953 2641 15809 4470 9264 9736 6609 8525 4406 6958 2536 21646 na 4795 7733 4754 3207 6750 7568 6536 2495 2344 na 4038 na 2900 3107 5706 6643 3359 6790 9262 4489 17986 3544 8676 2848 3352 7775 7903 6203 6109 5471 6289 9870 3282 na na 3663 na na 7458 na na na
Cer d40:0 38485 34170 9091 55410 25591 58267 25701 40154 38630 33982 50434 27719 31614 40802 52083 24935 28316 41832 25675 32743 23127 8803 7853 10055 16669 11705 16511 10691 10692 27121 39405 37050 44130 47050 46902 42852 73635 24471 69276 43880 18614 32335 35985 32324 43630 36137 34326 32847 29739 na na 11426 8538 5386 7856 7080 18552 10660
Cer d40:2 24703 25606 19790 45444 13877 68203 14219 47472 43843 13138 29286 7010 26299 23312 59651 17923 50592 24875 56970 15931 10437 10446 14681 9181 6666 11457 15045 10795 9034 9871 9213 12099 11327 9604 25843 5997 28455 15066 8724 3065 9583 13510 22392 23519 19906 23912 15239 20087 13333 na na na na na na na na na
Cer d42:1 1808446 1589878 1501780 2520609 1482203 2736203 1468184 2003338 1974570 1615317 2125444 1014188 1473508 1670412 2493111 1750387 2138536 1418558 1621602 1190484 1569224 1503695 1584610 1120928 1218929 1279481 1519681 1114712 1388542 1498967 1156194 1102292 1557328 1225554 1430974 1420464 1808148 1029822 1357911 846111 1236006 1521155 1470489 1495423 1501570 1514463 1597724 1382984 1509693 na 4348 13600 7608 5732 252519 15374 11833 14562
Cer d42:2 Isomer A 608480 566631 463569 890511 398505 1088315 544960 827205 976319 496853 795384 340893 589748 554364 1046476 459916 920951 606779 691973 393650 396289 504499 334932 260497 251702 243864 296984 228511 337073 275611 255990 335315 342873 327217 418638 346103 505300 249420 327590 188294 376120 418354 414573 432480 448816 484390 454781 374619 405322 na na na na na 16509 na na na
Cer d42:2 Isomer B 644084 555652 462923 768445 397028 1144931 504338 777834 918122 548117 779612 405580 543148 548224 1050657 516372 807453 620470 732240 420724 414061 457565 333339 278657 285078 266634 318728 272032 309565 248721 278104 328193 348710 325376 358325 366752 441572 257045 317218 221782 385740 442085 487546 433846 437412 437116 444163 370082 418502 na na na na na na na na na
Cer-AS d34:1 na na na 6076 na na na na na na na na na na na na na na na na na na na na na na na na na na na na na na 7392 na na na na na 3054 na na na na na na na na 5388 na na na na 7476 na 4262 4402
Cer-NDS d34:0 41988 42222 24305 104652 39355 89208 45855 75361 71856 56379 102263 31014 80440 100375 89287 49260 91473 66507 45283 73021 32583 10521 15701 15356 45200 37572 23787 23121 47250 53673 105436 23681 93118 133661 108311 89932 163185 76120 161066 75358 40540 49667 52504 62907 59198 55890 53642 53794 60148 na na na na na na 4105 na 3855
Cer-NP t40:0 10962 11395 3150 15618 10053 22786 6140 15916 14701 6607 9567 14170 26997 27079 34222 16925 36891 9559 15861 15123 20217 28270 13714 26478 18250 22172 10923 26595 32960 32478 32196 34975 54930 35976 51364 43020 80008 24049 71660 32507 23418 20948 25198 18811 27762 30809 39891 28324 16626 na na na na na 33777 na na na
Cer-NP t42:0 22667 30167 32072 56863 22002 55337 31785 39848 61551 20414 51419 49421 62388 79484 65178 78488 90116 33569 55397 61692 49709 52420 57984 31231 55306 51790 50713 55681 74410 63921 91551 89284 126118 129495 117460 133811 147637 82994 108899 90127 81120 70422 82016 70292 65243 72776 69408 68867 71598 6148 na na 1971 3794 111306 8291 4293 12840
Cer-NP t42:1 13374 27429 16115 57015 13703 41535 16406 30395 44202 15778 30307 15781 46166 36562 35363 29283 41993 20462 28595 35095 33621 49237 20451 22230 27939 31943 24152 31105 40747 28915 35900 44379 66569 28839 48962 44661 76376 32908 55195 29764 40622 43205 54082 38033 52378 38763 48631 41714 44077 na 6794 na na na 84896 4776 8780 3817
Cer-NS d32:1 na na 3514 6607 na 16997 na 13344 10697 na 9297 na 13011 11403 12123 4561 16441 3576 5318 5273 na na na na 3847 na na na na na na na na na 4457 na 11398 6404 9533 3895 3451 4348 na na 4426 na na na 5274 na na na na na na na na na
Cer-NS d41:2 4749 11207 8531 14070 5182 21235 5704 12097 13651 8771 11603 4372 3645 4701 25856 10806 11488 11350 8918 3481 3458 10807 4339 3671 na 2561 3012 na 5350 6578 2677 na 7649 3868 5679 na 8851 na 6740 na 6547 6884 7946 15352 12442 7328 9429 10362 6233 na na na na na 9380 na na na
Cer-NS d42:2 55599 51733 29730 106265 22558 129843 42025 99229 116938 60239 97366 16704 56912 70659 123389 33847 90482 55105 90045 24247 32068 41973 27257 9990 11098 17551 22320 9992 27983 11372 23037 23293 23953 14466 28047 21702 43519 9567 28681 9998 37651 28088 25472 41853 52973 40251 37913 46078 43553 na na na na na na na na na
FA 13:0 (tridecylic acid) 93974 84639 102781 148537 79767 90163 104257 119599 80026 94964 129943 83775 70503 77870 85400 88794 86942 79286 77977 139843 91539 108145 103306 67165 93125 85742 78355 87593 90846 104411 102084 81287 102100 74495 90412 68292 91177 95012 102715 60368 116740 109611 106400 107957 108006 113770 109515 134131 112356 102302 116571 120675 112555 110744 91524 129626 119035 105591
FA 14:1 (physeteric acid) 443602 340434 550268 724610 211273 527788 475679 585948 437080 386930 882806 103921 86454 28798 303309 347242 216011 514262 165647 68524 382595 269997 405601 111445 218602 143799 232723 205120 389103 330680 286101 160076 198154 155927 171211 196831 117630 264114 190180 134756 239395 230712 259475 251179 235929 291824 317359 307952 261291 52044 113143 106692 67708 53299 34878 147274 139986 131580
FA 15:1 88183 62588 79687 245903 38907 67717 100129 64343 75360 65283 240848 59993 15504 9384 66859 88911 105567 82167 51511 45961 99453 88355 101568 24751 42349 32562 62670 51973 92617 102142 71370 69329 71858 25628 35656 54836 41233 78923 88971 27308 121518 127619 152835 130262 120344 124711 171643 147582 148025 70123 129685 140171 77810 53503 72239 171877 162299 163262
FA 16:1 (palmitoleic acid) 14335072 13223479 19068797 25427728 7412897 19464726 16903174 20747435 16643117 14526381 31844766 2152605 2335123 990558 10432447 13931352 4037141 20970896 5379368 1722321 8736468 5849477 5313341 1484781 3906041 2453700 3752236 3486671 8277475 4843348 4774981 2164501 3581790 2923550 2689640 3389193 2209214 4621545 3317470 2569889 6429083 6434468 6422208 6570262 6222495 6514074 6964621 7482593 6894288 1084827 2151498 2045045 1084745 1040751 1096791 2517271 2458459 2365944
FA 16:2 174906 189754 214145 334777 147192 214450 225860 270107 218273 226418 304139 38451 29007 10288 149542 157021 100471 217182 87065 31536 253199 131752 260483 64374 121552 87365 159002 108998 222636 174187 202881 84953 128460 105071 107578 123850 64329 145846 105819 89181 149794 139674 143708 155236 158874 177259 167029 183631 163331 3289 8315 8070 na na na 23794 27184 15340
FA 17:1 369320 412153 481196 938311 265311 442406 535524 475424 399649 417232 785303 176710 97500 59479 281011 451572 279855 455078 214043 129552 609574 430140 461348 144081 326773 251705 370363 294290 630746 418613 534446 265942 385628 360320 345885 436030 303122 555017 431564 324399 400811 412736 415946 433137 373376 421272 458139 446366 433992 204136 359922 352356 186877 204577 203995 394798 387336 371642
FA 18:1 49446962 48342129 57450268 72562963 32452214 61062983 61082832 64755183 53965466 50364173 106955574 12196654 11114299 6711601 35468942 52463002 35881724 67437585 24198468 8753203 81207018 51780153 62039471 20727795 43340839 32169606 44525355 36924165 74961219 59109568 83604657 37513554 58121836 65160023 50429154 68614744 46224839 79620845 51419184 51961035 37896537 38460271 37650230 37933893 38634278 41843189 42008390 42715779 38712550 3365516 5385327 5293827 3885635 3276169 3418218 6144698 6308816 5779069
FA 18:1+2O 3533 1642 6419 4076 8331 3952 4536 3068 5232 12595 10193 21996 646 na 5404 851 22334 11653 3351 5194 2364 4820 26857 4068 5210 na 4439 14747 6449 16172 3838 5868 21135 7960 3683 5756 33268 2017 3318 740 5378 4101 3587 739 3830 7994 5853 7596 5764 14513 5699 na 63928 8447 na 5381 3175 3829
FA 18:2 1400756 1828025 1881206 2773539 1105261 1384335 2470622 1713732 1353454 1884993 2601356 398013 347631 221909 844939 1910788 582323 1698886 766644 279284 2228386 1448931 1960874 566362 899779 784025 1032467 1434954 1819012 1881943 2009383 916231 1331205 1244037 1216286 1496704 884944 1495061 1420636 998634 1182085 1253074 1276982 1305580 1230172 1431489 1418090 1020077 1336540 180954 305501 309100 171160 167560 177638 331975 351779 321074
FA 18:2 (linoleic acid) 26955555 43178474 40500891 56753378 28789344 35639636 46974462 49829629 36572639 42809730 64020806 7657557 6512256 4075895 23381569 37891541 17001155 44747955 19438740 6189949 56650029 32780753 47826288 13466353 29851017 21205787 34292451 26362504 53437288 42053778 53802472 19562647 33169432 34233180 27289330 39957372 24193888 47468585 29391885 29353736 31281339 30258362 29482453 30581056 29849637 33611847 31111391 34435499 30226566 446166 688350 674903 436260 446578 455295 754664 737829 693573
FA 18:2+2O 6141 na 5731 6465 1785 na na 4451 na 2788 11806 10921 2173 na 5819 1065 3297 16123 2503 na 978 1761 9944 2965 1515 na na 5291 11409 28128 1008 6003 2466 na 2005 2489 12848 4771 5335 4022 5843 3760 3779 2412 4553 7000 5964 7037 6998 857 na 1168 23379 3609 na 5469 5225 10714
FA 18:3 (y-linolenic acid) 2938665 4318165 4541089 6613494 2767424 3959871 5225974 5887715 4191378 4671001 6570564 784640 704816 403171 2563487 3832514 1682454 5020551 2035307 632742 4211602 2287183 2893488 881128 2077986 1445080 2387836 1943241 4338770 3033014 3257596 1161961 2138342 2017600 1780129 2314979 1417135 2918956 1825304 1720827 2812290 2671328 2531399 2729626 2675490 2848830 2751815 3039048 2732736 5934 14863 15912 9303 6458 na 16988 18554 20342
FA 19:1 122557 145986 147624 301888 105350 136295 182563 164183 137679 128074 218020 83499 55692 36946 109029 169600 109652 135957 98362 83169 221015 172282 223621 88775 160765 127872 171641 140872 245067 225756 270874 168528 218198 231235 183886 245790 177544 261308 224764 185332 161972 154712 156489 155169 140925 160511 156750 183310 159555 76003 108032 119008 67248 76961 77585 128010 105956 118686
FA 20:1 (eicosenoic acid) 1379230 1571674 1998056 2359599 1097354 1669107 1803796 1841084 1615766 1260558 2198933 604601 601007 457022 1327589 1775172 1452974 1510696 1361232 618185 1982343 1966647 2787445 812244 1590129 1453125 1513503 1474718 2207968 2203933 3126629 1654848 2401397 2642395 2097961 3325694 1911332 3281344 2193340 2191327 1596578 1678890 1601703 1565975 1510335 1683651 1623743 1613615 1590120 218862 290081 338613 218647 207810 239184 345872 347034 358571
FA 20:2 529692 685686 758923 1064774 423030 678050 699426 886432 648659 674095 872411 175275 175500 115254 437242 638344 393643 574586 379001 137300 1123892 767964 916408 416998 716266 647134 832366 719855 1363131 1110184 1308452 606490 905422 1150984 893582 1131365 816283 1344287 965499 923528 646748 603608 615772 603413 611153 619181 587073 621609 628777 56128 97170 105670 63318 60272 70775 116166 109261 118057
FA 20:2 (eicosadienoic acid) 529692 685686 758923 1064774 423030 678050 699426 886432 648659 674095 872411 175275 175500 115254 437242 638344 393643 574586 379001 137300 1123892 767964 916408 416998 716266 647134 832366 719855 1363131 1110184 1308452 606490 905422 1150984 893582 1131365 816283 1344287 965499 923528 646748 603608 615772 603413 611153 620057 587073 621609 628777 56128 97170 105670 63318 60272 70775 116166 109261 118057
FA 20:3 (homo-gamma-linolenic acid) 569088 568970 633138 1097136 282333 811494 568017 1011336 765740 544671 1155024 65037 136312 22769 400165 554808 280702 683387 315718 51080 748860 501950 448593 194957 365360 342913 514396 299255 806894 508620 292534 139749 204194 256044 267045 232922 146921 309075 278275 203256 357179 370247 335622 327107 326214 323646 312030 386079 358270 na na na 7230 na 7084 15632 15475 18563
FA 20:4 7291311 10680096 9472991 19656322 6555867 10458538 10611123 16394391 11413515 10291868 12765120 2165426 2428131 1980173 6419036 7899443 4414884 10179924 5864440 2147507 13146164 8443487 12128605 3871590 6921331 6027272 9830062 6309106 16259361 9193584 6488086 3516600 4577436 5785452 5202276 5336255 3799452 6038976 5907621 4137882 7054435 6834075 6796771 6847925 6706483 6728888 6767425 7129340 6570525 na 4107 na 4551 3048 na 2222 4008 6496
FA 20:4 b 34121 33440 37213 43233 43591 72038 62200 172496 118125 111573 29054 51998 85558 53266 50850 47162 33269 143341 114979 49219 140534 41984 154353 47773 77901 60667 50190 65602 178026 149446 31150 31361 220255 29301 46480 39041 19489 199919 100948 46585 102460 88526 95623 88675 96070 98545 107335 107926 110245 35680 47526 38877 43409 64638 43923 47122 52051 58260
FA 20:5 (eicosapentaenoic acid) 593831 802155 1004069 1284182 424070 693861 853981 1640990 1018932 1183044 643888 111380 115145 70046 368726 452572 207143 588768 361337 83427 380375 269456 434907 93702 160709 158584 309449 184074 487842 344996 168915 82992 102617 129741 102926 97529 71276 144557 133703 76722 729728 714805 672581 681031 685086 675254 703432 756847 728596 na na na na na na 2427 1954 na
FA 22:2 (docosadienoic acid) 43287 62076 46267 126601 45861 48539 58597 65896 54336 65629 64629 13512 19118 10760 24302 50570 28218 38752 28013 19275 67118 68315 74458 15860 49855 43636 45256 38494 83804 79388 66594 43741 61377 59071 50602 62223 54627 60140 49513 42554 59334 68065 64407 54166 51640 64254 61168 65155 60181 18877 34992 37032 17675 12891 10702 42087 47777 26559
