#METABOLOMICS WORKBENCH wangzhe_20201122_202648 DATATRACK_ID:2329 STUDY_ID:ST001632 ANALYSIS_ID:AN002667 PROJECT_ID:PR001043 VERSION 1 CREATED_ON December 15, 2020, 12:38 pm #PROJECT PR:PROJECT_TITLE Lipidomics of Ginseng Total Secondary Saponins on Myocardial Ischemia Rat PR:PROJECT_SUMMARY Cardioprotective Effect of Ginseng Total Secondary Saponins on Myocardial PR:PROJECT_SUMMARY Ischemia Rat via Regulating Disturbed Lipids Based on Lipidomics. PR:INSTITUTE Institute of Materia Medica, Chinese Academy of Medical Sciences & Peking Union PR:INSTITUTE Medical College PR:LAST_NAME Wang PR:FIRST_NAME Zhe PR:ADDRESS No.2 nanwei street, xichen district, Beijing, China PR:EMAIL wangzhe@imm.ac.cn PR:PHONE +861083154880 #STUDY ST:STUDY_TITLE Lipidomics of Ginseng Total Secondary Saponins on Myocardial Ischemia Rat ST:STUDY_SUMMARY Cardioprotective Effect of Ginseng Total Secondary Saponins on Myocardial ST:STUDY_SUMMARY Ischemia Rat via Regulating Disturbed Lipids Based on Lipidomics. ST:INSTITUTE Institute of Materia Medica, Chinese Academy of Medical Sciences & Peking Union ST:INSTITUTE Medical College ST:LAST_NAME Wang ST:FIRST_NAME Zhe ST:ADDRESS No.2 nanwei street, xichen district, Beijing, China ST:EMAIL wangzhe@imm.ac.cn ST:PHONE +861083154880 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Rattus norvegicus SU:TAXONOMY_ID 10116 SU:GENOTYPE_STRAIN Sprague-Dawley SU:AGE_OR_AGE_RANGE 6 weeks-age SU:WEIGHT_OR_WEIGHT_RANGE 200 ± 10 SU:GENDER Male SU:ANIMAL_ANIMAL_SUPPLIER Vital River Laboratories Co., Ltd (Beijng, China) SU:ANIMAL_HOUSING 25 ± 2℃, 50±5% relative humidity SU:ANIMAL_LIGHT_CYCLE 12 h light/12 h dark photoperiod #FACTORS #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 - 1-A3-PL class:Control | Tissue:plasma RAW_FILE_NAME=140422008.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-A5-PL class:Control | Tissue:plasma RAW_FILE_NAME=140422012.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-B2-PL class:Control | Tissue:plasma RAW_FILE_NAME=140422014.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-B3-PL class:Control | Tissue:plasma RAW_FILE_NAME=140422016.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-B5-PL class:Control | Tissue:plasma RAW_FILE_NAME=140422018.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-C1-PL class:Control | Tissue:plasma RAW_FILE_NAME=140422020.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-A1-PL class:Model | Tissue:plasma RAW_FILE_NAME=140422023.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-B1-PL class:Model | Tissue:plasma RAW_FILE_NAME=140422031.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-B4-PL class:Model | Tissue:plasma RAW_FILE_NAME=140422033.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-C1-PL class:Model | Tissue:plasma RAW_FILE_NAME=140422035.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-C3-PL class:Model | Tissue:plasma RAW_FILE_NAME=140422037.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-C4-PL class:Model | Tissue:plasma RAW_FILE_NAME=140422039.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-A1-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140424022.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-A2-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140424024.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-B3-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140424030.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-C1-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140424032.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-C2-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140424034.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-C4-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140424036.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-A3-N-PL class:Control | Tissue:plasma RAW_FILE_NAME=140522049.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-A5-N-PL class:Control | Tissue:plasma RAW_FILE_NAME=140522053.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-B2-N-PL class:Control | Tissue:plasma RAW_FILE_NAME=140522055.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-B3-N-PL class:Control | Tissue:plasma RAW_FILE_NAME=140522057.