#METABOLOMICS WORKBENCH t_ktmt_0211_20240805_184830 DATATRACK_ID:5084 STUDY_ID:ST003452 ANALYSIS_ID:AN005668 PROJECT_ID:PR002126 VERSION 1 CREATED_ON August 28, 2024, 10:43 am #PROJECT PR:PROJECT_TITLE Integrative proteomic and lipidomic analysis of GNB1 and SCARB2 knockdown in PR:PROJECT_TITLE human subcutaneous adipocytes PR:PROJECT_TYPE Multi-omics (Proteomics and Lipidomics) PR:PROJECT_SUMMARY This project focuses on the knockdown of two candidate genes, GNB1 and SCARB2, PR:PROJECT_SUMMARY identified through a comprehensive integration of genome-wide association PR:PROJECT_SUMMARY studies (GWAS) related to BMI and proteomics data from previous studies using PR:PROJECT_SUMMARY human subcutaneous adipocytes before and after fat accumulation. We aim to PR:PROJECT_SUMMARY understand the regulatory roles of these genes in fat accumulation by performing PR:PROJECT_SUMMARY an integrated analysis of changes in the proteome and lipidome using mass PR:PROJECT_SUMMARY spectrometry following gene knockdown. PR:INSTITUTE Hamamatsu University School of Medicine PR:LAST_NAME Kitamoto PR:FIRST_NAME Takuya PR:ADDRESS 1-20-1 Handayama, Chuo-ku, Hamamatsu 431-3192, Japan PR:EMAIL t.ktmt@hama-med.ac.jp PR:PHONE +81-53-435-2987 #STUDY ST:STUDY_TITLE Integrated Proteomic and Lipidomic Analysis ST:STUDY_SUMMARY GNB1 and SCARB2 genes were knocked down in human subcutaneous adipocytes using ST:STUDY_SUMMARY RNA interference. Both proteomic and lipidomic analyses were performed using ST:STUDY_SUMMARY mass spectrometry. The proteomic results revealed significant changes in the ST:STUDY_SUMMARY expression levels of key proteins involved in lipid metabolism and adipogenesis. ST:STUDY_SUMMARY The lipidomic analysis identified significant changes in lipid species, ST:STUDY_SUMMARY including phosphatidylcholines, ceramides, and cholesterol esters. This ST:STUDY_SUMMARY integrated analysis provides insights into the molecular pathways and lipid ST:STUDY_SUMMARY metabolism regulated by GNB1 and SCARB2 in adipocyte function. ST:INSTITUTE Hamamatsu University School of Medicine ST:LAST_NAME Kitamoto ST:FIRST_NAME Takuya ST:ADDRESS 1-20-1 Handayama, Chuo-ku, Hamamatsu 431-3192, Japan ST:EMAIL t.ktmt@hama-med.ac.jp ST:PHONE +81-53-435-2987 #SUBJECT SU:SUBJECT_TYPE Cultured cells SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 SU:AGE_OR_AGE_RANGE 38 SU:GENDER Female SU:CELL_BIOSOURCE_OR_SUPPLIER Zen-Bio, Inc. (Research Triangle Park, NC, USA) SU:SUBJECT_COMMENTS The cell line was derived from abdominal subcutaneous adipose tissue #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 NC_1 proteome_nc_1 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:Negative Control Analysis Method=proteome; RAW_FILE_NAME=proteome_nc_1.raw SUBJECT_SAMPLE_FACTORS NC_2 proteome_nc_2 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:Negative Control Analysis Method=proteome; RAW_FILE_NAME=proteome_nc_2.raw SUBJECT_SAMPLE_FACTORS NC_3 proteome_nc_3 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:Negative Control Analysis Method=proteome; RAW_FILE_NAME=proteome_nc_3.raw SUBJECT_SAMPLE_FACTORS GNB1_1 proteome_GNB1_1 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:GNB1 Analysis Method=proteome; RAW_FILE_NAME=proteome_GNB1_1.raw SUBJECT_SAMPLE_FACTORS GNB1_2 proteome_GNB1_2 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:GNB1 Analysis Method=proteome; RAW_FILE_NAME=proteome_GNB1_2.raw SUBJECT_SAMPLE_FACTORS GNB1_3 proteome_GNB1_3 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:GNB1 Analysis Method=proteome; RAW_FILE_NAME=proteome_GNB1_3.raw SUBJECT_SAMPLE_FACTORS SCARB2_1 proteome_SCARB2_1 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:SCARB2 Analysis Method=proteome; RAW_FILE_NAME=proteome_SCARB2_1.raw SUBJECT_SAMPLE_FACTORS SCARB2_2 proteome_SCARB2_2 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:SCARB2 Analysis Method=proteome; RAW_FILE_NAME=proteome_SCARB2_2.raw SUBJECT_SAMPLE_FACTORS SCARB2_3 proteome_SCARB2_3 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:SCARB2 Analysis Method=proteome; RAW_FILE_NAME=proteome_SCARB2_3.raw SUBJECT_SAMPLE_FACTORS NC_1 lipidome_nc_1 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:Negative Control Analysis Method=lipidome; RAW_FILE_NAME=lipidome_nc_1.raw SUBJECT_SAMPLE_FACTORS NC_2 lipidome_nc_2 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:Negative Control Analysis Method=lipidome; RAW_FILE_NAME=lipidome_nc_2.raw SUBJECT_SAMPLE_FACTORS NC_3 lipidome_nc_3 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:Negative Control Analysis Method=lipidome; RAW_FILE_NAME=lipidome_nc_3.raw SUBJECT_SAMPLE_FACTORS GNB1_1 lipidome_GNB1_1 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:GNB1 Analysis Method=lipidome; RAW_FILE_NAME=lipidome_GNB1_1.raw SUBJECT_SAMPLE_FACTORS GNB1_2 lipidome_GNB1_2 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:GNB1 Analysis Method=lipidome; RAW_FILE_NAME=lipidome_GNB1_2.raw SUBJECT_SAMPLE_FACTORS GNB1_3 lipidome_GNB1_3 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:GNB1 Analysis Method=lipidome; RAW_FILE_NAME=lipidome_GNB1_3.raw SUBJECT_SAMPLE_FACTORS SCARB2_1 lipidome_SCARB2_1 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:SCARB2 Analysis Method=lipidome; RAW_FILE_NAME=lipidome_SCARB2_1.raw SUBJECT_SAMPLE_FACTORS SCARB2_2 lipidome_SCARB2_2 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:SCARB2 Analysis Method=lipidome; RAW_FILE_NAME=lipidome_SCARB2_2.raw SUBJECT_SAMPLE_FACTORS SCARB2_3 lipidome_SCARB2_3 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:SCARB2 Analysis Method=lipidome; RAW_FILE_NAME=lipidome_SCARB2_3.raw #COLLECTION CO:COLLECTION_SUMMARY Primary cultured human preadipocytes were obtained from Zen-Bio, Inc., derived CO:COLLECTION_SUMMARY from the abdominal subcutaneous adipose tissue of a 38-year-old Caucasian woman. CO:COLLECTION_SUMMARY The cells were grown, differentiated, and collected as mature adipocytes on day CO:COLLECTION_SUMMARY 14. All experiments were performed in three independent replicates. CO:SAMPLE_TYPE White adipose #TREATMENT TR:TREATMENT_SUMMARY siRNA transfection was performed to knock down the expression of GNB1 and SCARB2 TR:TREATMENT_SUMMARY genes in differentiated human subcutaneous adipocytes. Three rounds of TR:TREATMENT_SUMMARY transfection were carried out over a period of 14 days. Following the final TR:TREATMENT_SUMMARY transfection, cells were harvested for both proteomic and lipidomic analyses. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Proteomics: Cells were lysed, proteins were extracted, and concentrations were SP:SAMPLEPREP_SUMMARY determined using the BCA assay. Proteins were precipitated, reduced, alkylated, SP:SAMPLEPREP_SUMMARY and digested with trypsin. Peptides were purified using a MonoSpin C18 column SP:SAMPLEPREP_SUMMARY and analyzed using an EASY-nLC 1200 and a Q-Exactive Orbitrap mass spectrometer SP:SAMPLEPREP_SUMMARY (Thermo Fisher Scientific). Data were processed using Proteome Discoverer 2.2 SP:SAMPLEPREP_SUMMARY software (Thermo Fisher Scientific). Lipidomics: Lipids were extracted using the SP:SAMPLEPREP_SUMMARY Bligh and Dyer method, dissolved in methanol, and analyzed using an Ultimate SP:SAMPLEPREP_SUMMARY 3000 and a Q-Exactive Orbitrap mass spectrometer (Thermo Fisher Scientific). SP:SAMPLEPREP_SUMMARY Data were processed using LipidSearch software version 5.1.9 (Thermo Fisher SP:SAMPLEPREP_SUMMARY Scientific). #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY HPLC lipidome analysis. C18 column (Acclaim 120 C18 column (3 μm, 2.1 mm × 150 CH:CHROMATOGRAPHY_SUMMARY mm), gradient elution with aqueous and organic