FA 22:4 1233336 1832775 1756916 3229601 881234 1668316 1660947 2582544 1743364 1645837 2627940 323371 434331 295355 1196586 1642328 1148545 1776664 1141476 321197 3205119 1625201 1532562 995533 1483748 1379560 2372661 1210838 3519900 2309523 1576524 628603 970487 1822989 1388639 1290575 919260 1494146 1396044 1103357 1213401 1180841 1118068 1204952 1146550 1100379 1172122 1188024 1140941 57416 47851 28176 49749 41497 27131 42160 41122 26433
FA 22:6 (docosahexaenoic acid) 2241787 2923955 3271703 5354423 1528221 3346056 2608626 4256419 4218699 2666965 3007822 502836 763473 529078 2012192 2191914 1327406 2684968 1861615 494791 2500976 1844876 2422870 717022 1229337 1296893 1919111 1184343 3242990 1541162 1083415 620616 951106 1241848 1062378 1105704 678086 1136145 1334451 855094 2622898 2436379 2368993 2502373 2494884 2565646 2519302 2625565 2564695 na na na na na na na na na
FA 24:1 495785 639681 729291 857368 435716 634977 822887 706173 671255 581189 688770 476341 606139 601847 631406 822061 803486 745349 990023 707500 486095 845304 1043897 246676 479835 434127 397119 482811 540465 560049 847080 428914 642132 668570 685360 1014576 504305 877870 354420 628081 730754 747663 749602 748689 710755 723563 691516 704697 707104 62985 97779 102656 65154 70089 82455 106697 93775 92125
FA 26:1 300751 476894 657582 683794 239909 440962 671552 623969 399867 277682 468555 448269 551526 647525 369924 653881 582665 541656 951124 850096 321124 561354 870650 144286 349018 278772 288230 359188 322091 352966 1077964 300693 506337 739303 652055 997465 547028 975063 285624 612742 617480 640147 644124 629010 618463 629295 650712 659301 655981 69069 110680 103828 68822 70211 74618 101291 101862 104371
FAHFA 18:2/18:1 124987 372799 297347 596088 143669 210454 373963 463904 221493 351853 830966 na na na 101866 266622 21850 378801 57594 na 658531 176428 369834 15199 129936 39564 170957 123995 535602 315370 591367 37803 173988 205124 137748 298054 91030 381097 140133 130209 157949 151578 163252 143607 172590 217891 177509 248124 166281 na na na na na na 1907 na na
FAHFA 38:4 133803 118092 167073 245180 45411 187575 184948 222863 151984 130226 478116 4562 na na 58211 136539 62678 259098 19610 na 340121 120555 169765 15064 109678 48936 92013 46849 253744 176336 255655 65992 189712 201701 121457 246869 106420 281010 155971 157129 54905 79621 78893 107765 86049 103632 99277 86901 74354 na na 3818 na na na 2514 na na
FAHFA 38:6 30312 86415 44975 139804 30128 39228 105281 122584 57026 57903 164688 na na na 15040 38995 4019 92429 5116 na 133454 36426 74307 na 31097 13755 35119 10945 121838 81266 101615 5836 46562 45858 30023 73248 13331 88218 28008 29908 15663 38789 17967 40161 33731 34945 24273 52169 38590 na na na na na na na na na
GlcCer d38:1 na na 2817 na na 8271 3361 na 2871 na na na 2753 na 3335 3109 na 4868 na na 4532 2443 na na na na 3348 na na na na na na 3923 4495 3340 na na na na 2515 na 5043 4413 2799 na na 2794 na na na na na na na na na na
GlcCer d40:1 88840 69932 43717 84281 99966 150749 70240 186679 177327 82578 102251 36987 101421 149226 129479 57051 118042 149303 102669 93285 103642 76954 17262 41430 61498 59189 64228 53179 71176 40227 29945 26492 47431 58196 99084 34933 66527 33917 34286 47417 91925 91142 104058 98944 94326 96842 90122 79557 101303 na na na na na na na na na
GlcCer d41:1 30473 50042 42636 56088 63779 93586 43870 119089 72118 46375 50113 38344 52164 85984 70532 35942 84188 109503 59611 51033 62288 39998 12136 15725 33787 25859 23017 27606 49323 31137 18823 10757 45048 36763 59830 33099 41940 18946 33785 18545 56254 70123 85010 71162 78161 83360 77612 69833 66722 na na na na na na na na na
GlcCer d42:1 152429 160783 162708 177315 198195 256019 136116 296693 242089 148159 183736 126812 188621 268532 214871 161497 239795 289131 190716 169004 150042 137442 50247 94749 122969 92200 118361 90547 122594 92198 89227 74428 127096 140920 160072 72582 154794 83621 110212 83256 180191 193021 174314 186441 196174 186110 195997 196780 182830 na na na na na na na na na
GlcCer d42:2 67230 87262 48950 91393 102875 175825 56886 151456 185997 90577 98181 48081 86038 143162 158254 52304 171483 164968 95732 92508 77456 86046 8806 18286 20991 19114 49018 20793 31621 15082 16175 20248 47869 24364 62240 18207 55797 12629 31136 22632 78629 88427 93383 97919 91563 92886 83901 83283 94167 na na na na na na na na na
GlcCerd14:14E/20:02OH 71293 56817 75492 58758 62537 74504 80592 96962 98321 70749 80557 127391 101571 151025 73950 94989 127624 103947 122619 115922 48755 86182 25551 29244 72700 52925 35742 37169 139757 104468 82237 93624 121815 117878 106949 101544 104167 106795 128014 83970 116303 97077 85658 95320 99613 80453 68072 89064 85476 3873 na na na na na na na na
GM3 d34:1 4445 10341 14758 12621 17188 8909 4534 26814 9038 27529 13776 14597 29892 26436 na 13698 19233 18728 19831 12842 14050 14682 19611 20877 18155 3700 11292 3913 20840 22556 10593 14755 23048 25032 19848 7044 10963 3194 8445 7887 12987 22188 28567 20060 11725 20499 11465 11329 14244 na na na na na na na na na
HexCer(18:1_24:0) - N-[3-hydroxy-1-{3.4.5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadec-4-en-2-yl]tetracosanamide 2704 2317 na 4998 na 4059 5416 5243 7766 na na na 2611 6088 na na 7085 5867 na 5828 4237 3918 na 7812 na 3272 na na 3149 na 2226 na 3042 na 3635 na 2461 na na na 2735 na na 2916 na 5936 na 6312 2427 na na na na na na na na na
LNAPE 18:1/N-20:0 5201 3470 4974 13513 4078 13670 na 3769 12458 5191 6463 na 15285 5066 14162 8543 5924 4337 11816 6783 3517 3954 na 7961 na 7807 7422 na 6989 16871 4846 13217 15659 4114 4877 na 12089 11569 4484 5118 4961 8838 6946 8929 6278 7241 8401 6861 na na na na na na na na na na
LNAPE 18:2/N-20:0 45710 38935 34984 16870 44257 44105 29812 25724 18476 37206 29606 33611 26240 34776 33304 25947 25883 40796 42946 50822 44787 54424 43365 30984 60620 51921 19917 41087 29921 44959 44766 38265 69650 50993 41246 54497 50265 49815 55387 15407 42268 28730 24326 42036 43788 47714 34846 44689 42569 na na na na na na na na na
LNAPE 20:4_N-3:0 31252 35284 28199 43332 46837 58281 34662 36871 32109 50260 23371 31311 31752 37931 27629 25503 30588 27428 25264 30542 38930 45046 29420 25405 55314 29017 27135 45300 40459 33897 65730 19158 53161 33115 51227 43525 46545 50502 56129 33177 52371 43567 27642 42850 44940 48820 47100 51281 50079 na na na na na na 546 na na
LPA 18:2 na na na 68455 na na na na na na na na na na na na na na na na na na na na na na na na na na na na na 968 1503 na na na na na 2170 na na na 962 17871 1820 na 2610 na na na na na na na na na
LPC 15:0 195224 161608 151357 246149 225196 213692 276009 195431 245768 204327 232373 181901 209800 238139 181433 242990 350106 173794 242447 156186 162905 166091 133099 136203 152482 191352 179756 146539 381653 165573 141267 165531 207380 182695 167391 150168 191250 124237 239242 150433 292535 198635 169739 162899 186240 153298 144746 171396 189160 na na na na na na na na na
LPC 16:0 8471770 10335327 9476614 11735978 9905146 11051493 9637387 11810906 10476096 9942459 11432504 8524722 10721181 11933325 10317276 8534975 10236715 11334294 9755645 9813694 11011774 9717370 7199145 7051959 10032829 7685845 7933667 7629761 10164146 8327211 7936049 6026125 8627088 7290879 8823797 7255952 8812495 7105850 7564713 5654917 7661234 8055876 8218346 8269561 8479919 9000102 9296319 9279926 8900615 3733 3710 5045 5622 na na 6536 6409 na
LPC 16:1 462526 485681 605075 521780 455577 676449 421602 613703 444218 398072 334592 313872 482021 391855 377863 304882 294696 407744 305495 275208 97498 93756 62377 51993 91052 60353 64292 63719 73380 67205 93907 39125 91634 61777 81668 61556 103457 79639 74712 67019 174688 190223 189942 198079 207864 224899 210358 224209 190758 na na na 3105 na na na na na
LPC 18:0 2900111 2357767 1975634 3410575 2594356 3871834 3100179 3196219 4315614 2948536 3314532 1909776 2446884 3259093 3134735 3016923 4552358 2767595 3142245 2465737 3696266 3764662 2354218 3371414 3692947 4111225 3701714 3163121 6185000 3859815 3217532 3147042 3867481 3902403 3557828 3451668 3086565 2549272 4279796 3114919 4228437 3625082 3386085 3205009 3073389 2986645 2878729 3477481 3183501 na na na na na na na na na
LPC 18:0 Isomer B 543112 556525 630824 1015023 682892 1133378 582624 828078 1043641 702164 1017682 508762 656816 789328 816475 564196 878963 719750 756791 548315 952819 1003831 882082 871536 934017 1039389 1342680 746283 1496572 860156 570454 596689 887469 1034763 1000033 695814 869757 776592 866284 729839 858368 646347 731936 874200 1001900 714906 769124 686508 698109 na na na na na na na na na
LPC 18:1 3797862 3396004 3199452 4349462 3918708 5856249 3524252 4064055 4416980 3323635 3783378 2446273 3350287 3491110 3808557 2967374 3651139 3065999 2714837 2315118 2369987 2360880 1680543 1581254 2333512 1694193 1750014 1698387 2244482 1930405 1812944 1264715 2186566 1468217 2206382 1674210 2334255 1605813 2006075 1289751 2396839 2354868 2337496 2432181 2448162 2477874 2436325 2700494 2610309 na na na na na na na na na
LPC 18:2 4425713 5120556 4217567 5320815 5153934 6415209 5598833 4945761 5317177 5260688 4459607 4282876 4338184 5224691 4273449 3540356 4203050 3671795 3998745 4428536 5112360 5157128 3983173 3828236 6625572 3690830 3652366 3798328 4822657 4592490 7360364 2815961 7113906 4414994 7065984 5022533 6809190 5768702 5984970 4133029 5338518 5057243 5307911 5460517 5800066 5482693 5416876 6079034 5694815 na 3704 na na na na 1814 na na
LPC 19:0 5197 15598 15671 17248 14789 12119 13524 12762 3729 15177 16906 5013 10423 11755 5726 13052 9499 14568 19497 16438 21804 22440 11063 4914 24001 20220 20868 9305 28268 10882 10562 na 17996 12232 22186 13773 11360 13665 9590 4325 34408 25130 33031 19496 38120 38649 36558 36837 40364 na na na na na na na na na
LPC 20:2 43106 45358 13079 37738 63893 61132 30722 31199 41367 28925 12883 9753 28235 27742 46528 7627 44135 17210 33990 25026 33921 40421 7218 28778 43306 23746 20897 8973 20206 21010 13596 7370 33270 9404 55663 10692 36240 26509 30753 11683 42106 26295 25314 29091 24043 48159 17830 41841 30524 na na na na na na na na na
LPC 20:3 227454 204282 201125 241823 246595 349227 186082 211605 253122 183935 153182 85889 178154 133764 191877 130135 174370 125400 132100 110368 121401 159201 68420 106657 138682 102974 121612 118961 138876 122007 90676 28407 103035 71699 105923 84175 91582 95480 79310 67648 121527 130740 133277 154721 155171 156551 153777 135232 147053 na na 3053 na 3045 na na na na
LPC 20:4 3561489 4497498 3244702 5410474 4135025 5734373 3664828 4463471 5095403 3940889 5191719 2291825 3641089 3885055 4676764 2863928 3795297 3474539 2700889 2477236 5365231 4347131 2930399 3026120 4760322 3030542 3964737 2968637 3856649 3210447 3546273 1623571 3159245 2920276 4112499 2712943 3658953 2678925 3222029 2361401 2820984 2816795 2886851 3245525 3217948 3301810 3193843 3168669 3128616 na na na na na na na na na
LPC 22:4 7299 3857 4418 5766 12679 18120 5194 6726 5482 5182 9086 6947 10610 18974 12726 na 14005 3340 na 3296 69073 29688 8334 32347 36429 18803 21682 9527 28911 15039 3965 na 17903 18762 36191 8888 16757 7621 8006 8782 4661 7724 4407 6084 6011 6954 6444 9781 6661 na na na na na na na na na
LPC 22:5 42765 56680 27995 68807 58493 69879 64714 59810 48367 57046 83006 24550 41970 79131 65308 34924 39522 36224 28573 25507 104596 71488 38428 57210 71974 43046 52263 33390 68755 75236 64699 19136 58109 34320 75075 29013 50251 29275 35628 20768 49387 46839 50872 53761 58661 58815 49292 58814 53434 na na na na na na na 3031 na
LPC O-16:0 12372 45379 36087 35264 33697 37126 36627 67605 45765 20770 31930 16600 43515 48899 28523 21448 44069 51232 43542 43556 50865 38933 19090 34871 65272 34891 35048 40024 57113 35182 15981 13237 45376 17573 25681 16746 12562 23754 25210 14802 34344 39718 35501 38301 35565 38261 50375 47637 37965 na na na na na na na na na
LPC O-16:1 3622 4809 na 12344 na 5035 na na na na 5030 na 4190 3872 5616 na 5922 5988 na na 6592 7788 na na 11275 na 4185 na 7856 na na 4296 na na 3539 na na na 4704 na na na na 5542 6672 4502 3438 11164 3435 na na na na na na na na na
LPC O-18:1 7020 17054 3755 7398 13418 10511 13502 12729 15836 4584 15589 5223 12474 14861 9042 4474 16662 18382 14133 8459 32278 35020 22640 15727 32517 8783 7102 16261 32300 19332 10850 7054 10073 na 18742 14757 19745 14284 4970 9279 4829 16340 5905 7841 20620 20986 15202 15373 7130 na na na na na na na na na
LPE 16:0 399177 474854 384299 579127 445000 534302 427507 635770 548546 413122 634730 320687 481437 657309 478979 466243 612881 565699 523295 452926 625527 498510 208827 231868 401276 349278 400408 362222 594983 380882 358803 280375 322201 256086 467729 364993 486051 308615 428247 275453 390051 381905 395075 375974 416500 453297 428788 427976 441043 na na na na na na na na na
LPE 18:0 472711 512852 371915 694308 565416 862304 547908 802601 728722 518672 881318 339838 513542 740495 656359 536761 848620 691858 622694 574228 1184600 1043838 425138 522670 778934 871312 886788 860730 1214163 898974 745401 632689 632241 655175 1022031 778185 976765 704670 951889 628010 637086 666183 673281 700218 639573 693536 696454 729490 699117 na na na na na na na na na