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-B5-N-PL class:Control | Tissue:plasma RAW_FILE_NAME=140522059.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-C1-N-PL class:Control | Tissue:plasma RAW_FILE_NAME=140522061.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-A1-N-PL class:Model | Tissue:plasma RAW_FILE_NAME=140522063.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-B1-N-PL class:Model | Tissue:plasma RAW_FILE_NAME=140522071.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-B4-N-PL class:Model | Tissue:plasma RAW_FILE_NAME=140522073.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-C1-N-PL class:Model | Tissue:plasma RAW_FILE_NAME=140522075.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-C3-N-PL class:Model | Tissue:plasma RAW_FILE_NAME=140522077.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-C4-N-PL class:Model | Tissue:plasma RAW_FILE_NAME=140522079.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-A1-N-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140524060.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-A2-N-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140524062.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-B3-N-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140524068.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-C1-N-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140524070.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-C2-N-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140524072.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-C4-N-PL class:GTSS | Tissue:plasma RAW_FILE_NAME=140524074.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-A1-HL class:Control | Tissue:heart RAW_FILE_NAME=140515004.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-A3-HL class:Control | Tissue:heart RAW_FILE_NAME=140515006.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-A5-HL class:Control | Tissue:heart RAW_FILE_NAME=140515008.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-B1-HL class:Control | Tissue:heart RAW_FILE_NAME=140515010.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-B2-HL class:Control | Tissue:heart RAW_FILE_NAME=140515012.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-C5-HL class:Control | Tissue:heart RAW_FILE_NAME=140515020.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-A1-HL class:Model | Tissue:heart RAW_FILE_NAME=140515022.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-A5-HL class:Model | Tissue:heart RAW_FILE_NAME=140515030.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-B1-HL class:Model | Tissue:heart RAW_FILE_NAME=140515032.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-B2-HL class:Model | Tissue:heart RAW_FILE_NAME=140515034.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-B3-HL class:Model | Tissue:heart RAW_FILE_NAME=140515036.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 2-C5-HL class:Model | Tissue:heart RAW_FILE_NAME=140515038.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-A1-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518002.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-A2-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518004.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-A4-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518008.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-B2-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518012.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-B4-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518014.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 8-C5-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518016.RAW; lipid=SM/PC/PE/DG/TG SUBJECT_SAMPLE_FACTORS - 1-A1-N-HL class:Control | Tissue:heart RAW_FILE_NAME=140515041.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-A3-N-HL class:Control | Tissue:heart RAW_FILE_NAME=140515043.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-A5-N-HL class:Control | Tissue:heart RAW_FILE_NAME=140515045.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-B1-N-HL class:Control | Tissue:heart RAW_FILE_NAME=140515047.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-B2-N-HL class:Control | Tissue:heart RAW_FILE_NAME=140515049.