solvents containing ammonium CH:CHROMATOGRAPHY_SUMMARY formate and formic acid. Flow rate: 300 μL/min, column at 50°C. 70-min CH:CHROMATOGRAPHY_SUMMARY gradient. Solvent A: 5 mM ammonium formate in water/methanol/acetonitrile CH:CHROMATOGRAPHY_SUMMARY (2:1:1) with 0.1% formic acid; Solvent B: 5 mM ammonium formate in CH:CHROMATOGRAPHY_SUMMARY isopropanol/acetonitrile (9:1) with 0.1% formic acid CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Thermo Dionex Ultimate 3000 CH:COLUMN_NAME Thermo Acclaim (150 x 2.1mm, 3um) CH:SOLVENT_A 50% water/25% methanol/25% acetonitrile; 5 mM ammonium formate; 0.1% formic acid CH:SOLVENT_B 90% isopropanol/10% acetonitrile; 5 mM ammonium formate; 0.1% formic acid CH:FLOW_GRADIENT 20% to 100% B over 50 min, 100% B for 10 min, then return to 20% B CH:FLOW_RATE 300 μL/min CH:COLUMN_TEMPERATURE 50℃ #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS MS acquisition Comments: Full scan MS followed by data-dependent MS/MS Data MS:MS_COMMENTS processing Comments: Raw data processed using LipidSearch for lipidomics MS:MS_COMMENTS Software/procedures used for feature assignments: LipidSearch for lipid MS:MS_COMMENTS identification #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS Relative abundance (isotope normalized) MS_METABOLITE_DATA_START Samples lipidome_nc_1 lipidome_nc_2 lipidome_nc_3 lipidome_GNB1_1 lipidome_GNB1_2 lipidome_GNB1_3 lipidome_SCARB2_1 lipidome_SCARB2_2 lipidome_SCARB2_3 Factors Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:Negative Control Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:Negative Control Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:Negative Control Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:GNB1 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:GNB1 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:GNB1 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:SCARB2 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:SCARB2 Sample source:Human subcutaneous adipocytes | Gene Knockdown Target:SCARB2 Ch 54.11270089 52.34504381 49.32844933 58.48100479 57.01645176 51.91968085 50.2294754 52.02238806 52.77740662 ChE(18:1) 0.647022643 0.607728551 0.363605943 0.291146055 0.267923364 0.277150196 0.402352054 0.352025027 0.439692735 ChE(18:2) 0.147860685 0.166605793 0.113264623 0.082685933 0.071375223 0.055739258 0.082129877 0.080449408 0.086463545 ChE(19:2) 0.771614193 0.684977538 0.623577834 0.57291401 0.711024517 0.557093339 0.740382637 0.74539155 0.690862731 ChE(20:3) 0.234240572 0.279082508 0.210209477 0.135109789 0.129644423 0.133295928 0.2593705 0.224185953 0.227079366 ChE(20:4) 0.473609349 0.551773257 0.376924107 0.324918544 0.362396493 0.307024762 0.474216554 0.426668461 0.387438273 ChE(22:3) 0.149390689 0.153844187 0.131672467 0.087111489 0.089920442 0.086962919 0.140410067 0.136786868 0.133344092 ChE(22:4) 0.425787106 0.44004529 0.403928524 0.247799972 0.27493749 0.283234832 0.525132003 0.506054898 0.503146887 ChE(22:5) 0.2849383 0.307852734 0.334172132 0.187315484 0.206715376 0.185760954 0.429266955 0.39602395 0.343995094 ChE(22:6) 0.077165264 0.08721648 0.132368492 0.112024366 0.115073876 0.095162215 0.180909278 0.207699812 0.177303683 ChE(24:3) 0.050740015 0.056780744 0.049079775 0.030216745 0.031806137 0.032106431 0.040080916 0.042646663 0.039776652 ChE(24:4) 0.075389228 0.084915446 0.072744613 0.042867262 0.045192401 0.044978928 0.096485634 0.08650767 0.091953652 ChE(24:5) 0.045204321 0.056086782 0.049541561 0.03254002 0.039379769 0.032345827 0.047719948 0.051241254 0.042500726 DG(12:0_14:0) 0.002014501 0.003248698 0.002756841 0.001879153 0.001039065 0.001967266 0.001012373 0.001802603 0.002696144 DG(14:0_16:0) 0.017294707 0.028685909 0.014458626 0.013499681 0.014816856 0.01423491 0.016127758 0.019721156 0.020533007 DG(14:0_16:1) 0.027442886 0.06106873 0.02502664 0.020699992 0.025756173 0.018903919 0.022928965 0.021869404 0.024839216 DG(14:1_16:1) 0.009162648 0.024585931 0.00828482 0.006401787 0.01011418 0.006905653 0.008338178 0.007989895 0.008312092 DG(16:0_16:1) 0.162742734 0.441208832 0.161042714 0.143409476 0.187300186 0.132282495 0.158400417 0.144253645 0.157401961 DG(16:0_18:0) 0.008934509 0.013180518 0.010319075 0.012120236 0.008456901 0.009904193 0.01202743 0.010598938 0.011480065 DG(16:0_18:1) 0.125847189 0.287827331 0.129105084 0.150648089 0.167119325 0.137111638 0.161605546 0.154892556 0.16624183 DG(16:0_19:1) 0.006551593 0.012448104 0.008283315 0.010649754 0.011809214 0.00911766 0.012261479 0.012109875 0.013212745 DG(16:0_20:4) 0.00415535 0.008691044 0.004746997 0.005389825 0.006181835 0.004891647 0.007884615 0.005972116 0.005910131 DG(16:0_22:6) 0.002447265 0.005668965 0.003043256 0.00379028 0.004172579 0.003708655 0.005427475 0.004651445 0.004868627 DG(16:1_16:1) 0.106631552 0.29291792 0.098139731 0.079252824 0.118357032 0.069168301 0.093205874 0.080289076 0.103653595 DG(16:1_16:2) 0.000760883 0.00178497 0.000568074 0.000856754 0.000999787 0.000629066 0.000937612 0.000956063 0.000956176 DG(16:1_17:1) 0.002972332 0.00467762 0.002990729 0.003077521 0.003049661 0.002686482 0.003051096 0.003071182 0.003772549 DG(16:1_18:1) 0.157237594 0.428775765 0.160380482 0.16916928 0.207952988 0.159671974 0.190515057 0.206667306 0.199388889 DG(16:1_19:1) 0.012298832 0.027114355 0.012876193 0.009634461 0.017282221 0.013014052 0.017915176 0.018211179 0.018417974 DG(16:1_20:4) 0.001991972 0.005346219 0.002188254 0.002279664 0.002514508 0.002085565 0.003014162 0.002725281 0.002884542 DG(16:1_22:6) 0.002572884 0.005983276 0.003209416 0.003314552 0.003811162 0.003195401 0.004493143 0.00421943 0.00444085 DG(18:0_18:1) 0.014619241 0.022629649 0.016926643 0.025484748 0.021137533 0.02011725 0.025551953 0.021787222 0.023619281 DG(18:0_20:0) 0.000563492 0.000788271 0.000576232 0.000617308 0.000332521 0.000464528 0.000519902 0.000648951 0.000694641 DG(18:0_20:3) 0.001381203 0.002142558 0.00154303 0.002181965 0.001716956 0.001998859 0.00185562 0.001633058 0.00142366 DG(18:0_20:4) 0.004734738 0.006496736 0.005023931 0.006075106 0.005191365 0.00578197 0.008307618 0.006871323 0.00620817 DG(18:0_22:4) 0.002285506 0.003315228 0.001991421 0.003090288 0.002846421 0.002767234 0.003711688 0.00283781 0.002833399 DG(18:1_16:2) 0.007772243 0.019003521 0.00734716 0.008714647 0.010140365 0.007212008 0.009324314 0.009045152 0.009334314 DG(18:1_18:2) 0.010407095 0.019005355 0.011924987 0.013494685 0.014882623 0.013045987 0.015900417 0.01438987 0.01525915 DG(18:1_20:1) 0.00476742 0.00752549 0.005147046 0.008203392 0.007207624 0.008527077 0.009269529 0.008308071 0.010132353 DG(18:1_20:4) 0.007258218 0.014192768 0.007715903 0.009624469 0.009920531 0.008887951 0.009620975 0.011057496 0.012212745 DG(18:1_22:1) 0.001061778 0.001613438 0.001031396 0.001600849 0.001335597 0.001603495 0.002033505 0.001578249 0.001603693 DG(18:1_22:2) 0.000887613 0.001177437 0.000780139 0.001377446 0.001181256 0.001320042 0.001056835 0.001081031 0.000833725 DG(18:1_22:4) 0.003404937 0.005508692 0.003144397 0.004961281 0.005042475 0.004768238 0.006941711 0.005833653 0.005826144 DG(18:1_22:5) 0.002071963 0.003802171 0.001914121 0.003853285 0.00357854 0.002070875 0.004878876 0.004478767 0.004401634 DG(4:0_16:1) 0.002670675 0.008439815 0.0021543 0.001823031 0.00260978 0.00129552 0.000860428 0.000891532 0.000928627 DG(4:0_18:1) 0.002864418 0.007451405 0.002591162 0.002385467 0.003349572 0.002008874 0.001301096 0.00127603 0.001378791 LPC(15:0) 0.020285119 0.028384835 0.005789018 0.007127031 0.01338572 0.01254558 0.01941482 0.03041231 0.047336351 LPC(16:0) 0.00802205 0.013199334 0.003938597 0.005984323 0.007632324 0.007803335 0.008331316 0.009546858 