LPE 18:2 49217 88963 71019 87838 70891 89724 83473 92905 83645 68987 71329 87104 86943 143546 66407 84345 105883 52295 94088 106852 110424 122790 68527 73702 146704 106155 75575 103587 95146 135838 312931 89648 212904 136758 324400 189187 342584 235327 266679 175229 115481 129420 130261 127382 144969 156231 143622 160110 129827 na na na na na na na na na
LPE 20:4 111987 137348 106167 160995 107318 143226 133987 184092 118428 114492 154021 77273 97318 148145 126342 116699 172697 99467 135810 97889 234098 194912 112342 87540 174423 130543 150753 122059 184055 172308 282649 79919 154646 157159 239446 175957 272835 176329 221943 162974 130964 122809 130242 135624 133624 143986 133577 137811 152448 na na na na na na na na na
LPE 22:6 29558 40594 24830 88009 52076 67565 38212 53930 53253 26158 74553 4822 34737 54386 78063 39379 67919 49708 59649 21314 88179 62514 24482 13026 34524 23314 54584 14940 63908 30928 41918 10372 11256 27756 58674 26141 46909 19454 55279 20003 29635 29621 28726 42150 52941 37300 35618 46126 35838 na na na na na na na na na
MGDG 16:0_20:3 59519 24403 28945 29618 20071 16603 20968 19800 10488 30763 30543 36601 14757 14764 14132 48856 29632 32419 10056 29128 30353 19186 16800 17960 15359 47728 42356 17885 24660 23013 12614 27056 21111 24472 46428 23916 23105 12466 11534 52206 26282 31277 11562 17874 13384 17485 22349 33857 29295 na na na na na na na na na
MGDG 17:0_20:4 9004 4919 14725 16090 6521 15359 8895 13359 11896 11435 8346 11488 18571 14274 14044 18008 22531 18469 17186 6097 na 6405 6712 na 7865 5519 8010 7790 9791 6285 5531 6500 7584 9446 12115 3850 5151 na 12228 5407 7994 22560 3034 12307 13093 9786 16209 8129 11368 na na na na na na na na na
MGDG 18:0_18:2 185370 184468 188762 194531 166269 221972 174990 197351 208966 203305 196014 205950 169862 232250 178118 227094 218527 191002 234708 229405 167661 249463 197374 225007 217033 243848 236443 259024 263129 260874 192059 273816 319068 269765 299529 270029 275661 268673 262978 222542 239197 290889 236552 256249 238118 262194 217371 184993 253434 na na na na na 6003 na na na
MGDG 18:0_20:4 253248 233849 253133 324305 265456 278701 260428 351128 397228 271699 339608 214903 249588 235244 346742 274858 329655 234548 348685 318227 319995 332058 309047 275744 424876 421069 338106 303612 417792 404015 266092 330497 320213 312391 363718 294220 396647 321215 334527 353446 213710 281354 229715 212686 343055 259147 282865 194241 212677 na na na na na na na na na
MGDG 18:2_20:4 4796 na 3208 8157 4516 8582 na 3526 4454 8927 3748 3931 na na 10554 na na na na 4056 na 3136 na 6081 5399 4501 5980 5854 4559 4649 8548 na 11808 na 14881 4470 5789 na 12548 na na 5138 14131 4522 3839 10009 9355 11953 na na na na na na na na na na
MGDG 34:1 102122 83002 90961 85285 98160 115919 101600 106418 109250 58671 88002 97055 104702 92299 88012 101116 98820 83355 92147 112868 38057 58615 40443 45413 62624 50140 36871 40050 43667 62005 76587 64752 91242 63126 74405 52269 102824 78641 73422 75546 55736 59752 66831 45556 74087 50132 74607 56592 48875 na na na na na na na na na
MGDG 34:2 326351 279694 279461 265870 338597 318418 234672 296189 344192 313148 308459 371319 363484 319380 329951 377320 353824 266080 328948 382610 376323 381298 225458 268471 352931 330006 283007 271076 301337 334177 353131 340276 474668 319023 465095 508424 493491 418177 535840 319580 353698 439447 277322 326242 341330 333416 328660 286609 331676 na na na na na na na na na
MGDG 36:4 403633 318400 390907 372366 351893 346160 357316 334843 336201 369008 365292 429048 355196 326483 359937 437559 363858 409765 322927 339728 382550 349841 312815 288209 287877 477842 390809 358360 289324 393343 244832 250773 375216 391591 474070 394484 399565 268379 280332 373651 242948 371141 331900 322848 348898 330634 443126 361659 347835 na na na na na na na na na
MGDG 38:3 23311 11920 15550 31001 21393 57778 16565 40315 43895 24978 26596 3186 14799 13516 43772 16502 31179 19124 11816 23991 33804 41548 18487 29561 21307 31967 37579 21536 38923 43492 28386 20761 31539 25253 29905 22406 33699 45531 27795 27395 11100 19641 31713 26790 27147 20413 12917 28538 24825 na na na na na 20750 na na na
MGDG 38:6 177826 205732 153527 255120 183713 230914 145863 169624 217108 137460 234824 139753 174882 190959 293564 207112 251345 154823 214517 155739 191680 124777 102200 120923 138940 156417 139711 121239 183271 170249 124467 161305 130667 130109 156029 134987 128874 134180 183764 116986 141733 151172 152699 131152 160073 188233 128630 93064 102865 na na na na na na na na na
MGDG 40:6 101671 82388 67599 102568 88802 152001 58488 93979 139750 67871 124255 70109 88493 101844 145311 109692 125339 105277 83228 61592 124548 111160 61875 81943 82053 101216 135940 72389 95997 72904 75618 54658 102432 130269 106363 103472 110558 78133 112976 71045 89782 92231 72808 89856 71393 95791 84577 72121 87811 na na na na na na na na na
PC 16:0_18:2 5814150 5170581 5184020 5291702 5804516 5412233 6807452 5296232 5667805 5543571 5317409 6652421 5589875 6315801 5687495 6878775 6873891 4866857 6056659 6260756 5691947 5832796 5409512 5674038 6196342 6174914 5259216 5651091 7403749 7108741 7263048 7743780 8465145 6745955 6556615 7842458 7345545 6661436 7920816 6805472 7878561 6612057 5908613 5823082 5866647 5741800 5394725 5655284 5735334 na 4346 5410 na 5085 na 4480 10888 3919
PC 16:0_18:3 314450 277761 335420 486141 288581 393809 286033 612594 309305 402734 250591 284337 325627 382584 238024 425144 292015 354982 312466 277393 179967 138974 177872 109386 123646 143268 188596 138110 159187 228581 185773 153115 194490 198118 183314 215271 305650 189367 168316 136994 260254 231619 247926 278858 226770 243357 245287 235717 232770 na na na na na na na na na
PC 18:0_16:0 257095 287602 235396 340683 278593 315750 308633 357216 335904 254570 355570 245311 281829 396503 383114 306423 514203 315942 326788 317310 357893 352833 222819 331336 420119 356100 324178 280136 532379 420042 463273 401434 605567 618768 565948 481079 644954 456952 687042 542173 402495 348269 367958 332701 315896 317943 333963 319937 339011 na na na na na na na na na
PC 18:0_18:1 1651077 1256133 1387869 1837804 1216729 2393012 1269325 1526875 1852961 1277079 1633484 1055086 1281905 1375455 1942194 1556586 2032112 1214810 1365354 1176243 1045585 1228964 1151629 1072962 1222607 1485843 1193659 1138894 1501211 1627340 1339427 1611849 1595265 1452226 1468061 1507700 1670949 1323468 1835133 1352601 1596986 1459610 1439691 1242041 1265928 1274544 1232719 1275104 1224022 na na na na na na na na na
PC 18:0_20:5 573416 426324 366735 716734 426260 794810 407569 575401 567404 390233 411912 276059 371120 466013 521973 566163 598366 355848 415087 277816 619356 513484 207748 531122 458021 768359 652688 222803 907847 350845 205961 254217 363954 691459 753891 363801 438967 207150 419093 344189 518449 422446 457292 438916 439713 462727 446210 413178 390457 na na na na na na na na na
PC 18:1_18:2 1394162 1117411 1306554 1277642 1539919 1642543 1439896 1074088 1428583 1224926 1043042 1299366 1249758 1295276 1480490 1696843 1738690 827032 1451056 1241235 606547 677805 579834 689009 779936 830487 639576 755153 946624 956723 1002125 966395 1326385 1245176 1256084 1124429 1390907 1114864 1606119 1291748 1294508 1214234 1126207 1077546 1146534 1135615 1072072 1132230 1117629 na na na na na na na na na
PC 18:2_20:3 923560 915573 851527 1118323 871082 1212603 772956 883520 1058285 718459 1047519 677292 871874 960791 1234206 1105271 1183049 813885 919147 735805 912318 847789 569259 669850 761145 895866 753407 652310 847736 834356 564149 574228 596690 836637 807425 756536 744891 667113 795016 670772 687751 758148 683904 733343 756447 789974 745550 725688 705486 na na na na na na na na na
PC 18:2_20:4 982243 848839 748379 1466687 1313231 1504853 972831 1025966 1039942 1148008 855691 673917 854192 918644 1230981 1167360 1142367 708147 834173 806613 854365 943637 580168 913156 1056756 1186506 882853 902228 985461 1119531 1096718 815187 1431127 935420 1477035 1197816 1607704 1116708 1482146 893262 1231834 1280231 1258229 1156872 1074135 1214540 1171954 1115490 1074710 69171 79793 79404 91936 106709 50611 82457 82076 82212
PC 18:2_20:5 156614 129864 125993 295269 172129 316882 107338 164722 171524 103733 127693 66300 136643 89116 221521 204303 173380 89685 135583 61561 30583 26432 4705 4801 6811 31017 22534 6945 26516 12174 5658 4505 6294 8840 14402 5694 18455 3520 8533 15542 62588 68605 78512 75590 78185 70038 77480 67363 69458 na na 5732 na na na na na na
PC 19:0_18:2 125178 95265 111716 139292 105670 172154 100134 132976 175179 108201 102316 72374 92382 99977 126256 127280 160544 92871 110053 91152 54653 73823 43103 72389 74103 98735 83143 85237 133526 124034 63776 60007 88955 78048 84376 72627 91158 99223 83358 58794 129893 126961 121657 109465 99195 102670 101877 85954 117137 na na na na na na na na na
PC 30:0 183126 168044 184389 156689 171164 162278 193351 225983 182257 181728 198296 234535 230406 273327 151445 160492 168893 252935 187612 235309 202308 249981 215963 235395 226296 210240 196268 231663 222370 256851 232459 259203 254346 229456 205639 217344 223498 216416 209154 260865 183988 183803 191068 209770 220002 194286 189700 185877 220400 na na 3593 na na na na na 1574
PC 32:0 634304 828145 816762 680507 729698 728221 723393 829650 744990 685992 828388 1056005 984503 1424706 804157 918159 930817 974284 932298 1075234 703352 761375 610035 510661 636546 572720 539346 541249 704024 702096 873674 820860 1038127 908414 1137537 768138 1132537 873069 913410 894635 701889 809146 743520 772831 739529 796345 793283 675719 751642 na na na na na na na 2904 na
PC 32:1 1438863 915410 1767320 1221137 1084117 1754378 1205264 1398706 1257046 953939 894280 1380989 1356500 1290932 1024722 1243826 1036111 933146 1042209 1039999 202457 199058 139402 132235 146149 182758 128973 207824 212607 214202 295144 244270 372456 383710 378432 304943 489281 319457 449149 392250 651518 571312 659552 637839 622111 596970 631047 600383 691159 11831 8277 4877 3901 2080 1745 6048 5130 988
PC 32:2 368360 310169 341466 532795 319279 543742 371538 435791 314718 263019 295465 433832 434980 484055 367059 524654 523834 303090 291691 347370 193705 169411 113134 69751 98148 118927 111452 179654 180260 182324 190093 106284 190839 158776 167022 173994 260132 175695 187458 128464 249227 288447 269794 269020 246962 242005 288324 242628 282887 na na na na na na na na na
PC 33:1 140096 150408 169478 190688 141506 198258 144442 186552 127288 129014 125140 149876 169597 157888 167818 181923 176124 112357 138457 137014 74604 78147 47867 46517 83341 61788 64549 72780 59007 82044 106477 85796 116562 108837 137549 142827 158439 116455 108517 96052 128865 131909 134870 124447 133164 115752 141089 102320 126269 na na na na na na na na na
PC 33:2 90362 127461 120902 158830 124501 112809 137577 120975 77311 121278 104557 155420 127206 181092 108009 185053 134173 117441 134064 162974 83768 116459 91013 68217 85651 76522 60467 112110 78743 107444 175172 83698 171248 104424 145147 144302 177204 171560 111822 103459 182963 210897 169069 200645 171642 198864 170810 159907 189092 21475 17483 4553 13539 6125 20440 21397 27499 36422
PC 34:0 334488 437437 361614 444140 360968 496591 360802 486324 412138 364338 522062 332536 445719 563164 511863 397196 566677 476163 446460 494053 560749 595125 315168 459925 642799 527588 457098 434432 575710 594063 675185 503758 785531 779134 842096 654942 953753 698346 822823 783382 445671 459969 465338 454383 491518 472942 491757 417069 449112 na na na na na 11279 na na na
PC 34:1 2980725 3033661 3735670 3110831 3143635 3670522 3290869 3213883 2809345 2764138 2933097 3503086 3338782 3967232 3247866 3392827 2919688 2795619 2855733 3258318 2233660 2310189 2076931 1859365 2028649 2039574 1750281 1985618 1920678 2271744 2432995 2494939 2839154 2208538 2788516 2377604 3441119 2712557 2347352 2488631 2226090 2426199 2254509 2496719 2391751 2557354 2665895 2256713 2426771 na na 6027 na na na 10800 2530 na
PC 34:2 9031950 9917733 9687231 9438039 9744414 9840576 9757523 10477569 8980057 9180847 9723579 10944259 10566375 11998527 10492412 10400801 10186946 9251531 10037701 12716247 11102491 11745112 10606593 9983602 12301576 11239746 9110097 11509458 10519666 12755532 13380425 11705744 13810274 12326053 14263948 14350531 16133258 14235306 12859333 12538172 10724327 10813362 10213597 11009470 11228077 11325592 11375808 9744111 10510329 173694 81955 11854 18891 109558 16507 85917 166248 55093
PC 34:3 526468 466496 531789 745364 677304 633651 531626 675344 371564 509713 498157 467625 565133 483908 525651 824208 550116 448382 504405 449033 150020 167979 85920 104795 120536 135532 118487 148135 155986 148205 212209 112051 244034 242872 236228 197887 336388 217228 236821 194765 369949 388391 388498 364691 358611 407296 387267 333296 349013 na na na na na na na na na
PC 34:4 490453 404826 422846 953690 404551 909012 461778 647511 519999 269980 363325 325137 508003 442247 558818 518372 615564 467180 322502 288486 204659 109216 77522 57433 74677 115305 90258 150625 142085 148834 119250 74322 100940 136214 113760 103486 135181 107334 106405 90390 205572 231050 272637 268422 252209 230322 241210 239355 243040 na na na na na na na na na