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-C5-N-HL class:Control | Tissue:heart RAW_FILE_NAME=140515057.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-A1-N-HL class:Model | Tissue:heart RAW_FILE_NAME=140515059.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-A5-N-HL class:Model | Tissue:heart RAW_FILE_NAME=140515067.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-B1-N-HL class:Model | Tissue:heart RAW_FILE_NAME=140515069.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-B2-N-HL class:Model | Tissue:heart RAW_FILE_NAME=140515071.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-B3-N-HL class:Model | Tissue:heart RAW_FILE_NAME=140515073.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 2-C5-N-HL class:Model | Tissue:heart RAW_FILE_NAME=140515075.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-A1-N-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518035.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-A2-N-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518037.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-A4-N-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518041.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-B2-N-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518045.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-B4-N-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518047.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 8-C5-N-HL class:GTSS | Tissue:heart RAW_FILE_NAME=140518049.RAW; lipid=PI SUBJECT_SAMPLE_FACTORS - 1-A2-PS class:Control | Tissue:plasma RAW_FILE_NAME=0414019.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 1-A3-PS class:Control | Tissue:plasma RAW_FILE_NAME=0414020.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 1-A5-PS class:Control | Tissue:plasma RAW_FILE_NAME=0414022.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 1-B2-PS class:Control | Tissue:plasma RAW_FILE_NAME=0414023.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 1-B3-PS class:Control | Tissue:plasma RAW_FILE_NAME=0414024.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 1-B5-PS class:Control | Tissue:plasma RAW_FILE_NAME=0414025.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-A2-PS class:Model | Tissue:plasma RAW_FILE_NAME=0414029.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-A4-PS class:Model | Tissue:plasma RAW_FILE_NAME=0414030.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-A5-PS class:Model | Tissue:plasma RAW_FILE_NAME=0414031.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-B1-PS class:Model | Tissue:plasma RAW_FILE_NAME=0414032.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-C3-PS class:Model | Tissue:plasma RAW_FILE_NAME=0414035.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-C4-PS class:Model | Tissue:plasma RAW_FILE_NAME=0414036.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-A2-PS class:GTSS | Tissue:plasma RAW_FILE_NAME=0415009.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-B2-PS class:GTSS | Tissue:plasma RAW_FILE_NAME=0415011.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-B3-PS class:GTSS | Tissue:plasma RAW_FILE_NAME=0415012.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-C2-PS class:GTSS | Tissue:plasma RAW_FILE_NAME=0415014.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-C4-PS class:GTSS | Tissue:plasma RAW_FILE_NAME=0415015.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-C5-PS class:GTSS | Tissue:plasma RAW_FILE_NAME=0415016.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 1-A1-HS class:Control | Tissue:heart RAW_FILE_NAME=140604014.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 1-A3-HS class:Control | Tissue:heart RAW_FILE_NAME=140604015.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 1-A5-HS class:Control | Tissue:heart RAW_FILE_NAME=140604016.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 1-B1-HS class:Control | Tissue:heart RAW_FILE_NAME=140604017.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 1-B2-HS class:Control | Tissue:heart RAW_FILE_NAME=140604018.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 1-B5-HS class:Control | Tissue:heart RAW_FILE_NAME=140604020.