0.012924791 LPC(18:0) 0.00272947 0.003994802 0.002530355 0.003151069 0.003526484 0.003807224 0.003770517 0.003363609 0.004089601 LPC(18:1) 0.012074387 0.016584778 0.003181179 0.005164181 0.012547536 0.011709151 0.013589491 0.016903695 0.021344011 LPC(20:4) 0.002789898 0.002948525 0.00092613 0.001071449 0.002909682 0.002095308 0.004700981 0.004412011 0.00470195 LPE(15:0) 0.139040944 0.186202123 0.067992099 0.093690926 0.099920823 0.128871893 0.1451997 0.173081846 0.206095718 LPE(16:0) 0.324298284 0.517766497 0.177602199 0.213642092 0.26125099 0.326724518 0.295209076 0.287583766 0.282079885 LPE(18:0) 0.282264127 0.497669589 0.218275507 0.299771582 0.31594616 0.419193999 0.266585412 0.28279497 0.284094998 LPE(18:1) 2.18154097 3.086294416 0.831355204 2.061357908 2.317102138 2.545080159 2.175229702 2.21466757 2.238646995 LPE(20:4) 3.099833769 3.399746193 2.569134318 3.190768746 3.079572447 3.777687895 3.504969061 3.439424742 2.937387549 LPE(22:5) 0.28250765 0.318274112 0.419082789 0.166020794 0.26722882 0.273106339 0.254969061 0.290068519 0.310176322 LPE(22:6) 0.350323462 0.405618366 0.41325146 0.259152489 0.569437846 0.602037064 0.533583349 0.390738649 0.41756747 MG(16:0) 0.101340594 0.124155018 0.090807596 0.101179901 0.078481536 0.101799222 0.094773141 0.080259906 0.097015905 MG(16:1) 0.329039748 0.643012266 0.180518246 0.301622364 0.464400234 0.339501522 0.279882016 0.298928919 0.299058806 MG(18:0) 0.318176793 0.321230845 0.308314848 0.310994536 0.233282764 0.325276514 0.326303461 0.286222006 0.405515832 MG(18:1) 0.578804798 0.90909369 0.391390196 0.723695237 1.043236907 0.802989663 0.766938492 0.763425961 0.60641325 MG(18:2) 0.072063132 0.098222861 0.116217732 0.094469212 0.220839224 0.103321178 0.104836471 0.104954685 0.100350212 PC(13:0_16:1) 0.001012053 0.001866263 0.001111462 0.001141957 0.001246183 0.001178992 0.000883661 0.000987028 0.000862092 PC(13:1_16:1) 0.000114862 0.000272384 0.000147814 0.000131198 0.000165729 0.000160132 0.0000999 0.000107461 0.0000921 PC(14:0_16:0) 0.005875869 0.007791663 0.006400534 0.00783021 0.008099938 0.01022202 0.006494029 0.006826739 0.005996394 PC(15:0_16:0) 0.000588435 0.000738567 0.000563898 0.000923167 0.000782175 0.00084171 0.00077588 0.000690198 0.000592542 PC(15:0_18:1) 0.002304105 0.002736431 0.001943485 0.003261133 0.00332319 0.003287444 0.003309279 0.002616744 0.00264341 PC(15:0_20:5) 0.000772512 0.001109508 0.000754896 0.00118456 0.001105499 0.001142045 0.001111645 0.001086457 0.00090891 PC(15:0_22:5) 0.000682767 0.000661656 0.000640663 0.0005616 0.000730267 0.000605548 0.000835909 0.000923114 0.000763418 PC(15:0_22:6) 0.000166028 0.000251168 0.00016863 0.0001905 0.000300838 0.000214563 0.000167986 0.000214676 0.000232275 PC(15:1_16:1) 0.000468013 0.000775468 0.00052775 0.000655717 0.000596653 0.000585835 0.000558066 0.000553297 0.00044167 PC(16:0_16:0) 0.011403328 0.016271619 0.01169181 0.016325202 0.015747448 0.019096231 0.013934479 0.014106608 0.011762416 PC(16:0_16:1) 0.049538937 0.074695146 0.0503757 0.066384464 0.064860097 0.06963224 0.059101794 0.060441843 0.052852462 PC(16:0_18:0) 0.00171782 0.002106798 0.001693841 0.00278547 0.002588129 0.003336554 0.002435021 0.002283857 0.001909225 PC(16:0_18:1) 0.087912421 0.123243803 0.089502161 0.145955169 0.14263593 0.154516001 0.127522511 0.133604719 0.106523388 PC(16:0_18:3) 0.000354057 0.00049352 0.000389843 0.00058201 0.000579134 0.000649179 0.000493358 0.000511866 0.000374676 PC(16:0_20:4) 0.005189346 0.007089503 0.006085758 0.00879925 0.008168879 0.010127437 0.011582317 0.010154555 0.008638087 PC(16:0_26:7) 0.0000818 0.000153675 0.0000849 0.000169856 0.000173848 0.000172239 0.000108687 0.000147822 0.0000945 PC(16:1_16:1) 0.00555002 0.007968279 0.00500087 0.007189653 0.006420569 0.00666913 0.006138962 0.007091303 0.005741268 PC(17:3_16:0) 0.000129432 0.000215558 0.000116555 0.000204957 0.00019888 0.000204604 0.000152703 0.000159476 0.000133953 PC(17:3_18:0) 0.000192647 0.000355591 0.000238083 0.000350756 0.000329532 0.000435389 0.000227936 0.000218378 0.000195931 PC(17:3_18:1) 0.001517496 0.002455886 0.002063013 0.002536697 0.00273638 0.002843631 0.002419375 0.002758958 0.002476999 PC(18:0_18:1) 0.016890511 0.022636487 0.018133685 0.029611733 0.02883823 0.034636503 0.025260234 0.024867191 0.021161303 PC(18:0_20:4) 0.006122375 0.007657448 0.006292176 0.010875783 0.010344707 0.007413176 0.010486142 0.009872082 0.00813828 PC(18:1_18:1) 0.041915116 0.059167929 0.047726943 0.079975774 0.067154553 0.083214915 0.067244077 0.062989661 0.050956544 PC(18:1_20:1) 0.003081477 0.004055312 0.002914068 0.005546192 0.00488218 0.005943159 0.004204132 0.00487607 0.003369153 PC(18:1_20:4) 0.00457611 0.005627321 0.005014506 0.008223166 0.007248 0.008527028 0.008752475 0.008674021 0.006903859 PC(18:3_15:0) 0.0000186 0.0000829 0.0000265 0.0000854 0.0000498 0.0000707 0.0000279 0.0000331 0.000033 PC(19:1_18:1) 0.000084 0.0000714 0.0000495 0.0000444 0.0000543 0.0000374 0.0000726 0.0000685 0.0000811 PC(19:2_15:0) 0.0000549 0.000041 0.0000652 0.0000322 0.0000423 0.0000848 0.0000549 0.000102972 0.0000701 PC(19:3_18:0) 0.0000742 0.000140493 0.0000936 0.000169699 0.000127909 0.00020465 0.000119773 0.0000927 0.0000813 PC(19:4_18:0) 0.00028383 0.000442592 0.000317865 0.000426417 0.000391552 0.000500449 0.000360448 0.000372617 0.000279208 PC(19:4_18:1) 0.0000385 0.0000436 0.0000571 0.0000678 0.0000924 0.0000708 0.0000784 0.000095 0.0000738 PC(20:3_16:0) 0.002026104 0.000154686 0.0000843 0.000130199 0.000137519 0.000117797 0.000126186 0.000166443 0.000119304 PC(21:4) 0.0000346 0.0000338 0.000081 0.000061 0.0000316 0.0000399 0.0000492 0.0000135 0.0000175 PC(22:6_18:0) 0.000680329 0.000862676 0.000616206 0.001229431 0.00109812 0.001325982 0.00110949 0.001085991 0.00096533 PC(23:0) 0.0000779 0.0000737 0.0000891 0.0000952 0.000101446 0.0000845 0.0000872 0.0000916 0.000078 PC(23:1) 0.0000857 0.0000746 0.0000851 0.0000902 0.0000989 0.000102839 0.0000924 0.0000844 0.0000556 PC(23:3) 0.0000254 0.0000537 0.0000533 0.0000468 0.0000608 0.0000508 0.000042 0.0000444 0.0000431 PC(23:4) 0.0000131 0.0000188 0.0000215 0.000014 0.0000143 0.0000145 0.0000339 0.0000189 0.0000278 PC(28:0) 0.000210075 0.000309668 0.000234036 0.000278716 0.000268535 0.000319911 0.000195686 0.000185119 0.000193655 PC(29:0) 0.00007 0.0000851 0.0000742 0.0000916 0.0000929 0.000116399 0.0000837 0.0000751 0.0000676 PC(30:1) 0.001693139 0.002487925 0.00147843 0.002025216 0.001858859 0.002286591 0.00194872 0.001784978 0.001629058 PC(32:0) 0.0000485 0.000058 0.0000999 0.000048 0.0000338 0.0000833 0.000137269 0.0000593 0.000100837 PC(32:2) 0.001344624 0.00202933 0.001246685 0.001838571 0.001897504 0.002199852 0.000983508 0.001447351 0.000786699 PC(33:1) 0.001354027 0.001942616 0.001588529 0.002079138 0.001778876 0.002343773 0.001570694 0.001672711 0.001405383 PC(33:2) 0.000399497 0.000518435 0.00041137 0.000629446 0.000558385 0.000577582 0.000497014 0.00049909 0.000399702 PC(33:4) 0.000256802 0.000650004 0.000528069 0.000647342 0.000513304 0.000505087 0.000591178 0.000625051 0.00060708 PC(34:3) 0.001662553 0.002314019 0.001598538 0.002904906 0.002532249 0.002658898 0.002154831 0.001948863 0.001728934 PC(34:4) 0.000157443 0.000203491 0.000165598 0.000257304 0.000236245 0.000286785 0.000284245 0.000258695 0.000211499 PC(35:1) 0.002169798 0.002320077 0.002055615 0.003715696 0.003425255 0.004365373 0.002880771 0.002745263 0.002326041 PC(35:4) 0.0000578 0.000111351 0.000105335 0.000139586 0.000143148 0.000171864 0.000116883 0.000173577 0.000176843 PC(35:6) 0.000152386 0.000221057 0.00018344 0.000309142 0.000276722 0.000296106 0.000272112 0.000285828 0.000232733 PC(36:0) 0.0000499 0.0000659 