PC 35:2 177088 206369 197492 195572 177913 186681 170246 177951 156533 165283 158369 229858 287225 248180 181468 229261 230666 173782 209315 304499 150790 196534 172714 167345 225628 210966 160739 206850 193464 265683 285900 205251 364233 247308 340899 295770 320553 329089 279331 263918 284203 318401 317589 340069 325158 279572 333530 275050 317970 na na na na na na na na na
PC 36:2 6449271 6440039 6069908 6425288 6597509 8559723 5684542 7457476 7318459 6425223 6665301 5918237 6834768 7236310 7069671 6175731 7551419 6267039 6590455 8459121 6637719 8307996 6846626 7496871 8911774 8796140 7174511 7721926 7193334 8933153 8405152 8159917 9512317 8527346 10114480 8581907 10326422 9899376 8561392 9145949 7407117 7654026 7614340 7531549 8156293 8187508 8338087 7261409 8079832 na 5152 na na na na 3205 3922 7444
PC 36:3 Isomer A 2167909 2025648 2338805 2083953 2539819 2781485 1966215 2036847 2129708 2020445 1953882 2101522 2242082 2273205 2660530 2456848 2490286 1630266 2219865 2334326 1082922 1298435 1080559 1131098 1432312 1464170 1085697 1310764 1319747 1548078 1645877 1382060 2086168 2020356 2437987 1825141 2771022 2073602 2368715 2096466 1729742 1913919 1800118 1948542 1999598 2007675 1997842 1843263 1907709 na na na na na na na na na
PC 36:4 Isomer A 120591 87857 127064 167812 134574 150001 85173 149561 111141 117939 95975 45370 92601 66943 126565 144516 101721 82409 103942 50290 22476 12369 11970 6471 5399 4608 12068 20354 11728 8887 8988 4950 13948 16114 14039 3453 21335 21002 1394 1228 31067 58471 40018 47717 52294 43116 53349 50459 52541 na na na na na na na na na
PC 36:4 Isomer B 192370 241385 200108 287269 306927 447025 209322 223620 235178 294151 240973 472364 404866 646028 345407 313500 413069 198452 289035 632899 230046 275543 225177 312534 412760 384787 194440 414458 313677 459634 562169 318930 689238 592133 809972 599618 991645 739992 744393 552464 570335 587015 705071 706758 709740 729835 706670 548769 570005 na na na na na na na na na
PC 36:4 Isomer C 11379270 11991204 12093751 14121855 12138350 12963824 11047485 13599173 11847799 12063886 13914974 10323314 12731720 14413014 13592037 12228635 13632779 13127478 12349163 13130024 13459151 12290148 11356492 11171572 12579316 12680596 13063643 11502564 12250581 12573457 11907842 10732907 11910973 12381436 12904352 12566392 13671044 12468287 11510698 11502052 10186328 10619271 11378694 11205436 12014137 11847883 11265835 10140814 10729671 na na na na na na 5890 9086 9951
PC 36:5 Isomer B 811781 621541 908486 1184764 820708 1053165 620078 1055197 758986 664303 670337 383181 682678 480908 903688 1010645 627131 520137 601471 370204 178040 143504 82847 97274 86709 134413 150407 125081 140597 146078 115268 68939 120649 142949 159122 132866 207555 125308 125538 98275 332043 391106 398941 349949 356475 381982 378331 346477 355237 na na na na na na na na na
PC 36:5 Isomer A 10419 13380 22524 38680 10475 46861 14618 22226 4864 20382 18529 31306 41828 82020 46216 29613 47202 22252 21917 67145 4515 6952 na na 9543 5990 na 7339 13214 11424 25316 na 49385 36361 50577 14624 64034 33672 40742 30025 46361 67330 72138 64121 77613 62613 52651 65823 72763 na na na na na na na na na
PC 36:6 94550 73933 75974 207780 72009 200240 68052 111817 105833 35915 75033 70140 115077 90710 174531 112174 140630 87479 71519 44602 34320 13840 6987 na 4998 5769 8341 17241 34396 9496 11090 na 8836 6948 8820 6085 7037 6061 2966 na 36690 43495 37177 42954 46573 49510 53690 47287 52917 na na na na na na na na na
PC 38:2 202521 206615 204590 192628 174080 265854 167501 222669 232049 161319 178532 133751 184680 185278 235078 211034 239643 170826 191762 172311 169010 234695 139680 159677 206520 228774 189840 206455 247780 238978 147496 177305 228785 188443 269092 231117 205874 214768 204962 176164 177894 216961 208697 196944 210389 198922 198254 177200 179183 na na na na na na na na na
PC 38:4 295353 263115 403552 309888 360920 409172 374877 383548 279719 268824 378081 261654 291940 356924 355989 482357 475026 321886 310169 270840 378519 305052 214320 330165 348547 324510 323370 254812 370786 370629 272994 225575 298453 317066 407246 222814 370442 240459 228952 236417 228609 231886 241252 294306 261389 254388 298192 214474 295088 na na na na na na na na na
PC 38:4 Isomer A 8967499 9013172 9005467 10673080 9294303 10805248 8100088 10200066 10922509 9530007 10968392 7291117 10048966 9587837 12405464 9178481 10362568 9248325 9782446 8866030 11663873 12274799 9943703 10260203 11009840 11965817 13087954 9768421 11025377 11604189 9632125 9179431 10029558 11289453 12201962 10779840 11882336 10898658 11542844 10776385 8686232 9291046 9479308 8966168 9448705 9658159 9746935 8412144 9625590 na 10531 7824 na na na 17371 16752 7444
PC 38:5 Isomer A 3521315 3274506 3461108 3362343 3526295 3223409 2878516 3170508 3027157 3020755 3586942 2428524 3098626 2311783 3951721 3752110 3433560 2343428 3064664 2514720 1376236 1439270 1289300 1251267 1193658 1254577 1336698 1114399 1300816 1597104 1076165 1126894 1254389 1098982 1321467 1027957 1414059 1097126 1104030 1079688 1762550 1940060 2021478 2010903 2138238 2223760 2033519 1658638 1972044 na na na na na na 2756 na na
PC 38:5 Isomer B 876795 758558 707824 1219692 637455 1246665 535086 953314 854726 554837 753887 402486 605454 724791 844247 821275 806442 738109 652841 509766 1138265 905617 326085 792207 780428 1299241 1152806 468563 1132437 635072 344423 400842 492592 1043661 1298585 573382 846739 355673 620767 525010 688324 695600 751957 740107 755922 759520 729818 673381 687412 na na na na na na na na na
PC 40:4 139906 166861 129853 231270 122487 208103 135369 249671 183721 142638 195047 95283 120500 168172 187992 172101 200562 150164 141872 148763 443522 397523 211965 374375 334961 369600 378151 258308 476012 411131 217224 217486 230686 354163 410757 253984 395935 256261 250613 237268 175917 164277 180099 185921 203318 179797 164496 169939 184217 na na na na na na na na na
PC 40:5 404264 329445 298656 794597 244090 657087 192684 515862 449554 177000 408988 189262 282571 336647 429107 343459 469075 356133 330608 231137 802999 703867 246503 580709 538750 855906 783976 242783 778049 341442 195630 245041 296323 918432 851800 350621 497544 201529 441123 412013 243873 252145 265649 283502 261742 240172 262158 221341 269452 na na na na na na na na na
PC 40:5 Isomer A 329892 423426 416144 343300 458713 344769 398440 354962 291405 372678 415665 346561 380588 425614 394852 444462 403725 281715 381889 384492 337230 379890 374563 343831 302919 347629 307657 307190 404662 453250 318929 385538 343002 290382 337504 273434 407046 327738 256670 302913 402926 393028 378066 376668 388189 374881 407111 346577 386246 na na na na na na na na na
PC 40:6 5096632 4600006 3893093 7305907 4440944 8649124 4098078 5769247 7694076 3817348 6329935 3525608 5544533 5999612 8726067 5734154 8063676 5035955 5180004 4166040 6790115 5794150 4376328 5142114 5595708 6455486 6472775 4355263 7022106 5433312 4020845 4068026 4906931 7105917 6274659 5169356 5659330 4383381 6734318 4860844 5300059 5161404 4963519 5592631 4890523 4802643 5465264 4532663 5063873 185227 171757 186534 181880 198222 83239 149401 175079 178809
PC 40:6 Isomer A 166534 195691 156965 218586 209115 221479 161890 198625 174588 170298 190762 90442 132602 98496 224860 178593 186864 117846 150173 118019 85999 110517 85740 84993 59595 96822 129406 56338 84993 100193 27013 42868 50877 55072 57296 52790 76246 44989 54302 50173 91494 114446 103991 118938 107533 105559 94477 89283 108603 2143 4030 5885 12200 3771 na 7405 7557 2948
PC 40:7 745036 667095 669761 881950 841777 1044859 497997 575369 751289 559543 735420 476725 626026 503625 1061666 977853 875273 420339 649352 370840 177969 145811 91133 112389 105909 162648 157335 93623 130084 122805 58933 102748 90004 143337 177566 110139 163200 80796 125190 109487 344265 351891 346703 356458 370778 383481 351760 330269 340958 na na na na na na na na na
PC 40:8 313626 320515 279442 667558 426254 583355 300045 455538 514847 375084 470455 166168 321562 295929 567165 366431 433531 336125 321065 220333 412733 383432 192909 279066 333826 395799 434723 239875 339809 315407 277395 188514 277733 291200 407303 318559 407073 260738 329973 259406 281580 322708 300241 288882 308776 273423 329462 277295 318212 na na na na na na na na na
PC O-16:0_20:4 448661 594180 566766 508384 428917 525320 455448 658618 555145 479338 536892 421839 705294 632842 367464 606136 633177 711445 614732 554454 410330 533267 319509 343710 410877 310497 397041 377103 549884 537188 458062 416564 401436 411749 488418 407340 472952 398072 394248 358792 443024 535022 418509 486519 502292 504267 508100 450651 490798 na na na na na 6209 na na na
PC O-16:1_18:2 na 6524 6075 3317 na 7057 na 10290 5060 na 3192 3381 10133 3715 3411 na 6924 8627 7190 4223 2515 13686 4618 3333 3509 na 3314 7278 9779 9401 12777 8308 4817 na na 4057 4974 5351 4813 3546 7114 7311 3288 8688 6854 13508 11908 6472 9262 na na na na na na na na na
PC O-18:1_20:4 231635 284163 274412 239728 261491 245937 318886 315719 299582 242680 272465 222942 338976 315435 220750 356417 369044 350732 324607 253129 233442 259986 195815 207103 223599 181873 210360 200584 415332 299309 251319 285647 274230 240656 266881 242492 247886 225889 273408 226070 293821 274016 226761 234860 243094 239014 236337 237915 251084 80321 88253 85506 93407 85758 66213 80551 76036 86742
PC O-38:4 71988 100505 94837 104744 80373 104064 88123 120447 112820 86579 83691 69889 111191 123671 85274 89064 113092 147766 107581 100700 157920 143000 133319 105439 127432 122025 124127 141797 162212 176451 130440 143102 127408 131355 134596 128333 138865 128866 131949 108313 101871 106579 117814 100854 113864 112146 108104 107121 102273 na na na na na na na na na
PC O-40:5 3570 na na na na na na 6434 na 3239 4584 na 2535 4125 na 3383 7717 9999 3339 6383 6131 5044 8694 2840 6239 3084 2462 na 2979 na 3248 5489 3138 na 2797 na 5790 7546 4611 na na 5552 9083 3323 na 7254 4325 7117 4952 na na na na na na na na na
PC O-40:7 11677 38073 25439 31484 24803 25961 9504 38453 38795 10361 32881 8432 29153 47134 21155 23983 28482 49258 45843 17263 24143 27568 6884 9089 9852 8642 14959 6137 47904 12727 na na 5706 7388 20779 5784 12596 6726 23717 10335 30926 17837 15627 15151 31806 20564 27598 19383 20160 na na na na na na na na na
PC P-32:0 or PC O-32:1 na na 3648 na na 2702 na 4841 na 5533 7419 4906 na na na 4901 4233 5455 3366 8881 na 4498 na na na na na na na 3553 na na na na na na na na na 3953 na na na 5998 na na na 2709 na na na na na na na na na na
PC P-34:0 or PC O-34:1 177943 219867 180813 203131 201539 196537 180160 282240 224416 184550 229903 146574 237460 266722 163665 185776 270066 352049 211512 219441 253026 269558 204697 179010 215040 163028 165439 166669 259772 217034 155763 200861 206746 196280 220466 166406 200730 176501 200962 144120 168650 196967 204952 184964 187833 186014 187727 166245 198245 na na na na na na na na na
PC P-34:1 or PC O-34:2 Isomer A 5620 33756 6831 7423 14637 12590 16436 28841 11497 16151 24055 21476 29020 25859 10339 16129 16721 32983 20588 27545 10336 26568 11930 20566 19066 10360 10778 9853 21012 31559 13949 8179 27653 15057 16905 19293 21842 16263 8287 17721 33907 26767 42717 23275 31559 37681 37988 27171 38313 na na na na na na na na na
PC P-38:4 or PC O-38:5 Isomer A 367773 438929 426496 393233 393501 423521 382334 482974 418196 386742 461710 339397 553678 528502 319647 483488 483558 594038 465451 458671 389582 447490 347795 338475 369653 307629 357909 355220 503638 452252 416563 415944 376520 336559 446683 335467 428044 417500 375234 361195 365946 388878 356950 385480 405206 380620 376850 371030 404198 na na na na na 21955 na na na
PC P-38:5 or PC O-38:6 41136 39110 46437 46890 22807 59937 28051 68528 56324 49285 71404 22379 63702 72415 28586 38087 51070 87867 65380 40970 54882 46434 17634 27898 26818 30584 19069 25961 26709 29990 23090 21708 17846 34437 32593 19306 51947 21530 20922 16821 33811 53906 29617 31033 28597 58020 43176 51044 51428 na na na na na na na na na
PC P-40:1 or PC O-40:2 na 4738 4847 4240 2386 2720 5089 12682 11491 4434 na na 2633 8205 2445 na 5319 9486 4148 3011 3816 15121 3205 3374 4657 na na 3248 9687 6664 na na 6032 4610 9279 3237 3137 2853 na na 5033 3379 5444 8473 10660 9208 8283 13683 9754 na na na na na na na na na
PE 34:1 14797 5105 20627 17542 21111 31006 17730 7798 16861 5548 32228 60365 49422 53600 48021 81314 53450 12340 9610 54245 9222 4427 5891 9577 14762 16874 5144 21772 10658 18168 44238 25044 39557 53912 48434 63892 72541 43784 76767 37339 19317 8267 28125 5289 17559 38608 14207 21656 7799 na na na na na na na na na
PE 34:2 166877 99600 190677 237776 234847 203588 199283 153808 192170 155094 269445 360046 282372 393119 381066 532165 498602 95277 230293 340766 212344 193482 152170 163404 197738 287893 270714 478796 318668 389691 395874 166861 357003 270891 345128 540286 593460 429618 516969 216362 295907 311644 281264 262661 263800 346623 272325 261572 285859 na na na na na na na na na