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-A1-HS class:Model | Tissue:heart RAW_FILE_NAME=140604022.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-A2-HS class:Model | Tissue:heart RAW_FILE_NAME=140604023.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-A3-HS class:Model | Tissue:heart RAW_FILE_NAME=140604024.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-A4-HS class:Model | Tissue:heart RAW_FILE_NAME=140604025.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-A5-HS class:Model | Tissue:heart RAW_FILE_NAME=140604026.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 2-C5-HS class:Model | Tissue:heart RAW_FILE_NAME=140604029.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-A1-HS class:GTSS | Tissue:heart RAW_FILE_NAME=140604051.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-A2-HS class:GTSS | Tissue:heart RAW_FILE_NAME=140604052.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-A4-HS class:GTSS | Tissue:heart RAW_FILE_NAME=140604054.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-B2-HS class:GTSS | Tissue:heart RAW_FILE_NAME=140604056.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-B3-HS class:GTSS | Tissue:heart RAW_FILE_NAME=140604057.d; lipid=Sph/Cer/CoQ SUBJECT_SAMPLE_FACTORS - 8-C5-HS class:GTSS | Tissue:heart RAW_FILE_NAME=140604058.d; lipid=Sph/Cer/CoQ #COLLECTION CO:COLLECTION_SUMMARY Blood samples of the rats were collected to obtain plasma by centrifugation CO:COLLECTION_SUMMARY (3000r/min, 15 min) using heparin as an anticoagulant and kept at -80℃ until CO:COLLECTION_SUMMARY analysis. Hearts were collected, washed with cold saline and cut in half. One CO:COLLECTION_SUMMARY part was grinded into powder in liquid nitrogen and kept at -80℃. Heart CO:COLLECTION_SUMMARY samples were homogenized in saline on ice at the ratio of tissue to solution was CO:COLLECTION_SUMMARY 1:4 (w/v) before analysis. CO:SAMPLE_TYPE Heart #TREATMENT TR:TREATMENT_SUMMARY Rats were divided into six rats in each group randomly as following: control TR:TREATMENT_SUMMARY rats group, MI model rats group, MI model rats pre-treated with diltiazem group TR:TREATMENT_SUMMARY (50 mg/kg, i.g.), and MI model rats pre-treated with GTSS group (200 mg/kg, TR:TREATMENT_SUMMARY i.g.). Pre-treated rats were consecutively administrated for 4 weeks. Except TR:TREATMENT_SUMMARY control rats group received saline, other rat groups received two injections of TR:TREATMENT_SUMMARY isoproterenol (85 mg/kg, s.c.) on the 27th and 28th days at an interval of 24 TR:TREATMENT_SUMMARY hours. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY 100μl of plasma or tissue homogenate was transferred into a 10 ml glass tube SP:SAMPLEPREP_SUMMARY and added 20 μl of lipid internal standards. After vortexed for 10 s, 1.5 ml of SP:SAMPLEPREP_SUMMARY methanol and 5 ml methyl tert-butyl ether were added to the tube, and the sample SP:SAMPLEPREP_SUMMARY was vortexed for 15 min and then added 1.5 ml water, then centrifuged at SP:SAMPLEPREP_SUMMARY 4500r/min for 10 min (4 ℃). The upper organic phase was transferred to another SP:SAMPLEPREP_SUMMARY glass tube, and the lower water phase was added with 2 ml secondary extractant SP:SAMPLEPREP_SUMMARY (methyl tert-butyl ether /methanol/water,10:3:2.5, v/v/v). After vortexed for SP:SAMPLEPREP_SUMMARY 10min and centrifuged for 15min at 4500rpm, and the upper organic phase was SP:SAMPLEPREP_SUMMARY combined and dried under a gentle nitrogen stream. The residue was re-dissolved SP:SAMPLEPREP_SUMMARY in 100 μl methanol/chloroform (1:1, v/v). #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Agilent 1100 CH:COLUMN_NAME Peeke C8 SR (150×3.0mm, 3µm) #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Agilent 6410 QQQ MS:INSTRUMENT_TYPE Triple quadrupole MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS The parameters for electrospray ionization tandem MS in positive ion mode were MS:MS_COMMENTS as follows: gas temperature, 350 ℃; gas flow rate, 10 l/min; nebulizer, 30 MS:MS_COMMENTS psi; and capillary voltage, 4000V. Multiple reaction monitoring was performed MS:MS_COMMENTS using the characteristic precursor-to-product ion transitions, optimized MS:MS_COMMENTS fragmentor voltages, and