0.0000583 0.0000966 0.0000784 0.000115444 0.00007 0.0000751 0.0000561 PC(36:6) 0.00012987 0.0000815 0.000125536 0.0000976 0.000104357 0.000132269 0.000115068 0.000195804 0.000127141 PC(37:2) 0.000603183 0.00075685 0.000594694 0.001065957 0.000969124 0.001195362 0.000756418 0.000835739 0.000709059 PC(37:3) 0.000177127 0.000268893 0.000194073 0.000370957 0.000350389 0.000432786 0.000267562 0.000263405 0.000227639 PC(37:5) 0.000383508 0.000547509 0.000426354 0.000576592 0.000557361 0.000669744 0.000547034 0.000575976 0.000451472 PC(37:7) 0.0000831 0.0000989 0.0000876 0.000159722 0.000132223 0.000194054 0.000154917 0.000137981 0.000102737 PC(37:8) 0.000190376 0.000203634 0.000166338 0.000161741 0.000212251 0.000114762 0.000288939 0.000273036 0.000244581 PC(38:1) 0.000409627 0.000544576 0.000426746 0.00075154 0.000622263 0.000803229 0.000708746 0.000689807 0.000566701 PC(38:6) 0.000676695 0.000979119 0.000641809 0.001346497 0.001186613 0.001220599 0.001293394 0.00125424 0.001094252 PC(38:7) 0.00016621 0.000213565 0.000186878 0.000294919 0.000306331 0.000348229 0.000397104 0.000365258 0.000307368 PC(39:2) 0.0000204 0.0000243 0.0000157 0.0000277 0.0000252 0.000034 0.0000234 0.0000236 0.0000232 PC(39:4) 0.000157655 0.000196174 0.000137048 0.000258567 0.000293728 0.000341875 0.000219027 0.000231125 0.000189749 PC(40:2) 0.000220841 0.000293807 0.000228205 0.000430324 0.000353944 0.000428636 0.000299604 0.000359945 0.000285919 PC(40:5) 0.001149554 0.001438288 0.001094708 0.001982885 0.001748714 0.002194395 0.001848617 0.001661124 0.001373517 PC(40:6) 0.000882773 0.000960086 0.000750138 0.001426339 0.001235895 0.001450804 0.001259164 0.001197309 0.001002175 PC(40:7) 0.000401784 0.000553312 0.000449505 0.000751592 0.000726012 0.00086581 0.00074462 0.000715722 0.000598495 PC(40:8) 0.0000143 0.0000241 0.0000328 0.0000224 0.000063 0.0000631 0.0000395 0.0000162 0.0000399 PC(O-12:0_20:4) 0.001022531 0.000953025 0.000894108 0.001219271 0.001026176 0.001100449 0.001426241 0.001020091 0.001066679 PC(O-13:1_22:6) 0.000389897 0.00062458 0.000439932 0.000650468 0.000602685 0.000637128 0.000669359 0.00065697 0.000513529 PC(O-14:1_20:4) 0.000183577 0.000363975 0.000321086 0.000404991 0.000361754 0.000263662 0.000440322 0.00043504 0.000408159 PC(O-14:1_22:5) 0.000043 0.0000652 0.0000539 0.0000581 0.0000556 0.0000845 0.000076 0.0000745 0.0000636 PC(O-15:1_16:0) 0.0000449 0.000062 0.0000514 0.000059 0.0000511 0.000066 0.0000553 0.0000525 0.0000394 PC(O-15:1_20:1) 0.0000681 0.0000982 0.0000792 0.0000964 0.000084 0.000105196 0.0000879 0.000104598 0.0000834 PC(O-15:1_20:3) 0.000383901 0.000549868 0.000419551 0.000582232 0.000538254 0.000675882 0.000493055 0.000480474 0.000480647 PC(O-15:1_20:4) 0.002831489 0.003827369 0.003340538 0.00294359 0.003641505 0.003003126 0.004484641 0.004483438 0.003719433 PC(O-15:2_20:4) 0.002805899 0.003977046 0.00323276 0.004153457 0.003476827 0.004309782 0.004028195 0.004641304 0.003612117 PC(O-15:2_22:5) 0.000298805 0.000433713 0.000324393 0.000329474 0.000368298 0.00044628 0.000393895 0.000389065 0.000326885 PC(O-15:2_22:6) 0.000306694 0.000448601 0.000333561 0.000473397 0.000457625 0.000503632 0.000473434 0.000488329 0.000364059 PC(O-16:1_18:1) 0.001947822 0.002380968 0.002103049 0.002901911 0.00273059 0.003189337 0.003049045 0.002723292 0.002613362 PC(O-16:1_20:4) 0.002750935 0.002946999 0.003093794 0.004442086 0.00359882 0.004325698 0.00634651 0.005263887 0.004939259 PC(O-18:1_16:0) 0.004080978 0.004811031 0.003811831 0.005243888 0.005114588 0.005766043 0.004904528 0.004657406 0.00404596 PC(O-18:1_20:4) 0.00209833 0.002218698 0.002344861 0.002582935 0.002782161 0.00280964 0.003371384 0.003319839 0.00240202 PC(O-18:2_20:4) 0.001250579 0.00146435 0.001421379 0.001779309 0.001671155 0.00185085 0.002775081 0.002358952 0.00196088 PC(O-18:3_22:3) 0.000353436 0.000409293 0.000387421 0.000484911 0.000463267 0.000507997 0.000584249 0.00049921 0.000654142 PC(O-20:4_20:4) 0.0000697 0.0000587 0.0000487 0.0000793 0.0000527 0.0000673 0.000114275 0.0000451 0.0000627 PC(O-31:1) 0.0000309 0.0000347 0.0000424 0.0000498 0.0000432 0.0000405 0.0000332 0.0000332 0.0000356 PC(O-32:1) 0.001224202 0.001419877 0.001464504 0.001766284 0.001611909 0.001790144 0.001993263 0.001737573 0.001650522 PC(O-32:2) 0.001361204 0.001790229 0.00120678 0.001528062 0.001285164 0.001636446 0.0016358 0.001247995 0.001372587 PC(O-32:5) 0.000210545 0.00021586 0.000247048 0.000262487 0.000195486 0.000234627 0.0002849 0.000196196 0.000229971 PC(O-34:0) 0.000350196 0.000419893 0.000354492 0.00048073 0.000448159 0.000555028 0.000411457 0.000413445 0.000357434 PC(O-34:2) 0.000863725 0.000976632 0.000759044 0.001029905 0.001037595 0.001142045 0.000799636 0.000929495 0.0006463 PC(O-34:3) 0.000362325 0.000476991 0.000347138 0.00078982 0.000360367 0.000407105 0.000362603 0.000346747 0.000305822 PC(O-34:4) 0.000220705 0.000203491 0.000219719 0.000285489 0.000255891 0.000276565 0.000368319 0.000285437 0.000275387 PC(O-34:5) 0.0000764 0.000091 0.0000964 0.000116694 0.0000897 0.0000972 0.000150118 0.000107684 0.000106885 PC(O-35:5) 0.0000807 0.000120834 0.0000852 0.000133295 0.000104571 0.000144216 0.000120083 0.000110044 0.000114027 PC(O-35:8) 0.00041417 0.000509795 0.000438031 0.000496985 0.000469852 0.000454863 0.000621847 0.00061259 0.000512227 PC(O-36:2) 0.00105775 0.001137387 0.000889277 0.001289657 0.001114251 0.001196612 0.001106185 0.001139445 0.000916651 PC(O-36:4) 0.000631346 0.000750363 0.000622821 0.001027665 0.000930628 0.001086932 0.001079204 0.000958871 0.000855667 PC(O-36:6) 0.0000663 0.0000866 0.0000757 0.00013814 0.000121408 0.000147502 0.000197474 0.000177595 0.000157254 PC(O-37:5) 0.0000255 0.0000535 0.0000399 0.0000422 0.0000472 0.0000378 0.0000669 0.0000691 0.0000513 PC(O-37:8) 0.000503505 0.000667044 0.000402042 0.000718535 0.000677659 0.000753879 0.000844067 0.000570317 0.000709917 PC(O-37:9) 0.000799222 0.001031274 0.000886391 0.00122594 0.001126828 0.001327915 0.001226244 0.001263525 0.000964342 PC(O-38:1) 0.0000521 0.0000743 0.0000561 0.000082 0.0000717 0.0000855 0.0000764 0.0000551 0.0000499 PC(O-38:4) 0.001104023 0.001293249 0.000995808 0.001612462 0.001424609 0.001689195 0.001619516 0.001564207 0.001325196 PC(O-38:6) 0.0000339 0.0000349 0.0000455 0.0000659 0.0000604 0.0000691 0.0000656 0.0000753 0.0000596 PC(O-39:10) 0.003841588 0.004984618 0.003873335 0.00669315 0.005971777 0.006979594 0.006100964 0.005912956 0.005202684 PC(O-39:3) 0.0000274 0.0000447 0.0000322 0.0000449 0.0000337 0.0000388 0.000039 0.0000313 0.0000314 PC(O-39:7) 0.0000162 0.0000241 0.0000212 0.0000278 0.0000247 0.0000366 0.0000251 0.0000227 0.0000196 PC(O-39:8) 0.0000746 0.000103164 0.0000903 0.000113247 0.000103281 0.000126232 0.000126662 0.000118337 0.00010953 PC(P-37:6) 0.0000601 0.000107404 0.0000735 0.000117319 0.0000965 0.000124379 0.0000872 0.0000882 0.0000651 PC(P-37:9) 0.002041549 0.003152626 0.002192405 0.003082564 0.003267848 0.003032456 0.002995721 0.002838267 0.002316597 PC(P-38:10) 0.001298684 0.001855902 0.001468711 0.002074189 0.001918644 0.002019326 0.00238521 0.002309139 0.001947573 PE(16:0_16:1) 0.137499733 0.244001183 0.123893387 0.139834594 0.165267043 0.133787591 0.110848915 0.113346238 0.111146242 PE(16:0_18:1) 0.221769636 0.379989538 0.20527109 0.262089121 0.293102848 0.262373059 0.227140361 0.215956031 0.192411648 PE(16:0_22:4) 0.033516027 0.045475015 0.03214874 0.038939773 0.039603788 0.043866868 0.036398691 0.033863357 0.028488619 PE(16:1_16:1) 0.016268367 0.032629017 0.014966004 0.015571992 0.018555463 0.015151674 0.011875766 0.012250471 0.011497612 PE(18:0_18:1) 0.185752063 0.269520322 0.18028248 0.231839957 0.215079033 0.258206119 