PE 36:2 256581 177278 280723 421359 368779 670423 285756 283156 465684 244226 538220 745361 818680 933706 1073509 895385 1241758 189900 454852 649979 577728 404955 358803 539570 681682 1018354 637964 1434715 748920 904787 1191345 633070 1345506 1319715 1358196 1831051 2090351 1306888 2360602 912198 686958 665779 701499 710997 691449 631780 714249 593635 669820 4670 na na na 8001 3535 3098 3876 na
PE 36:3 50013 31750 49274 113152 98647 128184 81031 42489 110867 35995 92234 177368 167833 214564 180182 213364 272922 24026 80338 173633 69324 37517 38125 70711 139298 188991 69948 234053 117697 129084 286734 148736 323040 332769 371292 453015 569135 338317 606048 263908 161036 141391 157880 140738 149465 183352 158150 118834 140835 na na na na na na na na na
PE 36:4 326636 157943 268339 472727 363368 356866 275375 245167 346902 230409 480215 314055 337877 374833 598137 654799 553689 167112 305442 325893 365356 231666 195285 207952 221698 360385 406260 431300 397762 363369 275918 224307 246326 249618 286501 339859 470770 302274 396343 203134 229890 236990 231590 250698 223151 246265 244080 218661 252179 na na na na na na na na na
PE 38:2 na na na na na 2422 na na na 2641 na na 3643 6573 6554 10048 10334 na na 2562 3347 na na na na na na 2440 2481 na 6816 na 7971 4606 7760 8639 20978 8118 14515 8061 3948 na na 4076 na 6817 2487 4050 na na na na na na na na na na
PE 38:4 4089 1466 4779 28442 10633 5302 na 4038 na 3650 15368 23447 24654 62500 31494 23352 23345 na na 4287 34281 6378 22956 47687 40323 28531 44408 32194 51209 18482 19514 3715 29271 35164 35745 9574 33627 27470 9428 6794 15263 6887 4094 13435 10651 10020 10563 11434 4623 na na na na na na na na na
PE 38:4 Isomer A 21665 44259 13577 16700 21828 24654 21435 20598 15517 8902 34474 8952 45145 14589 39961 60921 31031 22983 24603 5647 34358 12989 17559 50756 19785 29076 16164 16081 29485 12267 7375 20816 24930 19754 4239 22849 15863 8112 19038 27412 7315 15364 13336 17918 18697 15301 13801 6609 22154 na 7541 6628 na na na na na na
PE 38:4 Isomer B 771371 441111 610135 1232559 989449 1121957 738770 690821 888584 638931 1694490 957745 1174857 1401323 1784979 1766058 1946278 489462 953494 897336 1497380 859817 904221 1094406 971243 1575847 1828717 1859597 1596517 1297816 1433737 960110 1174616 1296133 1149887 1679153 1998529 1419999 1771399 1186103 844576 853028 922860 850594 820903 882499 855465 793543 924393 na na na na na na na na na
PE 38:5 Isomer A 169124 99031 172197 250986 285701 196562 160960 124466 175406 138270 297624 188621 184247 194088 370597 444689 356411 86410 190301 144302 171725 109547 75745 108962 92434 174573 148499 186799 164434 171810 143894 106387 147550 163828 207749 225855 288609 183419 196067 112475 126056 136025 117646 101680 133504 124343 133909 113710 132695 na na na na na na na na na
PE 38:5 Isomer B 16691 3517 10646 66847 32698 57622 13595 19445 25526 12950 35770 23593 32965 50535 50585 70605 63791 na 16130 22654 69263 21516 9661 36254 40952 67067 79436 37277 83785 22058 26460 24052 31987 48669 73476 40137 71225 16233 55122 29360 46919 48743 36768 46462 32617 28592 47535 36130 38490 na na na na na na na na na
PE 38:6 432661 205037 269013 698769 456036 524623 310275 232504 488872 201117 777240 359025 424055 533554 1002124 862265 858860 218290 489695 317840 644857 355751 289115 313076 291321 583918 638395 571019 831631 380452 291835 277176 313625 322244 359527 407481 466445 327154 439703 210761 313814 324029 339604 330511 319621 314329 288264 308718 293634 52619 54698 51325 70085 58190 18732 59814 54888 44334
PE 38:6 | PE 18:2_20:4 na na na na na na na 6681 na 3110 na na na na na na 3547 na na na na na na na 2988 na na 12072 4119 na 19282 na 4380 na 8996 na 23211 75156 12091 12474 3886 na na na na na na na 6188 na na na na na na na na na
PE 40:5 10010 4376 4716 27503 21617 20840 23427 7450 15709 10733 76269 21620 28058 38160 62407 58149 49357 5173 18810 14526 50376 8000 18261 33557 14911 21097 38069 62897 34598 30664 32100 14123 30741 11694 13630 12299 45850 30150 8331 5726 12709 13010 17180 5764 15696 26389 17298 10759 15497 na na na na na na na na na
PE 40:6 11886 9432 17115 18623 7594 22774 9671 14780 40384 24738 15315 8715 10789 15858 55655 37315 12150 10771 8103 5689 27119 15181 6108 12415 5272 na na 15925 19432 na 13355 9210 18134 14289 13875 9090 7575 5489 9087 11871 8671 27602 10064 14366 7895 20071 5835 5626 6262 na na na na na na na na na
PE O-16:1_18:1 25031 19002 14659 24505 18021 14047 18705 32898 24435 12154 30700 17527 30374 40584 23512 28556 24869 28497 16299 42897 29449 38916 9980 17140 29254 14974 9378 11753 36437 16403 22441 31461 44123 21154 48025 46242 49576 21653 19649 26119 30800 28884 27409 28447 29221 34831 20928 32132 19581 na na na na na na na na na
PE O-16:1_18:2 11531 3877 3434 2778 7735 2180 3880 7136 9682 8195 5963 3456 3376 5888 7647 na 5046 3339 4315 14679 na 13517 na 9377 6115 3858 na 3669 3556 8354 3972 5054 7691 4064 12517 3474 12077 12821 3987 6358 17155 17119 15407 9632 11749 4781 12860 8838 4245 na na na na na na na na na
PE O-16:1_22:3 47758 45189 33226 40072 41322 31285 34539 70531 72049 52767 51416 45702 56052 57053 35862 67230 61826 55806 64167 78992 127276 225966 184409 134818 175194 120062 97658 121134 189329 190159 188166 322178 267231 150181 253961 208115 300658 190688 229601 182902 119855 125341 118041 116345 113419 107568 119457 108143 106863 na na na na na 10896 na na na
PE O-17:1_18:2 25230 7941 22393 91098 17258 73592 13922 22925 69069 15522 48444 3046 30296 na 92204 77849 103110 2871 8500 3217 16099 5602 11597 7939 12624 34422 21981 23102 48970 13763 8783 3853 5171 49709 25017 34246 21421 18225 49054 7967 34209 31400 36107 34822 29589 19795 29892 29886 32680 na na na na na na na na na
PE O-18:1_16:0 3907 na 5962 22376 2879 10421 na 5723 10370 na 15037 3290 24205 1705 24028 20645 35255 na na 3592 2760 na 2815 17486 27671 3341 12588 6070 4016 9195 4069 4155 8851 6818 5911 10527 14676 4421 6903 4325 1492 na 9091 5017 9016 1506 2795 2273 na na na na na na na na na na
PE O-18:1_22:6 107588 136424 99620 157384 116604 143277 91502 153865 166239 103846 158653 109660 165457 201176 146228 128812 164939 156262 160007 144602 233929 269241 123824 150521 187955 169995 158578 121177 241351 139719 191199 217184 221451 179066 266106 200579 263071 190711 273272 246443 184385 202005 202017 200719 174377 171487 195849 176464 174423 na na na na na na na 2784 3196
PE O-22:6_16:1 159136 162504 172171 186733 132816 161174 150421 211198 213123 143209 223242 128469 228127 216678 157366 206425 238508 240029 189441 188339 197280 223323 102620 109993 133312 149466 132465 100309 217815 173087 163944 150657 159104 161225 203696 184751 184426 126068 174529 162043 188982 213209 197102 211978 228544 219565 233128 219804 223951 na na na na na na na na na
PE O-36:3 15091 10048 20726 87966 10412 71921 4656 23091 66257 13484 43019 5276 22357 8025 93731 82651 83187 4788 17773 5104 17202 14307 6798 4238 24292 48942 45650 14871 39014 10658 12083 4495 9588 45014 20408 27920 39500 15523 43976 11308 22087 25167 29588 41458 24701 28399 28328 31592 29673 na na na na na na na na na
PE O-36:4 40904 43374 57547 141173 33277 88936 39799 55224 103101 45230 70581 20005 55997 39584 137873 105691 110494 39435 60553 28526 65097 46935 40535 27980 37285 78196 68688 63688 89141 60011 45124 24437 32902 60102 44994 60774 49241 41785 50553 32964 70594 73143 68497 72441 73825 64419 76850 77531 63335 na na na na na na na na na
PE O-38:5 93235 102420 77887 80359 92670 78996 86673 110187 84863 84970 91194 74313 102054 116555 56173 86571 89569 120151 95279 102118 128158 149908 69771 87946 104134 79549 73986 71843 118740 117615 108025 124124 104823 97526 118444 92337 105329 85849 73926 98058 94239 91881 85965 99620 80144 84047 86254 74405 83958 na na na na na na na na na
PE O-38:6 201661 206513 160831 190679 173916 185859 166028 259367 223135 173068 243275 172443 244042 269065 162434 227306 242048 244936 203224 261310 185232 211693 110395 125252 145928 116066 121144 144679 223673 170568 160966 187668 203999 153444 240939 197129 225563 186903 181380 178269 195483 210601 191339 186295 182724 168766 188597 199457 189457 na na na na na na na na na
PE O-38:7 na 4070 na na 3614 na na 9273 na na na na na 9983 5314 6338 6791 10414 4689 4650 na 15734 na 5316 3902 na 6406 5092 5108 4061 3415 na na 5111 7158 na 6163 na 7918 na 7753 6012 12635 11145 15178 na 4704 9259 na na na na na na na na na na
PE O-40:4 34941 25722 38016 27588 27945 26778 23779 59198 29166 21930 47693 25911 39038 74115 30824 40796 52967 58004 42501 54578 99314 149624 137394 98105 113251 90333 63620 70523 119448 133291 119399 252234 197028 103809 195521 147341 224842 134988 189335 157980 96622 99235 95032 111773 84778 87707 75647 85512 102014 na na na na na 33904 na na na
PE O-40:5 63743 91560 47697 67601 47489 64846 61607 90636 81114 62578 75470 39586 68411 104832 53892 84940 85568 81048 73136 87251 151523 188930 106389 108850 128334 104939 85736 92423 157663 136796 147418 207202 168294 125850 187474 136765 198005 121125 165525 143062 109447 98398 110023 88255 117917 115536 93715 97489 93529 5294 na na na na na na na na
PE O-40:6 4380 5553 3875 6414 na 5588 na 8075 na na 2278 na na 11690 na na na 6013 4254 6231 16210 23331 6797 10671 8493 17101 13601 na 45037 3549 3172 15279 14864 38569 41451 10907 18288 3730 18649 33687 11228 5114 14430 4430 6121 8060 3504 7705 6892 na na na na na na na na na
PE O-40:8 78379 119484 69516 93058 70389 91209 73429 127272 121022 54276 136949 47727 119343 134509 99345 113476 128171 139956 102102 93146 79947 95936 28851 29909 34781 66585 43712 54180 110974 54977 31352 50982 67034 32258 95588 94796 67791 46450 96913 102087 100264 115272 96052 74886 96649 64873 94908 75311 88478 na na na na na na na na na
PE P-36:1 or PE O-36:2 7621 12940 9004 14868 9028 10212 9294 20681 24424 11812 11875 7465 16888 25957 5864 11247 14242 15464 8109 18898 32343 47055 24500 8646 21329 14359 14784 19755 39896 25054 31698 55963 31504 14648 43350 20199 45996 31688 36964 14968 19633 23669 23561 22958 19227 22310 20136 22020 31105 na na na na na na na na na
PE P-38:2 or PE O-38:3 na na 2250 5262 na na na 4499 4111 na 4051 na 4713 7357 na na 5252 3690 na na 4747 8882 na na 7630 na na na 4721 10408 5286 6793 5732 na 6090 na 6197 na na 9408 na na 4808 10653 3610 7689 6039 3332 3429 na na na na na na na na na
PE P-38:4 or PE O-38:5 257964 275134 227424 362582 222140 274222 242529 361681 360010 281133 307132 225889 349071 451826 261634 315012 352067 333843 302596 364582 431783 514594 357214 368874 439609 394151 355883 343860 535163 470434 477281 607696 470571 382380 584497 471104 627086 458922 516866 434997 351446 331444 354978 344996 324075 355577 332285 309563 334511 na na na na na na na na na
PE P-40:4 or PE O-40:5 91809 79594 73248 107358 66859 77782 55293 100375 110101 94870 95639 71027 100127 158823 99789 93424 107266 103720 89339 93943 109522 146866 78239 82954 88065 87220 74717 84223 156962 114654 130163 154016 119245 98465 149681 104732 159911 106601 139340 120601 109279 105723 107199 88237 98087 91709 90242 94478 91584 na na na na na na na na na
PE-Cer 20:0;2O/22:2 na 3401 4529 4386 na na na 14001 8573 4332 8947 na na 18975 4136 4100 na 14977 7106 6700 na 3649 6429 na 4133 3293 na na 4779 na na 9930 na 3011 na na na na na na na 5239 4030 4589 5346 na 4577 6473 na na na na na na 5194 na na na
PE-Cer 34:1;2O na 8804 4024 5499 11465 na 9044 21856 18750 5130 12676 na 17744 23960 na 11928 18525 38979 5545 7920 27316 32817 na na 10680 11731 15038 5595 46834 15511 11039 16884 18390 10474 14194 16211 9002 14910 20625 na 8883 21467 8298 14617 19819 18144 13632 13818 16866 6683 6635 9298 na 12714 10258 10808 9722 na
PEtOH 38:4 23935 21369 26599 21342 10913 41219 46479 28708 28715 39337 12924 62179 21197 63326 23130 38151 39459 37809 28426 48509 11568 13334 12153 13699 9992 na 9506 17034 23106 28705 29206 28711 28174 25058 21953 18727 33277 14360 34214 28492 36497 24502 25399 35070 13871 21638 15257 33596 29503 7430 na na 5003 8439 na 10386 4777 3934
PG 16:0_16:0 na na na na na 5536 na na na na na na 16364 24838 na na 8402 na na na na na na na na na na 6553 na na na na 9177 6769 7375 na 44191 5740 9950 na na na na na na 7627 na na na na na na na na na na na na
PG 36:2 4779 na 3177 12788 6691 19677 8751 7976 6716 na 8343 8592 19924 19764 31180 21577 29415 na 5295 4395 19570 3529 5746 8523 13520 26842 5759 43293 23321 22771 17084 12660 58521 33341 52825 46920 81372 19755 67152 16511 6845 9519 8344 na na 11954 13249 10547 7169 na na na na na 9026 na na na
PGE2 2323 na na 2435 2737 2986 4666 45596 4308 na 2629 3219 3772 na na 2880 na na 4308 10603 2349 na na na 3041 na na na na na 2448 na na 3496 na na 4112 3687 na na 40971 na na na na na na 1945 2516 na 4596 na na 2518 na 7730 3633 3471
Phenylalanine 421511 303187 878037 801558 407310 398313 336539 358446 335170 534467 391850 866443 986897 931176 494798 350593 358854 310910 381755 399313 453030 435238 867823 691835 564525 333916 301884 280265 389124 292222 517045 611257 1142908 645707 394761 343486 342206 259366 390592 304740 557269 578486 603751 551821 582945 617963 525633 656742 532085 9229 16589 8902 8287 na 9292 24023 36481 12827