collision energies. #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS pmol/ml(PS) & pmol/mg(HS) MS_METABOLITE_DATA_START Samples 1-A2-PS 1-A3-PS 1-A5-PS 1-B2-PS 1-B3-PS 1-B5-PS 2-A2-PS 2-A4-PS 2-A5-PS 2-B1-PS 2-C3-PS 2-C4-PS 8-A2-PS 8-B2-PS 8-B3-PS 8-C2-PS 8-C4-PS 8-C5-PS 1-A1-HS 1-A3-HS 1-A5-HS 1-B1-HS 1-B2-HS 1-B5-HS 2-A1-HS 2-A2-HS 2-A3-HS 2-A4-HS 2-A5-HS 2-C5-HS 8-A1-HS 8-A2-HS 8-A4-HS 8-B2-HS 8-B3-HS 8-C5-HS Factors class:Control | Tissue:plasma class:Control | Tissue:plasma class:Control | Tissue:plasma class:Control | Tissue:plasma class:Control | Tissue:plasma class:Control | Tissue:plasma class:Model | Tissue:plasma class:Model | Tissue:plasma class:Model | Tissue:plasma class:Model | Tissue:plasma class:Model | Tissue:plasma class:Model | Tissue:plasma class:GTSS | Tissue:plasma class:GTSS | Tissue:plasma class:GTSS | Tissue:plasma class:GTSS | Tissue:plasma class:GTSS | Tissue:plasma class:GTSS | Tissue:plasma class:Control | Tissue:heart class:Control | Tissue:heart class:Control | Tissue:heart class:Control | Tissue:heart class:Control | Tissue:heart class:Control | Tissue:heart class:Model | Tissue:heart class:Model | Tissue:heart class:Model | Tissue:heart class:Model | Tissue:heart class:Model | Tissue:heart class:Model | Tissue:heart class:GTSS | Tissue:heart class:GTSS | Tissue:heart class:GTSS | Tissue:heart class:GTSS | Tissue:heart class:GTSS | Tissue:heart class:GTSS | Tissue:heart Sph 17_1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 10.9834 10.8571 8.3311 11.8855 12.0157 8.6259 8.6439 11.7206 9.9755 9.9756 9.4401 10.0899 8.5941 10.6909 8.11 10.1043 8.6885 8.3239 HexSph 18_1 0.3415 0.3038 0.1916 0.1879 2.612 6.3173 2.2849 22.5482 2.2413 18.8287 0.286 0.3836 2.3306 0.2201 0.1936 0.2253 0.197 0.2266 9.8534 9.5819 7.5137 10.2873 10.4598 7.4409 8.0937 10.9497 9.3546 9.2063 8.7755 9.4172 8.007 10.2034 7.7437 9.5169 8.1712 7.6628 Sph 18_1 158.6463 232.7365 262.6996 164.7632 279.1939 129.6911 337.1891 531.4029 260.036 661.886 798.9108 652.0142 383.3173 336.6321 317.1152 448.7637 474.1091 458.4849 49.4003 50.3106 35.2121 63.3438 73.012 47.3383 34.7473 48.5397 38.1276 52.0438 43.2108 43.0886 32.2931 33.9155 34.3241 25.5448 45.1589 38.8524 dhSph 18_0 72.4066 137.1868 111.3951 95.0421 163.7703 51.386 306.1136 413.0387 175.9263 426.9692 740.8603 550.28 229.5396 207.2816 183.2996 229.6178 285.9548 277.1837 10.8142 11.4332 9.4886 13.1481 13.7669 9.3006 13.8007 18.2189 14.9986 22.236 18.9412 17.3265 10.9166 13.3329 10.59 11.2229 11.7794 9.6216 Sph 18_1_1P 1112.1182 1781.7636 1968.5137 2413.5539 1906.469 2867.3933 4177.8362 2179.6012 1132.8182 2029.9334 4594.1282 3037.9124 2276.2858 2053.2478 2080.8648 2271.3456 3114.4137 2836.0184 15.7401 15.3408 12.2075 16.6857 17.0185 12.0573 13.2458 17.5452 15.2395 15.3489 14.2912 15.2306 13.0169 16.7437 12.7974 15.4649 13.2591 12.5525 dhSph 18_0_1P 251.5907 500.5693 537.5288 757.626 475.5225 746.5162 1444.6964 722.6238 279.0143 554.1353 1417.9321 1021.7681 797.6572 542.682 632.273 569.1788 1032.7263 964.8843 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Cer 10_0 107.7373 111.841 131.4995 106.984 104.2839 116.7891 113.0493 122.664 122.4673 127.3799 124.3682 118.9369 102.4178 100.1401 96.7831 96.273 110.9197 101.5681 139.1343 512.06 367.741 462.1592 2560.0343 389.7875 181.9079 94.7311 168.8226 254.8977 156.4196 327.3972 313.4561 46.5838 78.2085 20.0858 461.4995 41.5808 Cer 12_0 0.8176 0.5094 0.431 0.3093 0.2887 0.2711 0.1942 0.3188 0.2986 0.2869 0.1837 0.2404 0.2764 0.1751 0.2929 0.1916 0.1779 0.2001 0.0623 0.0798 0.0979 0.0794 0.1558 0.0458 0.0435 0.051 0.048 0.0516 0.0388 0.0381 0.0365 0.0219 0.016 0.0198 0.0335 0.0143 HexCer 14_0 37.6168 38.2169 39.4061 37.8102 42.5849 42.5076 45.7127 77.2991 44.4835 74.6208 44.0869 39.0677 36.3802 33.6899 34.2896 35.2675 35.7933 34.3482 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 HexCer 16_1 543.3658 898.429 333.9361 485.2844 690.9282 642.5449 932.8163 1437.8509 1024.6438 827.6524 1315.63 709.2299 500.6072 615.1059 922.8895 695.0493 812.0865 675.2831 8.0965 13.3104 15.1703 18.3257 18.79 14.7542 21.5601 18.5058 21.4912 21.8718 28.6033 25.3896 18.507 17.9019 14.9986 18.5881 13.6304 15.7217 Cer 12_1_1P 