0.193643685 0.187334728 0.168572254 PE(18:0_20:1) 0.012011687 0.016062501 0.011674377 0.013340062 0.016674674 0.016199961 0.014211636 0.013519936 0.011508661 PE(18:1_18:1) 2.006696381 2.283985717 1.699996495 2.353800729 2.499477752 2.415252572 2.708613661 2.456143383 2.151393068 PE(18:1_22:6) 0.011319869 0.017324357 0.01188869 0.018358892 0.017062705 0.021569809 0.019426827 0.015597401 0.012334982 PE(19:4_15:0) 0.021432684 0.038810926 0.019997897 0.021127715 0.024759766 0.018968748 0.018325467 0.017016367 0.017701056 PE(20:3_18:0) 0.054319592 0.050644802 0.053415344 0.07933024 0.0801424 0.102439887 0.026495692 0.058753176 0.050325531 PE(20:4_18:1) 0.200902092 0.273273137 0.198121473 0.237082342 0.240495091 0.220048483 0.266643906 0.26078916 0.22982644 PE(22:5_18:1) 0.023294449 0.036179407 0.02014159 0.034726281 0.03844962 0.036425342 0.028594381 0.015059196 0.025661686 PE(22:6_16:0) 0.021778166 0.032155935 0.022396874 0.038551113 0.037697584 0.036030924 0.036511156 0.033892739 0.02982644 PE(O-16:1_18:4) 0.009907658 0.018080606 0.00942032 0.008110632 0.008721712 0.008417742 0.008560842 0.007964016 0.005731212 PE(O-16:1_20:3) 0.042594528 0.076109355 0.0457996 0.052020126 0.031909338 0.058856057 0.023645894 0.044530669 0.040401516 PE(O-18:1_22:3) 0.011666418 0.019111152 0.012489573 0.0157377 0.016378908 0.020931665 0.014681783 0.013023384 0.010521699 PE(P-16:0_18:1) 0.184282698 0.278981964 0.173027722 0.191557952 0.200891303 0.195439953 0.189900187 0.185139736 0.16321247 PE(P-16:0_20:4) 0.389648333 0.558509791 0.389794273 0.42594378 0.458568345 0.458415777 0.561303798 0.493752052 0.434630357 PE(P-18:1_18:1) 0.09408202 0.116132554 0.075153331 0.113869724 0.090749251 0.119466684 0.108290322 0.107568399 0.082744318 PE(P-18:3_18:1) 0.033906293 0.037284782 0.031908667 0.038093158 0.029789012 0.043422656 0.038639969 0.030736791 0.027154198 PI(16:0_18:1) 0.096217557 0.163732504 0.090399265 0.127791548 0.119267051 0.130278155 0.090505206 0.099136948 0.090204846 PI(16:1_18:1) 0.37015679 0.394059098 0.35118591 0.481304994 0.423741548 0.472851828 0.425987932 0.422116958 0.396360611 PI(18:0_20:4) 0.577641952 0.636057543 0.549408396 0.902714091 0.892395025 0.997047186 0.832524846 0.725608849 0.68446501 PI(18:1_18:1) 0.173886084 0.226096423 0.139904911 0.26255422 0.253902663 0.288584421 0.196095599 0.193284063 0.167515857 PI(18:1_20:4) 0.137177784 0.159891135 0.104716624 0.179309704 0.177460556 0.214510128 0.156726219 0.147472844 0.140641572 PI(18:2_18:1) 0.019666932 0.040978227 0.019500783 0.043196183 0.031580265 0.034035906 0.01767274 0.017189624 0.019110949 PI(20:4_16:0) 0.087319515 0.091360809 0.06529256 0.052866526 0.090575173 0.062493356 0.075508755 0.041268786 0.060221483 PI(22:3_18:0) 0.011212685 0.014390358 0.007602788 0.019806048 0.017842892 0.025436721 0.009724326 0.007742671 0.008530727 PS(18:0_18:1) 0.389018379 0.488739946 0.375052762 0.452404177 0.483487833 0.466016022 0.412119242 0.452621024 0.343238395 PS(18:0_22:4) 0.071186299 0.107602026 0.061342731 0.087668982 0.079857088 0.088549084 0.097919762 0.084134589 0.068501977 Cer(d18:1_16:0) 0.005460438 0.00589684 0.005074361 0.007580595 0.007584977 0.00752317 0.006457582 0.005848429 0.00497541 Cer(d18:1_17:0) 0.000255305 0.000285518 0.000385792 0.000473393 0.000408485 0.000454315 0.000332107 0.000336456 0.000233259 Cer(d18:1_18:0) 0.000978779 0.00111151 0.001295525 0.001711043 0.001467501 0.001853876 0.001305002 0.001220013 0.000961239 Cer(d18:1_20:0) 0.0004918 0.00059482 0.000801654 0.000833448 0.00058124 0.000741939 0.000711333 0.000627405 0.000437531 Cer(d18:1_21:0) 0.000178467 0.000177303 0.000355524 0.000263877 0.000129067 0.000194989 0.000205825 0.000170304 0.000141887 Cer(d18:1_22:0) 0.001600099 0.00186784 0.001962413 0.002807882 0.002283861 0.002522005 0.002245331 0.001996205 0.001482704 Cer(d18:1_22:1) 0.000844218 0.001011223 0.000861468 0.001238698 0.001214453 0.001427438 0.001125752 0.000991076 0.000866421 Cer(d18:1_23:0) 0.000517083 0.000633309 0.000823438 0.000834071 0.000566677 0.000764637 0.000731925 0.000599164 0.000429578 Cer(d18:1_23:1) 0.000383772 0.000462767 0.000414976 0.000597194 0.000642112 0.000800433 0.000533982 0.000483908 0.000452737 Cer(d18:1_24:0) 0.002480753 0.003425839 0.003347216 0.004535636 0.003063505 0.003909096 0.003778332 0.002847867 0.002075715 Cer(d18:1_24:1) 0.006178977 0.007799246 0.00575912 0.009559144 0.008650104 0.009838504 0.007751504 0.006610779 0.006358225 Cer(d18:2_16:0) 0.000433904 0.000505252 0.00042826 0.000766166 0.000748897 0.000863089 0.00058934 0.000542021 0.000472235 Cer(d18:2_18:0) 0.000190179 0.000194128 0.000254896 0.000318825 0.000289868 0.000379233 0.000229194 0.000230876 0.0002053 Cer(d18:2_24:1) 0.00184504 0.002161968 0.001601462 0.002670138 0.002547937 0.003131694 0.002384457 0.00224545 0.002070922 Cer(d19:1_24:0) 0.00026798 0.000243823 0.000450436 0.000300293 0.000198151 0.000256074 0.000297254 0.000310653 0.00013137 Cer(d20:1_24:0) 0.000846685 0.000279143 0.000566526 0.000421176 0.000192326 0.000303219 0.000287733 0.000275174 0.000232495 Cer(d20:1_24:1) 0.000682505 0.000257012 0.000554379 0.000313513 0.000224857 0.000566624 0.000427335 0.000474211 0.000282717 Hex1Cer(d18:1_24:0) 0.001035039 0.001200754 0.00095178 0.001672944 0.001303905 0.001779233 0.001599399 0.001477338 0.001324326 Hex2Cer(d18:1_16:0) 0.000723532 0.000777087 0.000637542 0.000898547 0.000727037 0.000957101 0.000762536 0.000699578 0.000555654 Hex2Cer(d18:1_22:0) 0.000157345 0.000190268 0.000146131 0.000207165 0.000190302 0.000197786 0.000181307 0.000147214 0.000136288 Hex3Cer(d18:1_16:0) 0.000748371 0.000811815 0.00072253 0.000830704 0.000713674 0.000930684 0.000839348 0.000762631 0.000648229 Hex3Cer(d18:1_24:0) 0.00104129 0.001266116 0.001092822 0.001384735 0.00118604 0.001567568 0.001334837 0.001277282 0.001098916 LSM(d14:1) 0.000840105 0.000801742 0.000783045 0.000763672 0.00083102 0.000747877 0.000739752 0.000693837 0.000717977 SM(d18:1_16:0) 0.222026649 0.263997127 0.205516172 0.235617634 0.23533342 0.251845274 0.217901235 0.22795306 0.191921367 SM(d18:1_24:0) 0.012057904 0.016230023 0.012611136 0.012070836 0.011325895 0.013707753 0.016502058 0.012998384 0.012074882 SM(d18:1_24:1) 0.058549926 0.078646076 0.054731207 0.05867681 0.049478464 0.06843887 0.059722222 0.057794955 0.048161989 SM(d18:1_26:4) 0.004971212 0.005516789 0.004693915 0.004561327 0.004068046 0.005205561 0.005735201 0.005249736 0.003855099 SM(d20:0_12:1) 0.002800872 0.003481415 0.002487446 0.00319455 0.002706214 0.003526167 0.002846233 0.002448879 0.002255765 SM(d33:1) 0.002242721 0.002661699 0.001920691 0.00273742 0.002376881 0.003003774 0.002709164 0.002550207 0.002008405 SM(d34:0) 0.003699786 0.004891453 0.003488776 0.004042901 0.003309743 0.004659415 0.005597816 0.005099361 0.004086343 SM(d34:2) 0.004676263 0.005644909 0.003355265 0.004331483 0.003824468 0.004721738 0.004923947 0.003578034 0.002994651 SM(d36:1) 0.009684981 0.01284701 0.009684685 0.012067095 0.011105994 0.013042899 0.012067901 0.012540229 0.009744373 SM(d36:2) 0.002185968 0.003171575 0.002266283 0.003221238 0.003261676 0.00359182 0.003239554 0.003079615 0.002557933 SM(d36:3) 0.000252352 0.000321817 0.000203168 0.000236092 0.000234146 0.000289589 0.000345244 0.000343792 0.00024363 SM(d36:4) 0.003555766 0.004989944 0.003336656 0.003460435 0.003640568 0.003844886 0.004432336 0.003494273 0.0031904 SM(d38:1) 0.003751522 0.004822859 0.003673682 0.004142358 0.003824338 0.004775348 0.004511713 0.00450657 0.003520006 SM(d38:2) 0.016861326 0.015454301 0.014897356 0.013383426 0.013152569 0.013787114 0.015405192 0.013292109 0.013449569 SM(d40:1) 0.012301365 0.017077572 0.012863683 0.013581717 0.011551635 