Phosphatidylethanolamine alkenyl 16:0-20:4 215326 221401 210686 225106 196263 234527 173011 271119 251609 205211 283659 175795 262552 315256 158659 292464 262077 288155 223839 283618 227125 280368 158695 180435 207801 165418 172859 178223 322981 246736 226233 251205 233946 201801 291838 239641 280235 218792 241301 220043 219152 241381 210003 230762 219691 224984 230230 230358 230832 na na na na na na na na na
Phosphatidylethanolamine alkenyl 18:0-18:2 28402 23793 24268 37517 14546 20234 18369 22126 33607 23392 25604 34316 28917 37384 15271 39733 34576 33410 22396 43280 46322 78751 36258 33170 43831 37958 26207 29772 68111 55836 58761 73875 65320 32232 65587 51836 70478 53337 48934 42719 49380 45712 50237 48333 57068 46005 47927 48459 47261 na na na na na na na na na
PI 16:0_16:0 22189 14244 42597 28650 na 9338 na 26591 33507 4867 na 16279 17345 13510 10734 18847 26187 na 5853 na na 3359 na na na na na na 4942 na na na na na na na na na na na 17637 4577 10229 na 6312 29194 12415 8687 8464 na na na na na na na na na
PI 18:0_20:2 43946 36287 37034 24936 16960 63214 9784 29193 61073 18171 na 12462 32147 18032 26220 15957 43470 16776 9010 na na 31115 6429 na 7146 8241 11505 8213 23938 na na na 18117 na 12429 na 10861 15093 na na 22182 37337 22202 13588 17773 40142 21247 35288 14547 na na na na na na na na na
PI 18:0_22:5 442094 601570 394023 705761 354789 700544 347953 800691 649957 401203 585621 295615 422592 561818 851909 510873 616392 420520 472992 282870 335721 367591 298789 222695 189938 238121 291320 112963 416332 88590 132857 278041 274382 344703 346800 144044 409068 149746 173872 112173 360241 447260 415380 441873 393845 438853 384759 344171 408479 na na na na na na na na na
PI 18:1_18:1; 1,2-Dioleoyl-sn-glycero-3-phospho-(1'-myo-inositol) 574501 739794 673436 987044 596212 798139 570043 883641 914277 552334 616784 645386 888529 982088 763269 851814 1125490 837983 699279 591407 501123 633972 670925 428413 495734 533408 469913 458473 767623 457642 783158 662389 1017232 759593 845612 539690 1124454 724639 999523 604147 1038033 1061477 1200018 1164339 1114769 1058822 1166213 975708 1001850 na na na na na na 4408 6501 na
PI 18:1_22:4 246295 204016 191105 295141 125619 308802 95243 223609 328405 112674 148215 113498 190345 220791 310460 243188 317253 168629 189261 76048 83988 154284 81825 49452 61293 112448 115126 34201 146449 16044 58302 90158 82359 106810 136130 51398 142226 36565 69371 47838 147875 141345 160543 145565 146374 131374 132458 133730 136718 na na na na na na na na na
PI 18:1_22:6 12566 7107 7289 44214 10195 23867 4072 8828 18181 na 5051 7337 16345 4947 29929 12115 20360 6922 4007 na na na na na 2145 na na na na na na na na na na na na na na na 9406 3955 3599 3907 4807 2384 6807 na 8558 na na na na na na na na na
PI 32:1 43291 14199 53413 22771 10745 28690 17392 28108 27110 9598 4870 17414 28688 20101 11229 20417 20967 7511 16287 8383 na na na na na na na na na na na na na na na na 2611 na na na 6417 7202 10093 9278 9796 9495 9857 9128 7121 na na na na na na na na na
PI 34:1 17349 12323 36636 31776 6563 10140 3811 21917 18849 2834 9574 14513 13208 7495 12780 10524 18902 12121 18655 12020 3725 10161 8743 4005 6438 12164 5478 5974 15933 8482 7103 15894 21830 13891 28096 21405 33373 16233 22974 15265 36589 18629 14930 19861 27193 56694 22146 31281 25724 na na na na na na na na na
PI 34:2 Isomer A 92250 91576 70526 77405 87957 85160 89319 89599 85507 63838 83618 63674 87147 94003 90518 95632 108379 59000 104053 100976 66090 98982 44695 28648 61732 64290 73413 64583 95925 77086 91640 95338 43388 42846 84257 79772 122588 77083 84187 68009 118444 89886 127461 132949 137899 219308 110620 100043 107552 na na na na na na na na na
PI 34:2 Isomer B 422913 530357 453002 538623 447772 399947 411965 485337 577066 464739 378328 435383 555542 605905 456272 609621 576380 370508 597754 500148 401851 429367 506108 285852 354784 350189 305027 326001 562353 406028 547769 493980 674287 449632 475242 446055 647202 416621 476705 386738 718293 825547 777377 704267 652636 1514257 684761 719265 707704 na na na na 4016 na 735 na na
PI 36:1 36056 13283 32471 34315 11331 47080 35763 38347 33557 13016 23126 9039 24862 29425 15634 19602 33613 26860 29273 21670 45759 38782 84487 42714 75468 19719 25351 53437 72648 58680 147919 105586 168926 111785 127380 60444 164255 128605 212184 108982 71718 87318 76014 63812 76046 97563 82745 70469 89111 na 10646 na na na na na na na
PI 36:3 178160 186337 179238 262686 227544 237085 181291 213926 209626 195861 141847 152083 195582 226258 215655 231339 264893 174307 196587 191370 137816 175112 164253 109128 190351 177002 96180 162377 200561 170408 296143 211211 363093 285770 301026 204482 341025 288488 333266 239024 271155 317322 305095 277211 270182 425429 273766 248997 282012 na na na na na na na na na
PI 36:4 347027 385471 398590 507783 378221 473401 402892 530212 472539 341342 474952 285956 409153 461369 459458 435419 591655 462091 579358 512921 282376 388410 262075 213588 256085 274689 354073 276659 388812 429557 429914 358951 520758 367017 389897 378448 492762 403079 409161 396902 412746 435399 461943 453616 539778 387776 400333 355208 409066 na na na na na na na na na
PI 36:5 4063 4410 2698 5208 na 3376 na 7805 4049 na 2995 3049 na na na 4287 4767 3269 3903 2822 na na na na na na na na 2676 na na na na na na na na na na na 11205 4706 8427 10915 13043 9551 10097 13391 11876 na na na na na na na na na
PI 38:3 688238 494280 754887 588821 506812 697116 401714 614841 707114 434447 375534 473256 503796 439137 547505 639887 695485 453851 583514 377073 269530 610957 383382 317332 282839 510936 431932 435279 615468 283428 298214 362450 492103 331317 389640 328520 390392 400297 420137 234036 546242 631635 597441 597906 588069 595204 548016 504359 540011 na na na na na na na na na
PI 40:4 98951 71405 54798 81173 32180 72642 64967 78753 87272 34215 37674 54604 46443 67264 80738 85322 89118 40373 55297 39734 85024 148553 81905 89544 66654 119840 107850 43479 137148 16907 47991 80749 78532 84446 99944 32440 68679 42073 39891 54193 51614 78506 49239 56276 47503 59666 50757 45450 52083 na na na na na na na na na
PI 40:6 1252212 988570 980232 1518998 665094 1647355 389498 1046974 1655990 439033 616916 634443 1091174 1170656 1568959 1237918 1688226 775976 978945 317857 379648 677329 490729 260218 222378 603309 537393 195734 711921 76215 184743 449201 412572 534049 595057 217353 640735 159104 443719 220207 737988 790405 693730 659095 601204 606016 706850 681645 646829 27058 13759 10155 4159 14206 15488 12366 11856 8589
PI O-18:1_20:4 3733 12100 3862 4567 3147 9841 5269 11777 na 6947 7991 3600 8750 8451 na 18134 9935 6636 5249 4534 na 4057 3569 6118 8064 na 3795 3086 9973 5749 2872 na na 5057 7467 8957 9179 3399 4290 11374 11062 8310 3419 8821 11004 7688 6588 6889 3447 na na na na na na na na na
PS 16:0_22:4 7599 na 5603 4245 na 25641 4807 7881 12179 na 3879 na 12686 10411 4076 4947 na 4773 5743 8195 11956 3642 9765 6769 4090 7439 5099 7523 26541 na 11999 6319 38991 45416 45626 52715 28084 23684 11595 24760 15769 na 12138 6955 5637 6809 6868 9586 9258 na na na na na na na na na
PS 40:5 39037 36681 21926 71127 36659 49465 35427 28356 25046 32989 34409 11892 44613 37455 51007 56702 56506 13888 31791 30718 22889 25602 4334 11779 6373 23672 4056 17831 22385 23090 8033 8471 12632 21281 26943 10273 21043 7182 11394 14455 49560 47134 29874 48059 27170 59296 37997 36339 36294 18565 14113 6533 5449 14259 4342 19864 21677 13356
SM 16:0;2O/22:1 115008 92756 71621 74210 84991 73664 99992 131019 109470 96803 112947 80187 105297 111582 107035 103215 134940 108503 114448 114954 162365 179968 101562 128325 140623 148189 132036 135872 287126 261632 127471 195077 166307 153265 136099 137691 164859 144866 124336 129684 135948 110921 120261 113976 112572 111737 102790 106955 101627 na na na na na na na na na
SM 16:1;2O/16:0 110951 85184 66250 100675 82626 98675 95283 139079 147457 96867 127485 86331 134852 129864 104707 131482 101654 103808 134906 98814 54120 75692 42864 55621 58615 87177 63256 57226 127843 116311 74175 72219 82208 105844 71858 69324 73707 68310 73295 68309 75009 69879 78617 74357 73098 63242 60436 75022 69322 na na na na na na na na na
SM 18:0;2O/22:0 93876 71094 68760 75437 82145 61100 82070 87817 83229 66849 73647 47722 81619 78938 62061 96525 93887 79978 82350 74921 76754 99611 58684 65225 71336 78979 53599 54708 126745 108077 48011 87635 84665 58726 70496 70694 73739 61362 77461 65784 111195 107273 91687 99630 98582 80004 91861 86436 81893 na na na na na 5531 na na na
SM 20:0;2O/21:1 659685 707863 624482 653685 617536 627465 567681 777545 645328 563060 648292 496621 728313 726320 558183 673557 704527 816125 730440 689291 759423 880198 498739 519907 714515 572160 532849 545879 951160 772460 478058 615270 641721 541221 554454 544423 699879 523845 506166 514987 792912 796526 748555 839919 844358 755651 789195 755769 739949 na na na na na na na na na
SM 20:0;2O/22:3 456483 617516 444455 491187 453046 427608 514930 649609 524666 534084 454491 440542 566258 624699 454953 587951 646969 596258 601442 570006 387859 568607 285798 329148 374233 280447 297876 290614 560203 461839 258850 417767 383138 326391 319541 327928 384826 298937 334694 344887 623535 549624 535365 506380 485579 500307 504433 497999 480766 na na na na na na na na na
SM 22:1;2O/12:0 1908340 1945504 1670688 1605984 2075408 1664943 2258811 2336458 1949909 1971313 2060986 2044195 1846729 2432125 1378071 2212719 2357218 2554059 2117266 2070742 2005336 2589410 1867174 2272622 2164877 2245995 1807643 1988706 3373865 2828414 2080398 2753029 2580669 2641936 2129475 2402972 2213981 1978737 2368852 2242125 2656921 2290550 2162236 1940668 2099170 1968976 1819827 1968043 2008464 na na na na na na na na na
SM 22:1;2O/22:1 28568 43907 49946 22639 30652 17481 26804 45079 18921 23771 36312 23316 35128 41730 25258 40933 44299 29232 44585 39196 51218 73278 55282 39524 50563 36346 18328 22104 55404 57498 58178 51369 50390 43984 38108 54005 46303 52941 33687 17199 45545 31914 39370 38599 31931 46339 39965 36721 40376 na na na na na na na na na
SM 25:2;2O/18:0 12037 24750 38262 19840 14742 11966 18175 24627 15074 14449 27274 14147 24096 26142 13542 25433 23753 24491 25272 19030 27976 39021 12844 14009 36878 19224 13858 23546 37831 33886 24333 37118 21151 23329 25336 25835 31002 33832 20144 11287 28322 47891 41129 48043 36685 48161 37686 44347 36592 na na na na na na na na na
SM 34:2;3O 3789 2742 3414 4048 4676 5303 3840 11061 7644 3172 9343 4150 5951 8287 2681 11340 9214 9610 12740 7858 10214 5477 na na 4660 3781 na 3100 6555 4644 5419 4126 3178 3582 6895 na 5793 3988 5722 3709 8581 4239 8730 4279 3873 3732 9490 5602 6772 na na na na na na na na na
SM 39:0;3O 129329 108908 93221 110243 97622 88451 139951 126860 125681 99105 112221 89768 110036 115048 100109 134215 126379 143666 120052 124522 122741 140234 93294 89002 105640 103257 92751 96074 171240 149362 101223 104062 122679 99028 82879 99970 118857 78064 90135 76408 158306 149163 139383 151145 123575 121471 138292 115308 131603 na na na na na 10624 na na na
SM 42:1;3O 4150 5499 na na na na na 3249 7062 2839 2511 na 3996 na 5928 na na 10236 na 9397 6085 32483 7123 6659 4709 8386 6668 5718 6818 11299 5688 9535 5713 na 3806 12800 12649 7224 na 4448 4487 3187 10498 5614 7302 3700 13634 7683 9052 na na na na na na na na na
SM 42:2;2O 2318053 2819579 2135639 2502928 2041613 2847160 1870080 3245703 2791739 2349957 2650871 1944482 2816757 2975529 2581032 2191249 3182652 3098232 2837598 2719098 2124614 2622575 1529087 1451863 1937806 1541103 1307995 1574237 2182558 1581619 1194549 1637585 1599139 1543895 1840843 1627589 2007944 1278825 1497770 1345820 2049458 2356951 2211932 2217661 2141650 2254715 2013921 1986826 2172869 na na na na na na na na na
SM 42:5;2O 69736 101937 39564 83398 56822 86816 58071 115732 120725 46459 172763 107711 167534 179318 188134 161836 258515 118714 188827 256800 210594 179573 29948 113751 142958 128892 164508 98125 214496 155237 122866 123683 134092 312759 354609 207291 209224 168545 291696 287206 112058 100953 93693 117419 98905 94932 115875 72325 108028 na na na na na na na na na
SM d32:1 172804 155385 140463 168471 136652 197618 140493 259249 227786 165315 186356 132651 225763 222721 182751 172369 178814 235701 223752 189817 107805 141316 95623 92449 120563 151843 125653 106550 201695 205411 112557 108837 129701 166504 152803 146898 160821 142328 126155 102425 113883 127355 132162 116788 127990 130330 116940 128318 123144 na na na na na na na na na
SM d33:1 111163 128399 113222 113429 120746 116534 102538 160002 102173 111059 123101 91668 138409 121571 95839 134074 138466 169836 147592 129273 108277 147503 81331 110750 151549 137987 123844 114138 208788 200930 105299 94458 134642 146224 155083 117689 143536 132639 134869 136024 127465 129690 113151 108582 105115 116650 137762 121303 120254 na na na na na na na na na
SM d34:0 50287 80519 29056 53937 50467 36943 85435 89880 64005 81610 158276 56208 117083 105924 84908 54204 105163 230340 103220 115986 96407 76394 53255 63269 104121 78498 48132 60035 130606 116831 86277 100724 63651 144353 88843 98731 98454 80713 121502 131533 62872 58123 67787 66229 69559 75134 61623 76456 55956 na na na na na na na na na