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5.5773 6.7949 4.0497 4.9275 5.5934 4.3866 4.0956 4.6875 4.1005 6.0193 4.1952 6.0388 3.6649 3.8524 2.5177 3.1318 2.6229 3.2891 Cer 14_0 10.9966 17.0376 10.7843 9.6139 14.2501 14.1789 8.7791 40.7747 11.3618 34.9401 9.0488 6.2812 2.8832 2.5869 3.944 5.0338 3.1831 4.1632 13.5244 19.2934 15.3482 19.1373 22.8533 19.1395 17.8272 15.716 15.9103 16.3755 21.6208 16.403 11.6036 3.4997 4.4196 3.6808 10.7698 14.1521 HexCer 16_0 1022.6805 1725.0362 880.7542 965.2177 1880.925 1874.0809 3140.2843 5687.5802 1937.0798 2443.9507 3075.4758 2170.8885 1270.0835 1403.4736 1671.4065 1718.9614 2108.0831 1953.7598 28.3607 36.9644 40.5873 48.8956 47.8485 36.2365 197.6355 112.3009 146.1449 250.5348 242.1113 313.1613 104.0659 136.54 116.7973 65.5094 57.1045 74.2393 Cer 12_0_1P 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 47.5511 41.4157 15.8506 27.229 23.2673 15.6557 7.9138 12.2515 8.689 15.3011 9.1937 12.4744 7.8772 8.2202 4.6805 8.0418 7.4958 7.0963 HexCer 18_1 419.3878 644.4753 503.1484 412.3683 435.903 4553.5456 2399.8658 9987.7368 2167.1062 6805.286 769.7695 624.4743 2484.3204 332.3902 365.6149 481.6297 584.1498 505.7784 21.8413 15.5107 11.3085 15.9829 14.3314 8.2716 23.7242 22.9579 23.8762 35.6384 23.5087 38.3586 27.1983 26.7671 21.3262 16.5953 20.2335 16.8838 Cer 16_0 100.0565 637.577 372.7618 183.5043 560.7524 434.8337 815.0517 1609.2119 742.1176 917.0212 481.6335 576.1487 133.3163 263.5962 260.3082 118.9466 242.8192 382.6973 659.1341 662.3684 365.0071 580.9797 538.7309 446.5532 787.7115 947.806 709.6062 1102.3265 786.2463 1036.1778 804.3332 636.2091 401.634 473.362 603.5089 497.2522 HexCer 18_0 153.3927 209.5119 159.5982 172.5225 705.2259 1148.6945 1018.1985 4704.6963 985.4297 6007.7082 300.3592 309.4841 533.9172 180.7671 181.4369 162.9945 170.3501 191.2906 4.0755 3.515 2.9506 4.9731 4.0729 3.8006 6.1335 7.5773 5.3527 11.2643 6.8309 9.193 4.7404 8.1671 4.9543 7.4569 3.0715 2.8547 Cer 18_1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2.6726 2.5628 0.9656 1.7636 1.6618 1.6002 1.4214 1.8204 1.4432 2.1751 1.4538 1.7143 1.6045 0.9525 0.7026 0.8925 1.1892 1.1476 dhCer 16_0 5.3555 7.8028 8.5291 8.8755 8.1011 7.1051 11.4706 20.4251 11.8737 8.5172 15.0227 7.3238 4.0067 4.4226 4.2292 4.7949 6.2329 6.4198 6.3999 5.7566 3.6084 5.2671 5.5567 4.4767 10.5874 13.8843 11.5933 12.7683 11.6216 14.4602 13.1729 7.9062 6.3504 6.5564 7.1365 8.0047 Cer (17_1) 18_0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1.3045 1.464 0.9391 0.7596 1.2259 0.5111 0.681 0.6663 0.7609 0.9883 0.7984 0.6648 0.7556 0.476 0.2093 0.3845 0.9172 0.5767 Cer 14_1_1P 246.5374 227.9089 214.0467 199.1363 214.9881 219.9546 212.2839 190.0363 177.8887 189.0128 238.6277 227.0234 199.7212 173.2414 162.9765 189.5964 175.0508 180.2793 7.3465 7.1734 5.6535 7.6594 7.8096 5.541 6.375 8.3816 7.4207 7.2821 6.7262 7.5633 6.1061 8.2677 6.0326 7.3422 6.1949 5.8155 dhCer 18_1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.1354 0.0401 0.0373 0.0658 0.3522 0.1952 0.3172 0.5394 0.5696 0.3584 0.5113 0.2199 0.3752 0.3593 0.076 0.0815 0.4156 0.197 Cer 14_0_1P 537.0101 1022.2347 399.6556 574.6348 934.9968 641.9762 1015.7421 4371.2162 961.8712 2253.3928 864.8764 813.7631 576.2082 416.5685 536.5916 539.6115 724.0145 732.6693 502.6671 556.6438 328.1862 463.4905 597.7317 414.1413 177.0112 221.1151 225.5959 158.9185 196.2421 174.7564 238.9021 101.6946 113.473 126.0109 266.3103 275.3201 HexCer 20_1 7897.1146 10487.523 7479.1882 5419.3342 234784.6837 4156319.421 2126685.787 6147220.069 2215248.75 3709621.498 13482.035 12609.5335 1880128.907 7073.8677 4937.1847 7825.7901 7241.0818 7339.4187 2.5058 1.8763 1.1913 3.5349 2.4751 2.3834 1.6723 1.9671 1.555 3.8932 2.6871 3.4883 3.1634 0.6893 0.6758 2.4961 2.1507 1.7985 Cer 18_0 4.374 8.6902 4.267 7.4195 98.1638 147.307 218.271 1403.3235 192.37 1485.6686 16.1808 16.1188 81.5624 10.5827 7.2377 8.3739 10.5208 17.4333 93.2645 82.3177 54.593 89.2535 86.3782 71.1568 60.1405 75.6291 66.3942 61.8277 55.5484 58.9607 63.4193 27.2445 23.5596 35.1292 56.5954 52.8854 HexCer 20_0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2.8148 3.0377 1.6426 4.1077 3.3106 1.3724 2.7576 2.5195 1.9539 6.2039 2.7992 4.1508 1.8507 3.6922 1.6732 2.5165 0.6626 0.784 