0.015054665 0.01427667 0.013832478 0.011804668 SM(d41:1) 0.002343066 0.003124529 0.00235017 0.002592255 0.00230397 0.002633609 0.002773583 0.002490479 0.002376146 SM(d42:3) 0.01665241 0.022486982 0.017241176 0.018766602 0.015988583 0.020836339 0.017867205 0.01926639 0.013771881 SPH(d14:1) 0.000474395 0.000202155 0.000461173 0.000418071 0.000398028 0.000280498 0.000303593 0.000360727 0.000327126 SPH(d14:2) 0.001754894 0.003516969 0.001185054 0.00167151 0.001354177 0.002269993 0.004564261 0.00140721 0.003250625 SPH(d16:0) 0.005828343 0.005605046 0.005136907 0.005532394 0.005554294 0.005889894 0.004887781 0.010453236 0.007795221 SPH(d16:1) 0.001476394 0.000374187 0.000602127 0.000892249 0.000268234 0.000386675 0.000398536 0.001079404 0.000695193 SPH(d17:0) 0.000617478 0.001007362 0.001869074 0.001037601 0.00060035 0.000770853 0.00070937 0.000362188 0.002231384 SPH(d18:0) 0.000302122 0.000289388 0.000276015 0.000814616 0.000300986 0.000446751 0.000484346 0.000718432 0.000484996 SPH(d18:1) 0.000513201 0.000335078 0.000358499 0.000268785 0.000303834 0.000307431 0.000430168 0.000438262 0.000421944 SPH(d18:2) 0.001230712 0.000463297 0.000889824 0.000565523 0.002226064 0.000873134 0.001031735 0.000719767 0.000277772 SPH(d19:0) 0.000179758 0.000151769 0.000141227 0.000215502 0.000138797 0.000155863 0.000174232 0.000191146 0.000157064 SPH(d20:0) 0.000361548 0.000397504 0.000134626 0.004926483 0.000168825 0.000418741 0.002947531 0.006092263 0.002315991 TG(12:0_16:0_16:1) 0.010181562 0.028595622 0.011356715 0.008146259 0.008578325 0.008588522 0.009646925 0.008180085 0.008690963 TG(12:1_14:1_18:1) 0.001955023 0.006357052 0.002428235 0.001811182 0.00174389 0.002009166 0.002343195 0.001785196 0.002059048 TG(14:0_14:0_16:0) 0.004181513 0.009261664 0.004680568 0.004251063 0.003211403 0.003939525 0.004347028 0.003726332 0.00401429 TG(14:0_16:0_16:0) 0.009882691 0.016649709 0.008525887 0.007460884 0.006329477 0.006660718 0.007265562 0.006942453 0.007338786 TG(14:0_16:0_16:1) 0.052789136 0.150873552 0.060015719 0.039195578 0.045916326 0.041695396 0.045903471 0.04017473 0.046088168 TG(14:0_16:0_22:6) 0.003958966 0.011638664 0.005320267 0.004111012 0.003512438 0.00437031 0.005955299 0.004743124 0.005520155 TG(14:0_16:1_20:4) 0.001494256 0.005472455 0.002497691 0.001685502 0.00168283 0.001896816 0.00261788 0.001748026 0.002593763 TG(14:1_16:1_16:1) 0.00678933 0.019665975 0.007849494 0.005804847 0.005272245 0.006119246 0.006916806 0.00556549 0.006985575 TG(14:1_16:1_18:1) 0.062524338 0.216386639 0.077050791 0.055829082 0.052461512 0.05641452 0.067305512 0.051384224 0.056927156 TG(15:0_16:0_16:1) 0.00419266 0.008428275 0.005219078 0.005251276 0.003425241 0.003687285 0.004129731 0.003877916 0.004781378 TG(15:0_16:0_18:1) 0.006255841 0.014308856 0.008015031 0.006958759 0.005726711 0.006711012 0.007766021 0.006712807 0.00697479 TG(16:0_12:1_16:1) 0.007780861 0.022125979 0.008944887 0.006570153 0.006558233 0.006699655 0.007322788 0.00606971 0.006914573 TG(16:0_14:1_16:1) 0.049780958 0.151014124 0.057063562 0.036460884 0.036977037 0.040474549 0.044182908 0.034681401 0.038819485 TG(16:0_16:0_16:1) 0.161438863 0.396171096 0.17444248 0.121011905 0.139649474 0.122251065 0.133957782 0.125333575 0.129937537 TG(16:0_16:0_18:0) 0.004987831 0.011665439 0.006300717 0.007132653 0.004715143 0.007152707 0.008330184 0.006209041 0.004100121 TG(16:0_16:0_18:1) 0.151518692 0.391083741 0.18268494 0.155493197 0.159276333 0.167288582 0.179663122 0.148974312 0.176286343 TG(16:0_16:1_16:1) 0.294105335 0.834393199 0.312638766 0.215620748 0.251930939 0.224680592 0.24764347 0.222687665 0.234934616 TG(16:0_16:1_18:1) 0.432583723 1.045317625 0.448275862 0.345595238 0.395620597 0.390143987 0.431317821 0.410007262 0.408079809 TG(16:0_16:1_20:4) 0.009250389 0.0338443 0.01316092 0.011755527 0.013313908 0.012524843 0.012875344 0.012330035 0.015145823 TG(16:0_16:1_22:6) 0.005809969 0.014967535 0.006806661 0.006059949 0.005474906 0.006517948 0.007815149 0.006881184 0.007582348 TG(16:0_18:0_18:0) 0.000799552 0.001746034 0.001169467 0.001467815 0.000812603 0.001278524 0.001822869 0.001295543 0.000839303 TG(16:0_18:0_18:1) 0.031060164 0.075386572 0.037584242 0.040746599 0.037246238 0.046895153 0.060130648 0.04810747 0.043683998 TG(16:0_18:0_19:1) 0.001133324 0.001864583 0.001143678 0.001723639 0.001311733 0.001581626 0.002177671 0.001883861 0.001750371 TG(16:0_18:1_18:1) 0.259082944 0.670928442 0.326495726 0.299404762 0.308602244 0.347106064 0.394552718 0.331637469 0.373715903 TG(16:0_18:1_22:3) 0.013750974 0.026213937 0.015633166 0.019818878 0.016232061 0.021415129 0.021877666 0.019048289 0.018251472 TG(16:0_18:1_22:4) 0.01569412 0.031844836 0.020410158 0.020469813 0.019972167 0.027718516 0.032499055 0.022071798 0.02399991 TG(16:0_20:1_22:1) 0.001326811 0.002707879 0.001611111 0.002030867 0.001595503 0.002183979 0.00236263 0.002021285 0.002042107 TG(16:0_22:0_18:1) 0.000720356 0.001529487 0.000923519 0.000959566 0.000747151 0.00097826 0.001238082 0.000951484 0.000928774 TG(16:0_24:0_18:1) 0.000385353 0.000701921 0.000376407 0.000432951 0.000315217 0.00042462 0.000484889 0.000371598 0.000358842 TG(16:0_26:0_18:1) 0.000104206 0.000178841 0.000125955 0.000156407 0.00011132 0.000151535 0.000156287 0.000130748 0.0000994 TG(16:1_16:1_18:1) 0.153431659 0.414110717 0.195859122 0.128839286 0.145851092 0.1347029 0.172569238 0.152568757 0.157349571 TG(16:1_16:1_18:2) 0.012298481 0.037041971 0.016071323 0.013159014 0.012496738 0.012263638 0.014200723 0.013422438 0.015360626 TG(16:1_16:1_22:6) 0.001165596 0.003167481 0.001559485 0.001546046 0.001261155 0.001649848 0.002366085 0.001460425 0.002124253 TG(16:1_18:1_18:1) 0.145974494 0.311848183 0.183736123 0.18582483 0.154444638 0.183832894 0.206872537 0.204524825 0.186127713 TG(16:1_18:1_18:2) 0.030409365 0.0725082 0.038271932 0.031595238 0.027528486 0.034823768 0.033896237 0.03538486 0.036264324 TG(16:1_18:1_20:1) 0.111862344 0.184510342 0.142513999 0.148728741 0.135557102 0.157217603 0.202564379 0.168589453 0.164386824 TG(16:1_18:1_20:3) 0.010169393 0.025812303 0.02707879 0.010818027 0.023866226 0.012871223 0.013785024 0.012611419 0.01329933 TG(16:1_18:1_22:6) 0.002306123 0.005386639 0.002912565 0.003372959 0.002916413 0.003584263 0.004993792 0.004472089 0.004103402 TG(17:0_16:1_18:1) 0.010856211 0.024849053 0.0144469 0.016116071 0.015052188 0.015083756 0.017456675 0.015515113 0.015654069 TG(18:0_18:0_18:1) 0.003992212 0.008260928 0.006090972 0.008064626 0.004972602 0.006928412 0.008404146 0.006740492 0.006919067 TG(18:0_18:1_18:1) 0.045181075 0.079884865 0.052122016 0.062223639 0.052822475 0.06852971 0.090023214 0.073114278 0.065204692 TG(18:0_18:1_19:1) 0.001165158 0.00244434 0.001327979 0.00236841 0.001358876 0.002512756 0.002976786 0.002425388 0.002525367 TG(18:0_18:1_20:1) 0.004658976 0.008956423 0.005869437 0.007525935 0.005747151 0.007912391 0.009418561 0.007606426 0.007412034 TG(18:0_18:1_26:1) 0.000119548 0.000187 0.000147097 0.000212925 0.00016807 0.000211482 0.000197576 0.000159867 0.000167735 TG(18:1_18:1_20:1) 0.018666277 0.031510141 0.020290795 0.024789966 0.021564321 0.028763334 0.031906819 0.027483435 0.024672628 TG(18:1_18:1_22:3) 0.005895639 0.011247071 0.007253659 0.00847449 0.007520658 0.010641249 0.009564865 0.008240447 0.007856469 TG(18:1_18:1_22:4) 0.007056075 0.011685521 0.009204244 0.00967432 0.00939158 0.011512878 0.013911353 0.010287283 0.010023368 TG(18:1_18:1_26:1) 0.000364408 0.000583466 0.000381909 0.000572491 0.000481256 0.000702941 0.000547751 0.000476264 0.000466319 TG(18:1_19:1_20:1) 0.000621447 0.000975166 0.000710188 0.000957696 0.000782726 0.001086798 0.000988609 0.000857811 0.00080879 