SM d34:1 3312730 4013701 3362151 3147031 3699552 3249407 3322440 4705154 3459935 3385425 4098481 3357516 4091116 4748645 2952552 3709880 3734165 5533040 3858435 4361581 4262105 5547799 3683889 4196571 4670497 4188664 3548160 3848059 5199856 4982912 3756157 4262303 4104594 4638527 4342062 4244908 4510342 3935433 3825577 4050059 3747828 3957037 3750393 3678530 3867235 3892888 3874929 3600991 3714500 na na 5446 na na na na na na
SM d34:2 613867 697309 598091 693501 666379 744943 630266 1033009 771314 649858 781664 580825 852342 949365 509997 742057 830429 882948 854979 697637 679483 897861 584384 590989 827305 751007 678205 630257 1302690 977880 814307 802651 900882 857164 832379 729224 818074 687820 796139 642904 773821 711791 743608 730544 757106 715462 746352 732296 797678 na 2493 na na na na na na na
SM d36:0 na 5342 na 3958 na na na 4542 na 4326 21377 na 4495 14367 na na na 18991 na 12043 10177 4177 7339 3958 8993 7488 8525 na 18213 12963 9669 na 5365 12629 4828 18059 20131 14874 10119 27384 na na 4864 4069 na na na 3696 7793 na na na na na na na na na
SM d36:1 415988 441298 406277 294165 277487 419365 330765 648157 490749 407644 575725 354486 451185 578390 428225 376194 446858 622399 563655 596312 1050169 1155632 621337 660226 935712 783377 681983 836613 1129188 1173234 726904 751169 757152 869868 894184 749273 854209 854770 745850 762226 501483 501797 497326 500185 511559 551381 483047 469310 526251 na na na na na 5007 na na na
SM d36:2 176829 166921 162749 121572 158751 148487 170325 260209 184554 181126 207051 174761 259044 251634 157519 178489 219000 289560 267421 254290 303414 385166 203531 221367 328134 280598 272799 309313 443716 420010 246727 305670 358847 316325 335941 282308 308738 329348 303736 293761 234341 250197 234034 226204 226017 234242 198796 225319 224658 4831 na na na na na na na na
SM d38:1 136229 159805 125206 109810 117383 119218 122738 209305 136576 154660 161275 116927 155633 165494 153659 129416 138288 200250 187290 193185 260453 298881 183861 196166 237711 227174 176611 227576 324965 329534 179291 233663 193559 204747 223199 207836 249958 202629 174009 224021 151763 148619 170264 147274 164644 149641 170934 152678 142862 na na na na na na na na na
SM d38:2 52545 76725 49048 28664 45015 45630 41719 68256 44372 47721 67818 36014 65988 72781 64947 40952 73868 85943 77785 68113 48163 70949 32176 26166 51117 34481 33615 55881 69534 57860 38111 33819 42297 44675 53583 34435 61394 51978 50410 48371 43694 48440 49315 40168 39387 50688 39011 38874 41231 na na na na na na na na na
SM d39:1 20694 31345 30545 28030 23511 18962 6381 39116 27809 25168 21441 13144 25867 26204 20071 30823 24568 60114 50768 28939 32687 55172 22324 22776 40939 32952 24548 30334 62132 57456 22296 27440 39508 32972 30731 38454 35836 15975 22619 30303 29994 50150 50946 44400 41716 41970 37518 44317 27966 na na na na na 111239 na na na
SM d39:2 247617 218382 205148 184536 187605 156658 256622 249100 250199 205092 228153 190927 256527 235658 261135 276025 378114 275116 334433 225033 147919 188900 132782 105971 140856 117497 115489 114359 241048 185312 117788 200511 172507 125866 127976 133406 144195 127034 120621 138179 202769 173106 180879 178649 166824 176613 152076 174573 149718 na na na na na na na na na
SM d40:0 95747 95230 74095 76535 64124 78034 80623 117936 88453 99675 103230 54297 95470 94298 84919 78869 69418 120092 94133 111786 100409 141026 76882 83253 105261 89336 64765 98428 142442 117167 60278 91367 85477 76438 84874 93630 105364 100593 88645 81151 90773 85100 86561 64776 100578 94494 98393 84478 70677 na na na na na na na na na
SM d40:1 831071 832330 707399 702023 652100 727064 666747 1126423 832401 824556 795750 645036 851353 812728 764239 679306 760886 911697 816477 923045 853614 1019720 728001 737875 904871 768260 657020 772248 1087077 959841 599833 826584 779733 705811 743234 743812 891995 685157 633287 638742 717686 762280 753880 753008 796845 744518 807296 738613 754857 na na na na na na na 4116 na
SM d40:2 Isomer A 321718 368480 322558 291915 290184 252778 309413 382702 337032 331574 347711 291216 387942 353972 359377 356056 477245 480726 459204 431703 249198 326620 231541 180851 227184 223466 180101 197317 292297 265806 191821 254643 241169 167034 207071 190210 245321 218793 175393 205525 259171 259566 255780 268387 273018 256607 275017 236539 247396 na na na na na 7270 na na na
SM d40:3 39650 35505 31690 12454 31976 20172 29305 41769 17662 39151 28730 20970 42321 46181 35540 36581 24100 46145 49990 54696 36348 38637 27591 18450 23689 6248 17284 15796 22160 23876 13467 25258 25539 8047 13303 11403 30687 28941 6692 16950 25308 18223 29496 24641 39599 38022 36466 35683 33995 na na na na na na na na na
SM d41:2 153056 151969 131753 157871 155303 124732 136814 195499 138919 153233 151705 112436 173973 150785 113749 156180 170578 188951 141727 159057 126750 159575 107201 98398 147000 128260 119550 109577 200347 169676 131311 149921 121434 115065 130657 123625 149577 124355 103762 99412 155439 169544 194528 190495 185963 198219 197576 148644 178285 na na na na na na na na na
SM d42:0 253738 278165 280038 281450 247729 237032 270269 345631 263486 249118 301385 214432 221858 282473 256699 296461 261656 324196 279041 296177 268254 332699 271187 227983 297274 227869 221870 204847 316498 310831 260049 234181 297097 225195 259099 245742 242003 248134 199511 197709 274561 261765 303289 302916 266545 278814 262464 237505 288937 na na na na na 25908 na na na
SM d42:3 592908 981849 651675 686550 671668 654557 645178 971681 678037 802721 699288 602452 816151 877378 652916 758644 800317 970248 832114 943048 599619 900501 454978 517298 574380 466806 449360 462088 695416 597783 410571 593000 499523 432877 531326 480112 631695 478955 436191 490358 716401 737786 783576 747390 770743 744335 824858 678469 701841 na na na na na na na na na
SM d43:1 72578 87714 98487 63195 68297 67641 62731 102024 55512 89032 78676 62702 66343 84769 55091 117202 94532 86484 58527 82553 100577 73234 62069 74028 118602 71191 61535 73898 128152 132655 98843 41571 63208 86986 75503 72644 81780 87532 66492 74498 71539 69950 69537 78183 75634 82083 81097 74998 71771 na na na na na na na na na
ST 27:1;O;S 2306386 2245190 2471444 2891256 1993031 2629379 1845715 2236881 2172521 1712239 2052959 2229316 3109395 2712382 2303827 2677039 3167055 2580563 2215214 2419333 1774069 2019139 1746794 1504156 1893621 1761459 1399044 1623004 2044857 1977742 2124034 1982336 2846607 2506695 2817821 2524660 3130953 2168542 2501378 2242636 2573370 2707618 2699033 2501952 2563935 2707512 2602523 2729044 2525347 215602 321741 286345 225438 232311 219345 298053 319986 330639
ST 29:2;O;S na na na na na 3895 na na na na na na na na 3084 na na na na na na na na na na na na na 3278 na na na na na na na na na na na 2371 3975 na 3542 na 2776 na 2031 na na na na na na na na na na
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name Species InChI Key Class m/z RT
13-HODE [M-H]- HNICUWMFWZBIFP-KDFHGORWSA-N HODE 295.2277 0.29
13-KODE [M-H]- JHXAZBBVQSRKJR-WWYDAZRDSA-N KODE 293.2123 0.29
15-oxo-5Z,8Z,11Z,13E-eicosatetraenoic acid [M-H]- YGJTUEISKATQSM-UHFFFAOYSA-N HETE 317.2121 0.27
15-PAHSA [M-H]- ZQDGXHWECRKADH-UHFFFAOYSA-N FAHFA 537.4885 1.06
2-OAHSA [M-H]- XHLKZBFZGPVOIC-UHFFFAOYSA-N FAHFA 563.5046 1.06
3-hydroxymyristic acid [M-H]- ATRNZOYKSNPPBF-UHFFFAOYSA-N Oxidized FA 243.1967 0.26
4-Hydroxy-5E,7Z,10Z,13Z,16Z,19Z-docosahexaenoic acid [M-H]- IFRKCNPQVIJFAQ-UHFFFAOYSA-N Docosanoids 343.2279 0.28
5-hydroxy-6E,8Z,11Z,14Z-eicosatetraenoic acid [M-H]- KGIJOOYOSFUGPC-UHFFFAOYSA-N HETE 319.2275 0.29
8,15-DiHETE [M-H]- NNPWRKSGORGTIM-HCCKYKKOSA-N HETE 335.2234 0.24
Cer [NS] d34:1 [M+Hac-H]- YDNKGFDKKRUKPY-UHFFFAOYSA-N Cer 596.5266 2.31
Cer [NS] d38:1 [M+Hac-H]- XWBWIAOWSABHFI-UHFFFAOYSA-N Cer 652.5885 2.79
Cer [NS] d40:2 [M+Hac-H]- AWTNSRHUZXWBCO-UHFFFAOYSA-N Cer 678.6050 2.80
Cer [NS] d42:2 [M+Hac-H]- FUWLDBVRSLAFFJ-DBOQMASJSA-N Cer 706.6380 3.10
Cer [NS] d42:3 [M+Hac-H]- KADBCXSPXAVXJL-UHFFFAOYSA-N Cer 704.6207 2.80
Cer 14:2;3O/22:0 [M+Hac-H]- RCTUCKHWFSUVMX-UAZDYKOFSA-N Cer 638.5372 2.96
Cer 18:0;2O_24:0;(2OH) [M-H]- DGORBCXEWSENPF-UHFFFAOYSA-N Cer 666.6421 3.11
Cer 18:0;3O/24:1 [M+FA-H]- DNXQPFZSRNGGHL-UHFFFAOYSA-N Cer 710.6304 2.88
Cer 18:1;2O/16:0 [M+FA-H]- YDNKGFDKKRUKPY-UHFFFAOYSA-N Cer 582.5105 2.31
Cer 18:1;2O/16:0;(2OH) [M+Hac-H]- YWZGQPJRQXHVQX-GGMPIESISA-N Cer 612.5211 2.20
Cer 18:1;2O/18:0 [M+Hac-H]- VODZWWMEJITOND-UHFFFAOYSA-N Cer 624.5583 2.55
Cer 18:2;2O/23:0 [M+FA-H]- YVMFSKMDQVDKIS-UHFFFAOYSA-N Cer 678.6057 2.93
Cer 18:2;2O/24:1 [M-H]- RYZWCKUTHDRXFD-UHFFFAOYSA-N Cer 644.5997 2.82
Cer 18:2;2O_24:0 [M+FA-H]- ZCUCZYYSYGKQQV-UHFFFAOYSA-N Cer 692.6224 3.03
Cer d33:1 [M+Cl]- QBFXCLDNTKBAPQ-STSAHMJASA-N Cer 558.4643 2.19
Cer d34:0 [M+Cl]- GCGTXOVNNFGTPQ-JHOUSYSJSA-N Cer 574.4966 2.40
Cer d34:1 [M+Cl]- YDNKGFDKKRUKPY-TURZORIXSA-N Cer 572.4819 2.29
Cer d34:2 [M+Hac-H]- XXWRZIYYFPIQHE-XPAOSYCESA-N Cer 594.5105 2.12
Cer d36:1 [M+Cl]- MJQIARGPQMNBGT-WWUCIAQXSA-N Cer 600.5128 2.56
Cer d38:1 [M+Cl]- XWBWIAOWSABHFI-NUKVNZTCSA-N Cer 628.5458 2.80
Cer d39:1 [M+Cl]- WYSRACVJQVNCRW-PQPBPFPMSA-N Cer 642.5598 2.91
Cer d40:0 [M+Cl]- SXPRAKSDHOEHIG-ZESVVUHVSA-N Cer 658.5917 3.09
Cer d40:2 [M+Cl]- HILTUFAERVOALR-MQXYEJFFSA-N Cer 654.5616 2.81
Cer d42:1 [M+Hac-H]-_[M+Cl]- ZJVVOYPTFQEGPH-AUTSUKAISA-N Cer 708.652_684.6075 3.21
Cer d42:2 Isomer A [M+Hac-H]- VJSBNBBOSZJDKB-KPEYJIHVSA-N Cer 706.6363 3.01
Cer d42:2 Isomer B [M+Cl]- VJSBNBBOSZJDKB-KPEYJIHVSA-N Cer 682.5919 3.01
Cer-AS d34:1 [M-H]- YWZGQPJRQXHVQX-UHFFFAOYSA-N Cer 552.4996 2.20
Cer-NDS d34:0 [M+Hac-H]- LNDIPJDWEYOMHO-UHFFFAOYSA-N Cer 598.5420 2.39
Cer-NP t40:0 [M+Hac-H]- CIMNZQFRNXDRER-UHFFFAOYSA-N Cer 698.6306 2.89
Cer-NP t42:0 [M+FA-H]- ZESJDNWGTANZCC-UHFFFAOYSA-N Cer 712.6476 3.11
Cer-NP t42:1 [M+Hac-H]- WLPNRZCQBKEKIH-UHFFFAOYSA-N Cer 724.6475 2.88
Cer-NS d32:1 [M+Hac-H]- ZKRPGPZHULJLKJ-UHFFFAOYSA-N Cer 568.4961 2.06
Cer-NS d41:2 [M+Hac-H]- KZTBXGOBTULOIO-SZHIUZGGSA-N Cer 692.6196 2.92
Cer-NS d42:2 [M-H]- ZCUCZYYSYGKQQV-UHFFFAOYSA-N Cer 646.6141 3.01
FA 13:0 (tridecylic acid) [M-H]- SZHOJFHSIKHZHA-UHFFFAOYSA-N Saturated FA 213.1860 0.47
FA 14:1 (physeteric acid) [M-H]- AFGUVBVUFZMJMX-KTKRTIGZSA-N Unsaturated FA 225.1860 0.45
FA 15:1 [M-H]- DJCQJZKZUCHHAL-VOTSOKGWSA-N Unsaturated FA 239.2017 0.57
FA 16:1 (palmitoleic acid) [M-H]- SECPZKHBENQXJG-FPLPWBNLSA-N Unsaturated FA 253.2173 0.70
FA 16:2 [M-H]- RVEKLXYYCHAMDF-UHFFFAOYSA-N Unsaturated FA 251.2018 0.52
FA 17:1 [M-H]- QSBYPNXLFMSGKH-UHFFFAOYSA-N Unsaturated FA 267.2329 0.87
FA 18:1 [M-H]- ZQPPMHVWECSIRJ-KTKRTIGZSA-N Unsaturated FA 281.2484 1.06
FA 18:1+2O [M-H]- XEBKSQSGNGRGDW-UHFFFAOYSA-N Oxidized FA 313.2388 0.28
FA 18:2 [M-H]- OYHQOLUKZRVURQ-HZJYTTRNSA-N Unsaturated FA 279.2328 0.84
FA 18:2 (linoleic acid) [M-H]- JBYXPOFIGCOSSB-XBLVEGMJSA-N Unsaturated FA 279.2328 0.80
FA 18:2+2O [M-H]- JGUNZIWGNMQSBM-UHFFFAOYSA-N Oxidized FA 311.2229 0.28
FA 18:3 (y-linolenic acid) [M-H]- VZCCETWTMQHEPK-QNEBEIHSSA-N Unsaturated FA 277.2172 0.60
FA 19:1 [M-H]- YOKHLRHWEXTWJR-ZHACJKMWSA-N Unsaturated FA 295.2641 1.24
FA 20:1 (eicosenoic acid) [M-H]- BITHHVVYSMSWAG-KTKRTIGZSA-N Unsaturated FA 309.2800 1.36
FA 20:2 [M-H]- XSXIVVZCUAHUJO-AVQMFFATSA-N Unsaturated FA 307.2643 1.15
FA 20:2 (eicosadienoic acid) [M-H]- XSXIVVZCUAHUJO-HZJYTTRNSA-N Unsaturated FA 307.2643 1.15
FA 20:3 (homo-gamma-linolenic acid) [M-H]- HOBAELRKJCKHQD-QNEBEIHSSA-N Unsaturated FA 305.2486 0.98
FA 20:4 [M-H]- YZXBAPSDXZZRGB-DOFZRALJSA-N Unsaturated FA 303.2330 0.75
FA 20:4 b [M-H]- YZXBAPSDXZZRGB-DOFZRALJSA-N Unsaturated FA 303.2332 1.05
FA 20:5 (eicosapentaenoic acid) [M-H]- JAZBEHYOTPTENJ-JLNKQSITSA-N Unsaturated FA 301.2174 0.57
FA 22:2 (docosadienoic acid) [M-H]- HVGRZDASOHMCSK-AVQMFFATSA-N Unsaturated FA 335.2956 1.41
FA 22:4 [M-H]- TWSWSIQAPQLDBP-DOFZRALJSA-N Unsaturated FA 331.2640 1.05
FA 22:6 (docosahexaenoic acid) [M-H]- MBMBGCFOFBJSGT-KUBAVDMBSA-N Unsaturated FA 327.2329 0.66
FA 24:1 [M-H]- AVPORSRTKOSBPH-UHFFFAOYSA-N Unsaturated FA 365.3426 1.79
FA 26:1 [M-H]- ALQCJXNGZHBRNR-UHFFFAOYSA-N Unsaturated FA 393.3740 2.04
FAHFA 18:2/18:1 [M-H]- GKFRCWOFCMCBNW-GSCXELOCSA-N FAHFA 559.4734 0.79
FAHFA 38:4 [M-H]- UWSSQGYIAHOMJM-OMCRSCLLSA-N FAHFA 585.4866 1.06
FAHFA 38:6 [M-H]- PBMZWRDOWKVLMN-DHWAMTIQSA-N FAHFA 581.4552 0.79
GlcCer d38:1 [M+Cl]- DFELABABMXOKTD-IYFIADHGSA-N HexCer 790.5996 2.61
GlcCer d40:1 [M+Hac-H]- _[M+Cl]- YIGARKIIFOHVPF-YAEABVQUSA-N HexCer 842.6731_818.6289 2.83
GlcCer d41:1 [M+Hac-H]-_[M+Cl]- SJGWLQDELUWRDA-MUYAOIFFSA-N HexCer 856.6893_832.6447 2.94
GlcCer d42:1 [M+Hac-H]- _[M+Cl]- POQRWMRXUOPCLD-AAAFHMTMSA-N HexCer 870.705_846.6606 3.05
GlcCer d42:2 [M+Hac-H]-_[M+Cl]- WBOZIXHPUPAOIA-RBELZSLISA-N HexCer 868.6885_844.6429 2.81
GlcCerd14:14E/20:02OH [M+Hac-H]-_[M+Cl]- YYILQTLJZBSOCA-IMJQGFQJSA-N HexCer 774.5811_750.5287 2.06
GM3 d34:1 [M-H]- UGQJOBGCMVNYRT-MSUUIHNZSA-N Gangliosides 1151.7037 1.70
HexCer(18:1_24:0) - N-[3-hydroxy-1-{3.4.5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadec-4-en-2-yl]tetracosanamide [M-H]- POQRWMRXUOPCLD-UHFFFAOYSA-N HexCer 810.6856 3.05
LNAPE 18:1/N-20:0 [M-H]- FPTSLKCBYZXNAK-UHFFFAOYSA-N LNAPE 772.5867 2.55
LNAPE 18:2/N-20:0 [M-H]- LMJRVTNHOFDJIG-UHFFFAOYSA-N LNAPE 770.5705 2.37
LNAPE 20:4_N-3:0 [M-H]- HLTZTXMJZIJWBT-GKFVBPDJSA-N LNAPE 556.2993 0.52
LPA 18:2 [M-H]- ZQTAMPRZFOOEEP-HZJYTTRNSA-N LPA 433.2370 0.41
LPC 15:0 [M+Hac-H]- RJZVWDTYEWCUAR-UHFFFAOYSA-N LPC 540.3307 0.55