Cer 16_1_1P 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 134.6071 151.3538 86.3564 130.3868 154.6803 107.4112 96.3011 101.7412 100.606 84.8375 88.7813 90.9698 107.306 49.6331 44.1024 53.5572 101.119 87.3363 dhCer 18_0 0.4907 0.9072 0.6314 3.6144 1.3175 2.3638 4.1827 20.2282 4.0823 19.8773 1.4414 2.5931 2.1773 0.7852 0.091 1.4526 0.877 1.868 3.4184 2.6132 2.1485 1.8821 2.9366 2.4209 4.4008 7.0913 7.2202 6.3599 5.8791 4.882 4.3175 2.4338 2.5813 2.649 3.6477 4.8786 Cer 16_0_1P 616.3974 817.4923 442.0376 466.1222 689.0316 937.6892 1427.683 4694.2655 984.554 2115.5762 940.0622 600.0658 1303.0125 688.9949 624.8657 698.1449 746.3986 794.7265 15.6711 10.0845 8.1298 14.4357 10.0646 9.7193 7.5279 9.9048 8.6985 8.645 8.3667 9.0162 8.7519 9.0563 6.2772 8.8784 8.7458 7.607 HexCer 22_1 124.199 140.2752 144.8133 131.0003 3855.3341 175514.0998 129267.717 259107.0679 104975.217 157207.2609 174.628 92.1383 128384.2395 182.6835 101.2454 111.1373 120.9541 115.627 1.7606 1.3093 1.2742 2.4953 2.0146 1.9057 0.8919 1.114 0.6473 10.9069 1.4879 2.9864 2.8034 1.4024 1.3254 3.7 2.5292 2.9836 HexCer 22_0 66.7904 527.5393 69.6685 63.2829 863.9975 33139.5826 25574.1349 52249.1231 20460.1828 30938.6803 906.4018 559.5463 24032.041 397.7027 404.1761 426.5491 404.579 521.2415 1.0081 1.4138 0.9804 1.2156 1.101 0.8345 1.7759 2.02 1.4273 4.907 1.9552 2.9299 2.3936 4.4163 2.2984 2.5796 1.6545 1.7935 Cer 18_0_1P 496.1686 815.5135 469.6005 947.0698 821.7377 1376.3559 2350.3373 3377.9894 1732.9942 1411.3007 1293.7389 898.445 1351.1462 656.1097 797.822 766.4311 969.0634 1075.402 24.418 25.2352 19.106 29.3346 27.8416 22.7309 42.441 52.2795 41.4124 52.5501 41.2274 57.8848 69.6995 58.7072 38.1493 34.1756 53.3677 41.3018 dhCer 20_0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.4262 0.5704 0.3177 0.4113 0.5941 0.4276 0.1744 0.291 0.2287 0.1707 0.216 0.2249 0.4933 0.1121 0.1335 0.2823 0.6879 0.4277 Cer 20_0 15.9608 35.7461 13.5023 17.5649 36.1724 65.2515 128.9593 647.7283 108.4311 414.8969 52.3598 44.0165 62.6879 22.7242 27.7473 27.8541 36.455 49.4644 34.9037 44.0679 26.8532 38.5121 48.7332 36.1893 19.2842 29.8308 25.0778 18.2895 18.1373 19.4054 35.1217 18.3691 14.6923 25.8077 34.3927 34.4073 HexCer 24_1 200.8384 372.1323 167.1597 206.9438 1117.0135 23823.5955 19590.476 68427.9591 18383.1004 44690.415 770.4509 432.5535 3693.6907 331.475 341.3279 325.6346 346.7252 395.7627 0.3615 0.5777 0.218 0.6053 0.8105 0.2866 1.4189 1.6091 1.0339 4.3967 1.4107 2.8649 2.0546 2.4902 1.9683 2.3729 1.3253 0.9669 dhCer 16_1_1P 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 7.6588 7.488 5.8273 8.0203 8.0878 5.8293 6.2311 8.4133 7.2008 7.1453 6.8287 7.1873 6.2292 7.9674 5.9993 7.3404 6.4917 6.1439 Cer (17_1) 24_1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.1146 0.0924 0.0628 0.0699 0.0363 0.0725 0.0587 0.0621 0.0136 0.0548 0.0747 0.0356 0.0339 0.0922 0.0464 0.0778 0.1005 0.0693 HexCer 24_0 471.3127 669.9087 361.5796 674.6814 3177.7669 6054.9089 8575.4683 43584.9746 7101.8025 41658.5059 1351.9592 792.7782 3776.5665 585.5263 604.2801 754.2631 704.5812 826.2274 0.638 0.6794 0.6123 1.1139 0.9531 0.6527 1.917 1.9953 1.628 3.49 1.7108 3.0299 1.6529 2.5212 2.1495 2.3007 2.1367 1.3959 Cer 20_0_1P 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 7.7424 7.575 5.8891 8.1899 8.0415 5.9015 6.4944 8.4627 7.4729 7.6438 7.0456 7.8086 7.2741 8.9278 6.5493 7.6418 7.1778 6.6119 Cer 22_0 129.0949 456.0852 106.0092 185.4358 270.815 423.4671 734.0088 1023.7976 651.1946 457.672 553.6494 393.6134 365.3985 128.2638 204.7849 148.9298 293.198 378.5077 60.6952 76.5094 51.5267 61.7692 78.9938 66.8533 37.8808 58.8576 46.0177 39.2302 38.0932 40.8675 57.2547 30.991 26.4999 37.5847 66.8934 57.8438 dhCer 22_0 167.6675 380.3816 127.7802 208.9555 254.6648 485.0812 632.1823 1149.1098 615.8523 546.969 675.8122 581.9456 377.0258 152.0936 72.5575 229.5146 408.3867 260.1804 61.3625 74.1993 48.6128 65.2616 77.3441 63.9429 32.4864 59.7391 37.2657 42.1706 42.4609 40.5105 58.7483 29.0188 28.2636 36.4994 68.2504 56.9899 Cer 24_1 454.0945 820.8499 509.6462 605.6466 764.6696 1246.4079 1872.6885 2565.998 1539.1109 1619.353 1412.8187 1023.6073 1021.04 571.1339 749.2524 503.924 819.0862 1014.6758 27.2826 31.427 22.0877 