TG(18:1_20:1_20:1) 0.003355578 0.005529286 0.003912074 0.005371599 0.003985648 0.00547029 0.006035739 0.004876554 0.004478992 TG(18:1_20:1_20:2) 0.003820337 0.006242988 0.004154337 0.005414541 0.004462903 0.006056784 0.005683205 0.004670963 0.004184514 TG(18:1_20:1_22:1) 0.001132107 0.002023094 0.001329944 0.001989541 0.00158063 0.002273413 0.002014415 0.001707906 0.00180843 TG(18:1_20:1_22:2) 0.000797118 0.001247004 0.000916446 0.001343027 0.000932243 0.00137684 0.001300869 0.000966915 0.001023862 TG(18:1_20:1_22:3) 0.001422459 0.002375527 0.001541409 0.001896386 0.001853657 0.002337416 0.002073962 0.001731778 0.001533456 TG(18:1_20:1_26:1) 0.0000437 0.0000779 0.0000553 0.000102236 0.0000742 0.000108692 0.0000807 0.0000635 0.0000624 TG(2:0_16:0_16:1) 0.001749513 0.00746971 0.00192681 0.001074872 0.00144355 0.001189373 0.000689737 0.00052714 0.000708309 TG(24:0_18:1_18:1) 0.000602074 0.001047326 0.000667403 0.000969473 0.000741628 0.001064125 0.000936997 0.000791731 0.000809644 TG(4:0_14:0_16:0) 0.000746447 0.002949796 0.000966451 0.000643027 0.000674654 0.000687568 0.000444485 0.000318585 0.000390738 TG(4:0_16:0_16:0) 0.001512948 0.006686927 0.001785932 0.001165476 0.0014656 0.001231109 0.000683799 0.000487746 0.000695097 TG(4:0_16:0_16:1) 0.013811819 0.060206841 0.014265154 0.008026361 0.011014613 0.008704928 0.004849161 0.004097985 0.004935514 TG(4:0_16:0_18:1) 0.007264408 0.032526943 0.008980745 0.005440476 0.009220231 0.006027581 0.003690061 0.003620042 0.003278434 TG(4:0_16:1_16:1) 0.003389165 0.014790816 0.003700118 0.002006122 0.002693311 0.002143298 0.001252335 0.001056957 0.001188559 TG(4:0_16:1_18:1) 0.0029283 0.016129594 0.003953237 0.00231824 0.002976124 0.002040803 0.001402149 0.001380639 0.001499124 TG(5:0_16:0_16:1) 0.001174357 0.00457949 0.001209107 0.000807951 0.001003392 0.000798662 0.000542245 0.000427262 0.000585719 TG(6:0_16:1_18:1) 0.002490995 0.008580896 0.00258154 0.001958588 0.001973123 0.002064125 0.001992442 0.001423437 0.001921943 TG(8:0_16:0_16:0) 0.000969139 0.002216882 0.001035072 0.000936395 0.00081456 0.000931779 0.000889381 0.000700281 0.000953669 TG(8:0_16:0_16:1) 0.004732963 0.016715309 0.004779939 0.003671046 0.003807385 0.003225309 0.00323182 0.002438776 0.002990204 TG(8:0_16:0_18:1) 0.004234034 0.011663431 0.004531978 0.003911054 0.003550404 0.003703143 0.003795444 0.003099256 0.004113333 TG(8:0_16:1_18:1) 0.003996933 0.013562487 0.004002112 0.003754634 0.003243281 0.003582965 0.003420936 0.002800399 0.002959241 TG(9:0_16:0_16:1) 0.001903914 0.005919339 0.002130612 0.001548639 0.00170601 0.001798094 0.002030341 0.001605655 0.002087719 TG(O-11:0_14:0_3:0) 0.000439686 0.000912243 0.000594312 0.000505825 0.000407785 0.000559116 0.000345241 0.000498684 0.000485687 TG(O-12:1_4:0_16:1) 0.015531542 0.055092041 0.016457904 0.013363095 0.016501696 0.012948692 0.014123522 0.012824725 0.013648047 TG(O-12:1_6:0_18:1) 0.014517621 0.034777428 0.016363592 0.021547619 0.021049839 0.022492395 0.023529126 0.022531088 0.021303644 TG(O-13:0_16:0_3:0) 0.004614389 0.011603186 0.005342372 0.005267857 0.004887797 0.005101197 0.004448955 0.004275438 0.004056981 TG(O-13:0_5:0_20:3) 0.000853583 0.001566236 0.000933392 0.001301233 0.001069844 0.001419753 0.001311829 0.001204548 0.001111805 TG(O-15:0_18:0_3:0) 0.001712033 0.002564563 0.00209328 0.002068282 0.001096938 0.002012411 0.001931329 0.001490742 0.001792837 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name BaseRT MainIon Calculated m/z Ch 48.8393 M+H-H2O 369.3516 ChE(18:1) 48.8736 M+NH4 668.634 ChE(18:2) 48.011 M+NH4 666.6184 ChE(19:2) 48.8707 M+NH4 680.634 ChE(20:3) 48.1779 M+NH4 692.634 ChE(20:4) 47.5319 M+NH4 690.6184 ChE(22:3) 49.126 M+NH4 720.6653 ChE(22:4) 48.3486 M+NH4 718.6497 ChE(22:5) 47.6039 M+NH4 716.634 ChE(22:6) 47.1332 M+NH4 714.6184 ChE(24:3) 49.9779 M+NH4 748.6966 ChE(24:4) 49.238 M+NH4 746.681 ChE(24:5) 48.5737 M+NH4 744.6653 DG(12:0_14:0) 31.9311 M+NH4 502.4466 DG(14:0_16:0) 36.6425 M+NH4 558.5092 DG(14:0_16:1) 34.742 M+NH4 556.4936 DG(14:1_16:1) 32.7954 M+NH4 554.4779 DG(16:0_16:1) 36.9466 M+NH4 584.5249 DG(16:0_18:0) 40.3926 M+NH4 614.5718 DG(16:0_18:1) 38.8139 M+NH4 612.5562 DG(16:0_19:1) 38.8395 M+NH4 626.5718 DG(16:0_20:4) 37.1818 M+NH4 634.5405 DG(16:0_22:6) 36.5355 M+NH4 658.5405 DG(16:1_16:1) 35.1007 M+NH4 582.5092 DG(16:1_16:2) 34.3231 M+NH4 580.4936 DG(16:1_17:1) 36.1741 M+NH4 596.5249 DG(16:1_18:1) 37.2242 M+NH4 610.5405 DG(16:1_19:1) 37.1737 M+NH4 624.5562 DG(16:1_20:4) 35.3533 M+NH4 632.5249 DG(16:1_22:6) 34.9235 M+NH4 656.5249 DG(18:0_18:1) 40.5484 M+NH4 640.5875 DG(18:0_20:0) 43.3453 M+NH4 670.6344 DG(18:0_20:3) 40.2471 M+NH4 664.5875 DG(18:0_20:4) 39.0736 M+NH4 662.5718 DG(18:0_22:4) 40.3066 M+NH4 690.6031 DG(18:1_16:2) 36.524 M+NH4 608.5249 DG(18:1_18:2) 37.7503 M+NH4 636.5562 DG(18:1_20:1) 40.6066 M+NH4 666.6031 DG(18:1_20:4) 37.2426 M+NH4 660.5562 DG(18:1_22:1) 42.0651 M+NH4 694.6344 DG(18:1_22:2) 41.1063 M+NH4 692.6188 DG(18:1_22:4) 38.8181 M+NH4 688.5875 DG(18:1_22:5) 37.8919 M+NH4 686.5718 DG(4:0_16:1) 20.1521 M+NH4 416.3371 DG(4:0_18:1) 24.0751 M+NH4 444.3684 LPC(15:0) 11.2747 M+H 482.3241 LPC(16:0) 13.4609 M+H 496.3398 LPC(18:0) 18.1135 M+H 524.3711 LPC(18:1) 14.3309 M+H 522.3554 LPC(20:4) 11.115 M+H 544.3398 LPE(15:0) 11.7027 M+H 440.2772 LPE(16:0) 13.9578 M+H 454.2928 LPE(18:0) 18.5746 M+H 482.3241 LPE(18:1) 14.7559 M+H 480.3085 LPE(20:4) 11.4655 M+H 502.2928 LPE(22:5) 12.544 M+H 528.3085 LPE(22:6) 11.217 M+H 526.2928 MG(16:0) 18.412 M+H 331.2843 MG(16:1) 14.7113 M+H 329.2686 MG(18:0) 22.7834 M+NH4 376.3421 MG(18:1) 19.2372 M+NH4 374.3265 MG(18:2) 16.1737 M+NH4 372.3108 PC(13:0_16:1) 33.1153 M+H 690.5068 PC(13:1_16:1) 31.0318 M+H 688.4912 PC(14:0_16:0) 32.1368 M+H 706.5381 PC(15:0_16:0) 33.3798 M+H 720.5538 PC(15:0_18:1) 33.7078 M+H 746.5694 PC(15:0_20:5) 33.8428 M+H 766.5381 PC(15:0_22:5) 33.7312 M+H 794.5694 PC(15:0_22:6) 35.3888 M+H 792.5538 PC(15:1_16:1) 33.4516 M+H 716.5225 PC(16:0_16:0) 34.5219 M+H 734.5694 PC(16:0_16:1) 32.5804 M+H 732.5538 PC(16:0_18:0) 36.6464 M+H 762.6007 PC(16:0_18:1) 34.809 M+H 760.5851 PC(16:0_18:3) 34.5303 M+H 756.5538 PC(16:0_20:4) 33.0342 M+H 782.5694 PC(16:0_26:7) 34.6489 M+H 860.6164 PC(16:1_16:1) 30.4695 M+H 730.5381 PC(17:3_16:0) 35.0835 M+H 742.5381 PC(17:3_18:0) 37.0832 M+H 770.5694 PC(17:3_18:1) 35.7539 M+H 768.5538 PC(18:0_18:1) 36.9035 M+H 788.6164 PC(18:0_20:4) 35.2832 M+H 810.6007 PC(18:1_18:1) 35.048 M+H 786.6007 PC(18:1_20:1) 36.9926 M+H 814.632 PC(18:1_20:4) 33.3179 M+H 808.5851 PC(18:3_15:0) 31.8528 M+H 742.5381 PC(19:1_18:1) 33.0228 M+H 800.6164 PC(19:2_15:0) 31.8049 M+H 758.5694 PC(19:3_18:0) 38.4245 M+H 798.6007 PC(19:4_18:0) 37.1585 M+H 796.5851 PC(19:4_18:1) 32.1676 M+H 794.5694 PC(20:3_16:0) 31.3819 M+H 784.5851 PC(21:4) 11.458 M+H 572.3347 PC(22:6_18:0) 34.906 M+H 834.6007 PC(23:0) 22.1191 M+H 608.4286 PC(23:1) 20.2744 M+H 606.4129 PC(23:3) 17.7452 M+H 602.3816 PC(23:4) 14.419 M+H 600.366 PC(28:0) 29.4667 M+H 678.5068 PC(29:0) 30.8615 M+H 692.5225 PC(30:1) 30.0611 M+H 704.5225 PC(32:0) 32.3373 M+H 734.5694 PC(32:2) 31.9384 M+H 730.5381 PC(33:1) 37.331 M+H 746.5694 PC(33:2) 31.9077 M+H 744.5538 PC(33:4) 33.555 M+H 740.5225 PC(34:3) 31.4641 M+H 756.5538 PC(34:4) 30.5427 M+H 754.5381 PC(35:1) 35.889 M+H 774.6007 PC(35:4) 31.8582 M+H 768.5538 PC(35:6) 33.1706 M+H 764.5225 PC(36:0) 38.5645 M+H 790.632 PC(36:6) 31.8244 M+H 778.5381 PC(37:2) 36.0518 M+H 800.6164 PC(37:3) 35.6844 M+H 798.6007 PC(37:5) 35.7427 M+H 794.5694 PC(37:7) 33.4141 M+H 790.5381 PC(37:8) 35.597 M+H 788.5225 PC(38:1) 38.6189 M+H 816.6477 PC(38:6) 32.6421 M+H 806.5694 PC(38:7) 33.0343 M+H 804.5538 PC(39:2) 40.6174 M+H 828.6477 PC(39:4) 36.3057 M+H 824.6164 PC(40:2) 38.7664 