LPC 16:0 [M+Hac-H]- ASWBNKHCZGQVJV-HSZRJFAPSA-N LPC 554.3464 0.64
LPC 16:1 [M+Hac-H]- LFUDDCMNKWEORN-ZXEGGCGDSA-N LPC 552.3309 0.45
LPC 18:0 [M+FA-H]- IHNKQIMGVNPMTC-UHFFFAOYSA-N LPC 568.3617 0.99
LPC 18:0 Isomer B [M+Hac-H]- IHNKQIMGVNPMTC-RUZDIDTESA-N LPC 582.3780 0.92
LPC 18:1 [M+Hac-H]- _[M+FA-H]- YAMUFBLWGFFICM-PTGWMXDISA-N LPC 580.3623_566.3461 0.70
LPC 18:2 [M+Hac-H]-_[M+FA-H]- SPJFYYJXNPEZDW-FTJOPAKQSA-N LPC 578.3468_564.3303 0.51
LPC 19:0 [M+Hac-H]- WYIMORDZGCUBAA-UHFFFAOYSA-N LPC 596.3947 1.19
LPC 20:2 [M+Hac-H]- YYQVCMMXPIJVHY-ZOIJLGJPSA-N LPC 606.3779 0.78
LPC 20:3 [M+Hac-H]- BBNHCUBQEQJHIG-FZZJNMCHSA-N LPC 604.3625 0.61
LPC 20:4 [M+Hac-H]- GOMVPVRDBLLHQC-UHFFFAOYSA-N LPC 602.3467 0.50
LPC 22:4 [M+Hac-H]- GXEIJYZRCDTJTE-UHFFFAOYSA-N LPC 630.3780 0.70
LPC 22:5 [M+Hac-H]- YBUXFQUGNPBZPS-YNBHEIDWSA-N LPC 628.3627 0.54
LPC O-16:0 [M+Hac-H]- VLBPIWYTPAXCFJ-UHFFFAOYSA-N O-LPC 540.3666 0.76
LPC O-16:1 [M+Hac-H]- PLQWZMJRHVARFU-UHFFFAOYSA-N O-LPC 538.3514 0.73
LPC O-18:1 [M+Hac-H]- XWYSLMAMRKYUFH-UHFFFAOYSA-N O-LPC 566.3826 0.83
LPE 16:0 [M-H]- CKPBBEOJHAPPBT-HXUWFJFHSA-N LPE 452.2782 0.65
LPE 18:0 [M-H]- BBYWOYAFBUOUFP-UHFFFAOYNA-N LPE 480.3096 1.01
LPE 18:2 [M-H]- DBHKHNGBVGWQJE-USWSLJGRSA-N LPE 476.2783 0.52
LPE 20:4 [M-H]- JPNPIRVRGLGTRE-YSKCIPFOSA-N LPE 500.2783 0.50
LPE 22:6 [M-H]- XEVRBOQZSXWGQO-PAUXXPOVSA-N LPE 524.2781 0.47
MGDG 16:0_20:3 [M+FA-H]- GORZYUCSGLEBRM-SVNQLWEDSA-N Others 825.5697 2.09
MGDG 17:0_20:4 [M+FA-H]- RGVWEJUIAMCNFP-UMWXEKTDSA-N Others 837.5809 2.20
MGDG 18:0_18:2 [M+FA-H]- UINNZTXASUBFNN-MLWYYCKJSA-N Others 827.5933 2.37
MGDG 18:0_20:4 [M+FA-H]- RQAJBXADHYXDNI-ZKVKLVECSA-N Others 851.5925 2.32
MGDG 18:2_20:4 [M+FA-H]- JVWUEAAJPFPUCQ-DMQHYRIXSA-N Others 847.5607 1.93
MGDG 34:1 [M+FA-H]- GJPFUHJUTMNEJR-UHFFFAOYSA-N Others 801.5765 2.31
MGDG 34:2 [M+FA-H]- GJHPGSRMFZQOAU-WSXGAQSRSA-N Others 799.5618 2.13
MGDG 36:4 [M+FA-H]- WVWMRPOQTGABQB-BOQSSNEJSA-N Others 823.5617 2.09
MGDG 38:3 [M+FA-H]- MUELWIFYCUDOFI-JTBMWNAQSA-N Others 853.6114 2.43
MGDG 38:6 [M+FA-H]- GSRCDNLIRNWURU-LFIPBAJGSA-N Others 847.5617 2.03
MGDG 40:6 [M+FA-H]- RFAQTMPYWRJLNB-QQZFANIGSA-N Others 875.5909 2.26
PC 16:0_18:2 [M+Cl]-_[M+FA-H]- JLPULHDHAOZNQI-UHFFFAOYSA-N Unsaturated PC 792.5317_802.5606 2.14
PC 16:0_18:3 [M+Hac-H]-_[M+FA-H]- JMAYDGBZRHQJAT-QWFQJEORSA-N Unsaturated PC 814.5611_800.545 2.00
PC 18:0_16:0 [M+FA-H]- BYSIMVBIJVBVPA-UHFFFAOYSA-N Saturated PC 806.5925 2.54
PC 18:0_18:1 [M+Cl]-_[M+FA-H]- ATHVAWFAEPLPPQ-UHFFFAOYSA-N Unsaturated PC 822.5783_832.6084 2.56
PC 18:0_20:5 [M+FA-H]- ZMNDHWFRGYCJKG-UQIQIHEKSA-N Unsaturated PC 852.5767 2.17
PC 18:1_18:2 [M+FA-H]- GDWULUGDXGHJIJ-RWLIYIGXSA-N Unsaturated PC 828.5764 2.16
PC 18:2_20:3 [M+Hac-H]- LSNIXSHXTMSKGF-JPMBMWHXSA-N Unsaturated PC 866.5839 2.03
PC 18:2_20:4 [M+Hac-H]-_[M+FA-H]- RUHBZJXWUDKAMZ-XXAGCNFXSA-N Unsaturated PC 864.577_850.5606 1.94
PC 18:2_20:5 [M+Hac-H]- HRBNRYBXXRPMKP-OMCHRGCMSA-N Unsaturated PC 862.5607 1.83
PC 19:0_18:2 [M+Hac-H]- LOOVXTAPKGYHKO-HJTCUGKVSA-N Unsaturated PC 858.6237 2.45
PC 30:0 [M+Hac-H]- RFVFQQWKPSOBED-UHFFFAOYSA-N Saturated PC 764.5491 2.04
PC 32:0 [M+Hac-H]- KILNVBDSWZSGLL-KXQOOQHDSA-N Saturated PC 792.5774 2.29
PC 32:1 [M+Hac-H]-_[M+FA-H]- QIBZFHLFHCIUOT-NPBIGWJUSA-N Unsaturated PC 790.561_776.5457 2.08
PC 32:2 [M+Hac-H]- GPWHCUUIQMGELX-VHQDNGOZSA-N Unsaturated PC 788.5457 1.90
PC 33:1 [M+Hac-H]- GXTATYLPYLLNLV-MGIDVFSBSA-N Unsaturated PC 804.5766 2.20
PC 33:2 [M+Hac-H]- SBNDHGBVMZMSNL-UESLNCBNSA-N Unsaturated PC 802.5613 2.01
PC 34:0 [M+Hac-H]- PZNPLUBHRSSFHT-RRHRGVEJSA-N Saturated PC 820.6083 2.53
PC 34:1 [M+Hac-H]- WTJKGGKOPKCXLL-VYOBOKEXSA-N Unsaturated PC 818.5927 2.31
PC 34:2 [M+Hac-H]- JLPULHDHAOZNQI-ZTIMHPMXSA-N Unsaturated PC 816.5770 2.13
PC 34:3 [M+Hac-H]- CNNSEHUKQJCGTE-UPPWDXJYSA-N Unsaturated PC 814.5607 1.93
PC 34:4 [M+Hac-H]- YWDDIWXKFJEMKF-JTZVLWBESA-N Unsaturated PC 812.5457 1.87
PC 35:2 [M+Hac-H]- ZSKWZJYUVZYDQU-WESJWMGVSA-N Unsaturated PC 830.5929 2.25
PC 36:2 [M+Hac-H]- SNKAWJBJQDLSFF-NVKMUCNASA-N Unsaturated PC 844.6081 2.37
PC 36:3 Isomer A [M+Hac-H]- YPAZQMWFRMHBBM-CLKMJQEKSA-N Unsaturated PC 842.5920 2.16
PC 36:4 Isomer A [M+Hac-H]- FVXDQWZBHIXIEJ-UHFFFAOYSA-N Unsaturated PC 840.5693 1.91
PC 36:4 Isomer B [M+Hac-H]- FVXDQWZBHIXIEJ-UHFFFAOYSA-N Unsaturated PC 840.5769 1.97
PC 36:4 Isomer C [M+Hac-H]- IIZPXYDJLKNOIY-JXPKJXOSSA-N Unsaturated PC 840.5765 2.09
PC 36:5 Isomer B [M+Hac-H]- NJKOHDXHBBUJBZ-UHFFFAOYSA-N Unsaturated PC 838.5610 1.90
PC 36:5 Isomer A [M+Hac-H]- DYDDZDMJSQYFGN-OIVUZXIWSA-N Unsaturated PC 838.5609 1.82
PC 36:6 [M+Hac-H]- HAIPHKFLSXSDAN-UHFFFAOYSA-N Unsaturated PC 836.5461 1.81
PC 38:2 [M+Hac-H]- KXXLFCAPKGRXBT-FMJYHZMHSA-N Unsaturated PC 872.6393 2.58
PC 38:4 [M+Hac-H]- HUAVKOMRGUBYMK-UHFFFAOYSA-N Unsaturated PC 868.6079 2.27
PC 38:4 Isomer A [M+Hac-H]- PSVRFUPOQYJOOZ-QNPWAGBNSA-N Unsaturated PC 868.6081 2.33
PC 38:5 Isomer A [M+Hac-H]- YLWBKBDNHWQEFU-YJXJLLHLSA-N Unsaturated PC 866.5922 2.10
PC 38:5 Isomer B [M+Hac-H]- YLWBKBDNHWQEFU-YJXJLLHLSA-N Unsaturated PC 866.5926 2.18
PC 40:4 [M+Hac-H]- QQIYXJBHMDYXHH-NMUBDWGHSA-N Unsaturated PC 896.6386 2.49
PC 40:5 [M+Hac-H]- MAAMGQXOTCBPFS-UHFFFAOYSA-N Unsaturated PC 894.6240 2.42
PC 40:5 Isomer A [M+FA-H]-_[M+Hac-H]- LJFKFKIYUJNFPZ-ZLFSCUDPSA-N Unsaturated PC 880.6086_894.6242 2.33
PC 40:6 [M+Hac-H]-_[M+FA-H]- FAUYAENFVCNTAL-UHFFFAOYSA-N Unsaturated PC 892.6082_878.5919 2.25
PC 40:6 Isomer A [M+Hac-H]- FYVNIFOYDIIODX-KNKJIUSSSA-N Unsaturated PC 892.6091 2.15
PC 40:7 [M+Hac-H]- FPEVDFOXMCHLKL-UHFFFAOYSA-N Unsaturated PC 890.5924 2.04
PC 40:8 [M+Hac-H]- BFCSBEFTXQRIOJ-IMYLGOOQSA-N Unsaturated PC 888.5773 1.89
PC O-16:0_20:4 [M+Hac-H]- SOUZQPFUXRVDGK-KCTKZSJBSA-N O-PC 826.5978 2.22
PC O-16:1_18:2 [M+Hac-H]- AXCLECQLCBWNLZ-KZZBVOOISA-N O-PC 800.5823 2.23
PC O-18:1_20:4 [M+FA-H]- FHHVIBPVBBRLOR-IYACIECVSA-N O-PC 838.5970 2.24
PC O-38:4 [M+Hac-H]- PTKWWHCMNOQBSL-TXZKCYEUSA-N O-PC 854.6293 2.46
PC O-40:5 [M+Hac-H]- HJDYJUQFSIJNGA-MMLUMLTRSA-N O-PC 880.6426 2.47
PC O-40:7 [M+Hac-H]- MWJZGUPJPKCTCF-BGOAOESGSA-N O-PC 876.6127 2.17
PC P-32:0 or PC O-32:1 [M+Hac-H]- KEVGQWGZKKFGDC-JCUPVDEDSA-N O-PC 776.5826 2.40
PC P-34:0 or PC O-34:1 [M+Hac-H]- QCGUXAIDEOWPBV-SNKLRXETSA-N O-PC 804.6132 2.45
PC P-34:1 or PC O-34:2 Isomer A [M+Hac-H]- MBRHHFWRXQYYAN-RTVLTNFHSA-N O-PC 802.5966 2.26
PC P-38:4 or PC O-38:5 Isomer A [M+Hac-H]- DBQMOXDLWKVKKG-REWQMPQJSA-N O-PC 852.6132 2.23
PC P-38:5 or PC O-38:6 [M+Hac-H]- ATTCDOPAYPGSLE-LQULQHAGSA-N O-PC 850.5973 2.18
PC P-40:1 or PC O-40:2 [M+Hac-H]- KYEGAYPFBCAHDL-SPACVREBSA-N O-PC 886.6975 2.70
PE 34:1 [M-H]- RECBGBLFDMTQRS-SGEDCAFJSA-N PE 716.5231 2.36
PE 34:2 [M-H]- HBZNVZIRJWODIB-NHCUFCNUSA-N PE 714.5085 2.17
PE 36:2 [M-H]- MWRBNPKJOOWZPW-CLFAGFIQSA-N PE 742.5402 2.40
PE 36:3 [M-H]- GKAFCSRKMWFPSJ-RQOIEFAZSA-N PE 740.5249 2.19
PE 36:4 [M-H]- NQIMLWFRWGTTOZ-JAXHXWBXSA-N PE 738.5081 2.13
PE 38:2 [M-H]- WYDGEVICLIVPEG-OHNCOSGTSA-N PE 770.5696 2.62
PE 38:4 [M-H]- ICYDFONFTSPCRL-BHYOAKPMSA-N PE 766.5400 2.29
PE 38:4 Isomer A [M-H]- ANRKEHNWXKCXDB-BHFWLYLHSA-N PE 766.5324 2.10
PE 38:4 Isomer B [M-H]- ANRKEHNWXKCXDB-BHFWLYLHSA-N PE 766.5401 2.37
PE 38:5 Isomer A [M-H]- ZYMZKMQPPJPQHY-HAGCXRLMSA-N PE 764.5241 2.14
PE 38:5 Isomer B [M-H]- MOJMRZJNAPRFBD-GLWDABGQSA-N PE 764.5239 2.21
PE 38:6 [M-H]- MPWUZHVZZKSTPV-LGFBOSHVSA-N PE 762.5089 2.06
PE 38:6 | PE 18:2_20:4 [M-H]- LFGBKOUQHCWBQI-BZGLIJSBSA-N PE 762.5072 1.86
PE 40:5 [M-H]- XBPHCFQOKKXKHJ-IVJZGABJSA-N PE 792.5561 2.37
PE 40:6 [M-H]- FEABWDMFZNBFCT-KUVQHVNNSA-N PE 790.5315 2.03
PE O-16:1_18:1 [M-H]- RFPQMVKZNQOUGY-KXYOHKLBSA-N O-PE 700.5290 2.47
PE O-16:1_18:2 [M-H]- RIQAKBUOHSSMTC-PNBIJBBKSA-N O-PE 698.5134 2.28
PE O-16:1_22:3 [M-H]- KGUFJBOXYGWRSC-VKPJOHIISA-N O-PE 752.5608 2.51
PE O-17:1_18:2 [M-H]- ANDIJCDJHMZLND-UHFFFAOYSA-N O-PE 712.5260 2.43
PE O-18:1_16:0 [M-H]- HEASGCOZOMIKFU-WUVHBKSUSA-N O-PE 702.5390 2.44
PE O-18:1_22:6 [M-H]- IVBLZGVNSKPGOR-XAJDCCMMSA-N O-PE 774.5450 2.40
PE O-22:6_16:1 [M-H]- WVGALBKSWOUIEZ-ULUZTLKMSA-N O-PE 746.5132 2.16
PE O-36:3 [M-H]- CQHMZFNQRVSRPW-HLMRNWPHSA-N O-PE 726.5392 2.43
PE O-36:4 [M-H]- CVFFRLVFXKZVIJ-MAZCIEHSSA-N O-PE 724.5250 2.25
PE O-38:5 [M-H]- RKVZUTPSIGLURV-BLAGHTKOSA-N O-PE 750.5455 2.40
PE O-38:6 [M-H]- YJPYELPDWSEQHM-KTUZNUCGSA-N O-PE 748.5291 2.24
PE O-38:7 [M-H]- QIQGIECOBDSDSX-IVGDTRDPSA-N O-PE 746.5147 2.06
PE O-40:4 [M-H]- JWICLJISDBHCTF-MAZCIEHSSA-N O-PE 780.5926 2.74
PE O-40:5 [M-H]- GZMXKUALKXYCMM-XSEHFSNESA-N O-PE 778.5765 2.63
PE O-40:6 [M-H]- NKXPONDLZHZZND-PKBJNFAXSA-N O-PE 776.5604 2.57
PE O-40:8 [M-H]- VVEHXBSUSFPSAC-OJMLKDQNSA-N O-PE 772.5292 2.17
PE P-36:1 or PE O-36:2 [M-H]- OBAAWAYLQLYWNN-KHFVPPDWSA-N O-PE 728.5598 2.70
PE P-38:2 or PE O-38:3 [M-H]- LZGIKQZCPKHHMV-NANSGXCVSA-N O-PE 754.5775 2.74
PE P-38:4 or PE O-38:5 [M-H]- URPXXNCTXCOATD-FXMFQVEGSA-N O-PE 750.5450 2.47
PE P-40:4 or PE O-40:5 [M-H]- OQKUDRFZPJFLJQ-KMUIXOOCSA-N O-PE 778.5771 2.70
PE-Cer 20:0;2O/22:2 [M-H]- MWAFZSCSTCTGSN-UHFFFAOYSA-N CerPE 769.6233 2.76
PE-Cer 34:1;2O [M-H]- YZEKNINLRZQHRK-WSYRTZMQSA-N CerPE 659.5156 2.05
PEtOH 38:4 [M-H]- GPIZQCJFIIUKMR-IAMXBNBSSA-N PEth 751.5331 2.06
PG 16:0_16:0 [M-H]- BIABMEZBCHDPBV-UHFFFAOYSA-N PG 721.5023 1.97
PG 36:2 [M-H]- KDFIYBDWNQKADP-UHFFFAOYSA-N PG 773.5335 2.03
PGE2 [M-H]- XEYBRNLFEZDVAW-ARSRFYASSA-N Prostaglandins 351.2174 0.26
Phenylalanine [M-H]- COLNVLDHVKWLRT-QMMMGPOBSA-N Amino acids 164.0718 0.17
Phosphatidylethanolamine alkenyl 16:0-20:4 [M-H]- QDRJMAHGAQYRIN-PKKQLAOCSA-N O-PE 722.5140 2.23
Phosphatidylethanolamine alkenyl 18:0-18:2 [M-H]- QBAQUPWJTLVJBD-CZAAGYDRSA-N O-PE 726.5449 2.51
PI 16:0_16:0 [M-H]- IBUKXRINTKQBRQ-UHFFFAOYSA-N PI 809.5204 1.92
PI 18:0_20:2 [M-H]- RZFIPFIGUWXYNB-UHFFFAOYSA-N PI 889.5800 2.18
PI 18:0_22:5 [M-H]- QLABQLNIHHHJCI-UHFFFAOYSA-N PI 911.5668 1.97
PI 18:1_18:1; 1,2-Dioleoyl-sn-glycero-3-phospho-(1'-myo-inositol) [M-H]- LALGUHSIWLNTNW-UHFFFAOYSA-N PI 861.5506 1.99
PI 18:1_22:4 [M-H]- OOSPMTMUZPWTKZ-DCMOKHIZSA-N PI 911.5583 1.91
PI 18:1_22:6 [M-H]- QHPDGSFYNQHVMI-UHFFFAOYSA-N PI 907.5374 1.73
PI 32:1 [M-H]- RNXWIPLNUTUDRT-YHSIYXGOSA-N PI 807.5047 1.76
PI 34:1 [M-H]- PDLAMJKMOKWLAJ-AGORXRROSA-N PI 835.5352 1.90
PI 34:2 Isomer A [M-H]- ZPUUVEHXYAPJAQ-KOHXHNRGSA-N PI 833.5201 1.74
PI 34:2 Isomer B [M-H]- GXAHXPDRXNWFIX-UHFFFAOYSA-N PI 833.5190 1.79
PI 36:1 [M-H]- YOBFISPJJWPPTK-JUCSSFOXSA-N PI 863.5649 2.16
PI 36:3 [M-H]- UPMVFTFJRCVMKL-PVJQQWEWSA-N PI 859.5346 1.82
PI 36:4 [M-H]- WPXXYOUAQYYXER-BFRKKRKTSA-N PI 857.5194 1.72
PI 36:5 [M-H]- FQGSWQFJOVVRRB-UHFFFAOYSA-N PI 855.5033 1.64
PI 38:3 [M-H]- VVADTISLHXZLIB-WNWAWKNRSA-N PI 887.5664 2.05
PI 40:4 [M-H]- VTYLJIRGLIZEIC-UHFFFAOYSA-N PI 913.5825 2.11
PI 40:6 [M-H]- QSUYYEJLNWCMIO-SIZJMFNESA-N PI 909.5502 1.91
PI O-18:1_20:4 [M-H]- VKRDRDRLFSZIGY-UHFFFAOYSA-N O-PI 869.5556 1.88
PS 16:0_22:4 [M-H]- BAGQGBPETWVHAA-BHYOAKPMSA-N PS 810.5297 1.97
PS 40:5 [M-H]- PZEFRSYCROBXSJ-UHFFFAOYSA-N PS 836.5508 1.93
SM 16:0;2O/22:1 [M+FA-H]- OLSNBXYFWAGDNX-UHFFFAOYSA-N SM 803.6284 2.52
SM 16:1;2O/16:0 [M+FA-H]- RPTUKVYGSPDHGQ-PSALXKTOSA-N SM 719.5356 1.80
SM 18:0;2O/22:0 [M+Hac-H]- FONAXCRWZQFJHY-UHFFFAOYSA-N SM 847.6840 2.87
SM 20:0;2O/21:1 [M+Hac-H]- YUVPOZFUVRRVLD-UHFFFAOYSA-N SM 859.6919 2.88
SM 20:0;2O/22:3 [M+FA-H]- BCTOQCAZSBNMRM-UHFFFAOYSA-N SM 855.6605 2.54
SM 22:1;2O/12:0 [M+FA-H]- OAUYZGOKCOOZQY-KHDLYOHESA-N SM 747.5661 2.04
SM 22:1;2O/22:1 [M+Hac-H]- SCVCWRROIWOKRT-UHFFFAOYSA-N SM 899.7237 2.97
SM 25:2;2O/18:0 [M+Hac-H]- CTRDFKIWJJWXFI-AVKVGXGOSA-N SM 885.7080 2.86
SM 34:2;3O [M+Hac-H]- NFXZCBYDQPAVIP-DHMMHTEOSA-N SM 775.5619 1.77
SM 39:0;3O [M+FA-H]- FKICOAOACYYOIO-UHFFFAOYSA-N SM 835.6482 2.88
SM 42:1;3O [M+Hac-H]- ISGKSTOOPWPBST-QOSDPKFLSA-N SM 889.7024 2.63
SM 42:2;2O [M+Hac-H]- OWZJVISZEHCUKV-BDXCBASSSA-N SM 871.6920 2.75
SM 42:5;2O [M+Hac-H]- VVLNRWXINSYDID-NZJVTSFOSA-N SM 865.6446 2.20
SM d32:1 [M+Hac-H]- KYICBZWZQPCUMO-PSALXKTOSA-N SM 733.5513 1.80
SM d33:1 [M+Hac-H]- LQINJRUGTUOHGS-YPDYIYJKSA-N SM 747.5660 1.91
SM d34:0 [M+Hac-H]- QHZIGNLCLJPLCU-QPPIDDCLSA-N SM 763.5978 2.12
SM d34:1 [M+Hac-H]- RWKUXQNLWDTSLO-UHFFFAOYSA-N SM 761.5824 2.04
SM d34:2 [M+FA-H]-_[M+Hac-H]- YLWSJLLZUHSIEA-CKSUKHGVSA-N SM 745.5499_759.5667 1.83
SM d36:0 [M+Hac-H]- JCELSEVNSMXGKA-IOLBBIBUSA-N SM 791.6275 2.37
SM d36:1 [M+Hac-H]- LKQLRGMMMAHREN-YJFXYUILSA-N SM 789.6140 2.28
SM d36:2 [M+Hac-H]- _[M+FA-H]- NBEADXWAAWCCDG-QDDWGVBQSA-N SM 787.5966_773.5809 2.06
SM d38:1 [M+Hac-H]- AADLTHQNYQJHQV-SVLGDMRNSA-N SM 817.6444 2.52
SM d38:2 [M+Hac-H]- MDRFMTLYKHBJTF-NQYLGBTJSA-N SM 815.6298 2.29
SM d39:1 [M+Hac-H]- YXSZOBWVQJIWNE-LUJNSPTCSA-N SM 831.6614 2.64
SM d39:2 [M+Hac-H]- SDUGEKJCGFHJRC-IYXZHQORSA-N SM 829.6440 2.52
SM d40:0 [M+Hac-H]- FONAXCRWZQFJHY-JCGOJSMZSA-N SM 847.6871 2.76
SM d40:1 [M+Hac-H]- FJJANLYCZUNFSE-QVMKKYBKSA-N SM 845.6763 2.76
SM d40:2 Isomer A [M+Hac-H]- FOULCGVQZYQEQM-DNXGLLHMSA-N SM 843.6604 2.52
SM d40:3 [M+Hac-H]- FMJPKVXVBYILLP-FTRJIJDXSA-N SM 841.6450 2.30
SM d41:2 [M+Hac-H]- JBDGKEXQKCCQFK-JWQIMADESA-N SM 857.6757 2.65
SM d42:0 [M+Hac-H]- SMJLGESYPKPRNU-CRCOQUFZSA-N SM 875.7153 2.99
SM d42:3 [M+Hac-H]- SAFPQDBNJOKZOV-UHFFFAOYSA-N SM 869.6762 2.54
SM d43:1 [M+Hac-H]- ULARPQXVRGTQDC-UHFFFAOYSA-N SM 887.7235 3.07
ST 27:1;O;S [M-H]- BHYOQNUELFTYRT-UHFFFAOYSA-N Others 465.3044 1.27
ST 29:2;O;S [M-H]- WXMRLOQHICRRPA-UHFFFAOYNA-N Others 491.3188 1.25
METABOLITES_END
#END