35.153 33.2125 31.6246 50.0069 73.1813 50.8704 70.3114 53.7516 66.3656 81.4913 62.5211 41.2716 45.3482 69.1405 48.5344 dhCer 16_0_1P 374.3061 671.4241 381.8767 416.2841 528.6261 655.0835 785.5124 1344.1858 832.499 871.2613 692.5579 414.8134 638.7307 426.0544 474.6212 440.018 684.4284 595.3144 17.0559 18.4709 12.5811 15.3804 17.8654 12.6731 9.2483 12.4925 10.6388 10.333 10.125 10.7193 13.207 15.4816 11.6013 14.3987 17.87 15.5246 dhCer 18_1_1P 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 7.6435 7.564 5.7746 7.9423 8.1827 5.8138 6.2491 8.3999 7.0907 6.9708 6.7647 7.2072 6.1352 7.8479 5.8711 7.2097 6.4214 6.0231 dhCer 24_1 12.9944 23.6756 14.1184 58.7139 19.1009 52.258 50.6278 144.6863 46.3839 99.0561 41.5692 23.081 22.3102 13.9531 13.2678 26.1573 26.2224 20.9524 0.5626 0.3809 0.4506 0.6617 0.5795 0.5119 0.5842 0.8892 0.6895 0.8519 0.6779 0.9394 1.5565 1.8641 1.601 1.4322 1.6378 1.4141 dhCer 18_0_1P 334.236 554.1681 330.5712 334.3786 529.8216 715.6831 814.7847 1391.6954 849.2351 865.0533 676.0171 414.9331 685.0219 354.7989 475.4889 427.2179 864.8637 661.8912 10.0321 9.9723 7.6664 10.1226 10.2909 7.8994 7.7865 10.4749 9.0521 9.0554 8.4285 9.4149 8.7753 10.1109 7.8487 8.848 9.1051 8.192 Cer 24_0 2384.1891 5248.2163 2261.7247 2728.631 5193.3862 6279.6568 8584.2831 12991.9742 7659.6146 7173.9571 5959.2447 3663.4821 5033.127 2719.9259 3400.5855 2430.2207 4805.0067 3913.7744 129.1564 148.0359 101.3719 117.8036 132.8008 122.2465 93.2952 125.9795 102.4303 115.9017 105.3846 119.3762 123.1244 96.7812 70.5631 78.8959 116.7268 99.3602 dhCer 24_0 63.818 103.4722 40.1303 213.1634 83.9078 151.8757 265.7715 658.3602 246.5255 287.6126 262.9122 125.5014 105.1836 62.6238 63.3272 101.7665 152.9274 100.1537 5.3482 5.0759 5.2977 5.9792 6.2091 4.4491 5.7617 8.0287 6.8812 8.301 7.2223 8.0134 5.7584 6.0759 6.3202 6.1604 6.0042 5.3611 Cer 26_1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.6627 0.6006 0.4701 0.4888 0.5585 1.3409 0.5744 0.8628 0.6758 0.6695 0.2677 0.6992 0.6128 0.6555 0.4662 1.8124 0.5354 0.4776 Cer 26_0 27.1907 138.4398 16.498 73.2903 141.0313 210.781 390.0075 800.3701 382.4655 351.5719 307.2601 158.7936 240.2218 116.396 115.9517 109.5525 246.8211 183.0255 4.8424 5.1002 3.6239 4.8341 4.8182 4.9021 3.3006 4.6563 3.7754 3.5907 4.1873 4.1773 3.7173 2.8919 2.6723 2.4354 4.4708 3.3621 CoQ8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.1256 0.108 0.096 0.1075 0.1253 0.0937 0.0595 0.067 0.0809 0.075 0.068 0.0836 0.0928 0.0727 0.0898 0.072 0.1032 0.0836 Cer 24_0_1P 299.511 284.7382 219.1124 214.322 243.5179 295.998 253.5646 654.1684 231.3749 296.2186 205.2576 185.8511 585.7952 274.8816 250.3612 300.1836 313.8586 264.543 10.37 9.6932 8.0834 10.1951 10.6545 7.7562 7.5132 9.9099 8.9507 8.7321 8.1985 9.0118 8.0841 9.3843 7.7982 8.6315 8.4733 7.7586 CoQ9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 1.7908 1.2991 1.4796 1.8702 1.337 1.0099 1.2492 1.1697 1.2107 1.1315 1.2525 1.444 1.4239 1.3241 1.4785 1.4664 1.4712 dhCer 28_0_1P 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 7.3726 7.1637 5.6232 7.6802 7.8182 5.5583 6.0546 8.1861 7.0013 6.8793 6.5615 7.0415 6.0181 7.6443 5.8005 7.1351 6.1255 5.7444 CoQ10 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.1653 0.1518 0.106 0.0966 0.1867 0.1182 0.0851 0.1091 0.106 0.07 0.0927 0.094 0.1218 0.1179 0.0911 0.1155 0.1529 0.1613 Cer 28_0_1P 243.6464 327.4467 219.5332 268.7156 332.099 515.7786 666.5566 1218.6706 873.4622 965.4556 521.2562 429.87 504.843 329.1046 290.8421 375.3408 410.3722 521.8068 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name Sph 17_1 HexSph 18_1 Sph 18_1 dhSph 18_0 Sph 18_1_1P dhSph 18_0_1P Cer 10_0 Cer 12_0 HexCer 14_0 HexCer 16_1 Cer 12_1_1P Cer 14_0 HexCer 16_0 Cer 12_0_1P HexCer 18_1 Cer 16_0 HexCer 18_0 Cer 18_1 dhCer 16_0 Cer (17_1) 18_0 Cer 14_1_1P dhCer 18_1 Cer 14_0_1P HexCer 20_1 Cer 18_0 HexCer 20_0 Cer 16_1_1P dhCer 18_0 Cer 16_0_1P HexCer 22_1 HexCer 22_0 Cer 18_0_1P dhCer 20_0 Cer 20_0 HexCer 24_1 dhCer 16_1_1P Cer (17_1) 24_1 HexCer 24_0 Cer 20_0_1P Cer 22_0 dhCer 22_0 Cer 24_1 dhCer 16_0_1P dhCer 18_1_1P dhCer 24_1 dhCer 18_0_1P Cer 24_0 dhCer 24_0 Cer 26_1 Cer 26_0 CoQ8 Cer 24_0_1P CoQ9 dhCer 28_0_1P CoQ10 Cer 28_0_1P METABOLITES_END #END