M+H 842.6633 PC(40:5) 36.1641 M+H 836.6164 PC(40:6) 33.4631 M+H 834.6007 PC(40:7) 32.9301 M+H 832.5851 PC(40:8) 31.2306 M+H 830.5694 PC(O-12:0_20:4) 29.4129 M+H 712.5276 PC(O-13:1_22:6) 34.2694 M+H 748.5276 PC(O-14:1_20:4) 35.7614 M+H 738.5432 PC(O-14:1_22:5) 35.9422 M+H 764.5589 PC(O-15:1_16:0) 38.1364 M+H 704.5589 PC(O-15:1_20:1) 39.8959 M+H 758.6058 PC(O-15:1_20:3) 38.0485 M+H 754.5745 PC(O-15:1_20:4) 36.6582 M+H 752.5589 PC(O-15:2_20:4) 35.0543 M+H 750.5432 PC(O-15:2_22:5) 35.2424 M+H 776.5589 PC(O-15:2_22:6) 34.5019 M+H 774.5432 PC(O-16:1_18:1) 35.9068 M+H 744.5902 PC(O-16:1_20:4) 34.1093 M+H 766.5745 PC(O-18:1_16:0) 36.1482 M+H 746.6058 PC(O-18:1_20:4) 34.675 M+H 794.6058 PC(O-18:2_20:4) 34.3618 M+H 792.5902 PC(O-18:3_22:3) 34.9414 M+H 820.6215 PC(O-20:4_20:4) 36.5905 M+H 816.5902 PC(O-31:1) 32.7366 M+H 704.5589 PC(O-32:1) 35.6473 M+H 718.5745 PC(O-32:2) 33.6961 M+H 716.5589 PC(O-32:5) 29.0711 M+H 710.5119 PC(O-34:0) 37.9261 M+H 748.6215 PC(O-34:2) 34.8317 M+H 744.5902 PC(O-34:3) 33.1581 M+H 742.5745 PC(O-34:4) 31.4178 M+H 740.5589 PC(O-34:5) 29.8017 M+H 738.5432 PC(O-35:5) 38.3302 M+H 752.5589 PC(O-35:8) 34.6738 M+H 746.5119 PC(O-36:2) 36.393 M+H 772.6215 PC(O-36:4) 35.5976 M+H 768.5902 PC(O-36:6) 32.7053 M+H 764.5589 PC(O-37:5) 36.6438 M+H 780.5902 PC(O-37:8) 36.7396 M+H 774.5432 PC(O-37:9) 34.5271 M+H 772.5276 PC(O-38:1) 40.037 M+H 802.6684 PC(O-38:4) 35.6125 M+H 796.6215 PC(O-38:6) 33.28 M+H 792.5902 PC(O-39:10) 34.8093 M+H 798.5432 PC(O-39:3) 43.4241 M+H 812.6528 PC(O-39:7) 39.3381 M+H 804.5902 PC(O-39:8) 38.113 M+H 802.5745 PC(P-37:6) 38.0535 M+H 776.5589 PC(P-37:9) 32.56 M+H 770.5119 PC(P-38:10) 35.594 M+H 782.5119 PE(16:0_16:1) 33.1281 M+H 690.5068 PE(16:0_18:1) 35.3194 M+H 718.5381 PE(16:0_22:4) 37.3352 M+H 768.5538 PE(16:1_16:1) 31.0318 M+H 688.4912 PE(18:0_18:1) 37.3304 M+H 746.5694 PE(18:0_20:1) 38.9771 M+H 774.6007 PE(18:1_18:1) 35.5889 M+H 744.5538 PE(18:1_22:6) 33.453 M+H 790.5381 PE(19:4_15:0) 33.1204 M+H 712.4912 PE(20:3_18:0) 37.0406 M+H 770.5694 PE(20:4_18:1) 35.5805 M+H 766.5381 PE(22:5_18:1) 35.2717 M+H 792.5538 PE(22:6_16:0) 33.1712 M+H 764.5225 PE(O-16:1_18:4) 34.3364 M+H 696.4963 PE(O-16:1_20:3) 36.1241 M+H 726.5432 PE(O-18:1_22:3) 39.3277 M+H 782.6058 PE(P-16:0_18:1) 36.4207 M+H 702.5432 PE(P-16:0_20:4) 34.6827 M+H 724.5276 PE(P-18:1_18:1) 36.6149 M+H 728.5589 PE(P-18:3_18:1) 36.4185 M+H 724.5276 PI(16:0_18:1) 32.682 M+NH4 854.5753 PI(16:1_18:1) 31.3842 M+NH4 852.5597 PI(18:0_20:4) 33.2233 M+NH4 904.591 PI(18:1_18:1) 32.9489 M+NH4 880.591 PI(18:1_20:4) 31.2293 M+NH4 902.5753 PI(18:2_18:1) 31.9023 M+NH4 878.5753 PI(20:4_16:0) 30.9084 M+NH4 876.5597 PI(22:3_18:0) 36.0397 M+NH4 934.6379 PS(18:0_18:1) 35.1843 M+H 790.5593 PS(18:0_22:4) 35.0656 M+H 840.5749 Cer(d18:1_16:0) 34.7886 M+H 538.5194 Cer(d18:1_17:0) 35.9363 M+H 552.535 Cer(d18:1_18:0) 37.0035 M+H 566.5507 Cer(d18:1_20:0) 38.9575 M+H 594.582 Cer(d18:1_21:0) 39.8528 M+H 608.5976 Cer(d18:1_22:0) 40.6629 M+H 622.6133 Cer(d18:1_22:1) 39.0165 M+H 620.5976 Cer(d18:1_23:0) 41.455 M+H 636.6289 Cer(d18:1_23:1) 39.8164 M+H 634.6133 Cer(d18:1_24:0) 42.1784 M+H 650.6446 Cer(d18:1_24:1) 40.636 M+H 648.6289 Cer(d18:2_16:0) 32.8512 M+H 536.5037 Cer(d18:2_18:0) 35.2925 M+H 564.535 Cer(d18:2_24:1) 39.2829 M+H 646.6133 Cer(d19:1_24:0) 42.8877 M+H 664.6602 Cer(d20:1_24:0) 43.7329 M+H 678.6759 Cer(d20:1_24:1) 42.1048 M+H 676.6602 Hex1Cer(d18:1_24:0) 40.6141 M+H 812.6974 Hex2Cer(d18:1_16:0) 31.8489 M+H 862.625 Hex2Cer(d18:1_22:0) 38.2283 M+H 946.7189 Hex3Cer(d18:1_16:0) 31.1853 M+H 1024.6778 Hex3Cer(d18:1_24:0) 39.3559 M+H 1136.803 LSM(d14:1) 25.0468 M+H 409.2826 SM(d18:1_16:0) 31.9609 M+H 703.5749 SM(d18:1_24:0) 40.2885 M+H 815.7001 SM(d18:1_24:1) 38.51 M+H 813.6844 SM(d18:1_26:4) 38.5127 M+H 835.6688 SM(d20:0_12:1) 29.2374 M+H 675.5436 SM(d33:1) 30.6323 M+H 689.5592 SM(d34:0) 32.9297 M+H 705.5905 SM(d34:2) 29.8512 M+H 701.5592 SM(d36:1) 34.4322 M+H 731.6062 SM(d36:2) 32.5164 M+H 729.5905 SM(d36:3) 32.9471 M+H 727.5749 SM(d36:4) 31.9422 M+H 725.5592 SM(d38:1) 36.656 M+H 759.6375 SM(d38:2) 33.5698 M+H 757.6218 SM(d40:1) 38.5458 M+H 787.6688 SM(d41:1) 39.5266 M+H 801.6844 SM(d42:3) 37.0154 M+H 811.6688 SPH(d14:1) 6.8843 M+H 244.2271 SPH(d14:2) 20.6459 M+H 242.2115 SPH(d16:0) 3.4913 M+H 274.2741 SPH(d16:1) 11.3758 M+H 272.2584 SPH(d17:0) 4.5625 M+H 288.2897 SPH(d18:0) 6.4292 M+H 302.3054 SPH(d18:1) 16.275 M+H 300.2897 SPH(d18:2) 10.2498 M+H 298.2741 SPH(d19:0) 8.3253 M+H 316.321 SPH(d20:0) 10.4344 M+H 330.3367 TG(12:0_16:0_16:1) 44.9943 M+NH4 766.6919 TG(12:1_14:1_18:1) 43.0201 M+NH4 762.6606 TG(14:0_14:0_16:0) 45.9747 M+NH4 768.7076 TG(14:0_16:0_16:0) 46.9877 M+NH4 796.7389 TG(14:0_16:0_16:1) 46.0539 M+NH4 794.7232 TG(14:0_16:0_22:6) 45.7097 M+NH4 868.7389 TG(14:0_16:1_20:4) 45.0527 M+NH4 842.7232 TG(14:1_16:1_16:1) 44.0445 M+NH4 790.6919 TG(14:1_16:1_18:1) 45.1401 M+NH4 818.7232 TG(15:0_16:0_16:1) 46.5609 M+NH4 808.7389 TG(15:0_16:0_18:1) 47.4889 M+NH4 836.7702 TG(16:0_12:1_16:1) 43.9774 M+NH4 764.6763 TG(16:0_14:1_16:1) 45.0827 M+NH4 792.7076 TG(16:0_16:0_16:1) 47.0396 M+NH4 822.7545 TG(16:0_16:0_18:0) 48.7316 M+NH4 852.8015 TG(16:0_16:0_18:1) 47.9123 M+NH4 850.7858 TG(16:0_16:1_16:1) 46.1215 M+NH4 820.7389 TG(16:0_16:1_18:1) 47.0776 M+NH4 848.7702 TG(16:0_16:1_20:4) 46.073 M+NH4 870.7545 TG(16:0_16:1_22:6) 45.7699 M+NH4 894.7545 TG(16:0_18:0_18:0) 49.4846 M+NH4 880.8328 TG(16:0_18:0_18:1) 48.7364 M+NH4 878.8171 TG(16:0_18:0_19:1) 49.1062 M+NH4 892.8328 TG(16:0_18:1_18:1) 47.9349 M+NH4 876.8015 TG(16:0_18:1_22:3) 48.0938 M+NH4 928.8328 TG(16:0_18:1_22:4) 47.7052 M+NH4 926.8171 TG(16:0_20:1_22:1) 50.1163 M+NH4 960.8954 TG(16:0_22:0_18:1) 50.1763 M+NH4 934.8797 TG(16:0_24:0_18:1) 50.8086 M+NH4 962.911 TG(16:0_26:0_18:1) 51.3755 M+NH4 990.9423 TG(16:1_16:1_18:1) 46.1708 M+NH4 846.7545 TG(16:1_16:1_18:2) 45.488 M+NH4 844.7389 TG(16:1_16:1_22:6) 44.7859 M+NH4 892.7389 TG(16:1_18:1_18:1) 47.1109 M+NH4 874.7858 TG(16:1_18:1_18:2) 46.603 M+NH4 872.7702 TG(16:1_18:1_20:1) 47.9431 M+NH4 902.8171 TG(16:1_18:1_20:3) 46.8907 M+NH4 898.7858 TG(16:1_18:1_22:6) 45.8173 M+NH4 920.7702 TG(17:0_16:1_18:1) 47.5145 M+NH4 862.7858 TG(18:0_18:0_18:1) 49.4845 M+NH4 906.8484 TG(18:0_18:1_18:1) 48.7326 M+NH4 904.8328 TG(18:0_18:1_19:1) 49.0882 M+NH4 918.8484 TG(18:0_18:1_20:1) 49.4492 M+NH4 932.8641 TG(18:0_18:1_26:1) 51.3468 M+NH4 1016.958 TG(18:1_18:1_20:1) 48.7148 M+NH4 930.8484 TG(18:1_18:1_22:3) 48.347 M+NH4 954.8484 TG(18:1_18:1_22:4) 47.6886 M+NH4 952.8328 TG(18:1_18:1_26:1) 50.6997 M+NH4 1014.9423 TG(18:1_19:1_20:1) 49.0661 M+NH4 944.8641 TG(18:1_20:1_20:1) 49.4338 M+NH4 958.8797 TG(18:1_20:1_20:2) 48.8417 M+NH4 956.8641 TG(18:1_20:1_22:1) 50.0924 M+NH4 986.911 TG(18:1_20:1_22:2) 49.4875 M+NH4 984.8954 TG(18:1_20:1_22:3) 49.0247 M+NH4 982.8797 TG(18:1_20:1_26:1) 51.2574 M+NH4 1042.9736 TG(2:0_16:0_16:1) 38.3723 M+NH4 626.5354 TG(24:0_18:1_18:1) 50.7491 M+NH4 988.9267 TG(4:0_14:0_16:0) 39.8327 M+NH4 628.5511 TG(4:0_16:0_16:0) 41.468 M+NH4 656.5824 TG(4:0_16:0_16:1) 40.0204 M+NH4 654.5667 TG(4:0_16:0_18:1) 41.585 M+NH4 682.598 TG(4:0_16:1_16:1) 38.4518 M+NH4 652.5511 TG(4:0_16:1_18:1) 40.1811 M+NH4 680.5824 TG(5:0_16:0_16:1) 40.6716 M+NH4 668.5824 TG(6:0_16:1_18:1) 41.5313 M+NH4 708.6137 TG(8:0_16:0_16:0) 43.8393 M+NH4 712.645 TG(8:0_16:0_16:1) 42.671 M+NH4 710.6293 TG(8:0_16:0_18:1) 43.9138 M+NH4 738.6606 TG(8:0_16:1_18:1) 42.9293 M+NH4 736.645 TG(9:0_16:0_16:1) 43.2248 M+NH4 724.645 TG(O-11:0_14:0_3:0) 34.414 M+NH4 530.4779 TG(O-12:1_4:0_16:1) 35.0615 M+NH4 582.5092 TG(O-12:1_6:0_18:1) 39.0055 M+NH4 638.5718 TG(O-13:0_16:0_3:0) 38.6234 M+NH4 586.5405 TG(O-13:0_5:0_20:3) 40.2398 M+NH4 664.5875 TG(O-15:0_18:0_3:0) 41.9539 M+NH4 642.6031 METABOLITES_END #END