#METABOLOMICS WORKBENCH ftobias_20220130_131819 DATATRACK_ID:3057 STUDY_ID:ST002070 ANALYSIS_ID:AN003375 PROJECT_ID:PR001312 VERSION 1 CREATED_ON January 31, 2022, 8:14 am #PROJECT PR:PROJECT_TITLE Lipidomic Comparison of 2D and 3D Colon Cancer Cell Culture Models PR:PROJECT_TYPE Untargeted Lipidomics PR:PROJECT_SUMMARY Altered lipid metabolism is one of the hallmarks of cancer. Cellular PR:PROJECT_SUMMARY proliferation and de novo synthesis of lipids are related to cancer progression. PR:PROJECT_SUMMARY In this study, we evaluated the lipidomic profile of two-dimensional (2D) PR:PROJECT_SUMMARY monolayer and multicellular tumor spheroids from the HCT 116 colon carcinoma PR:PROJECT_SUMMARY cell line. We utilized serial trypsinization on the spheroid samples to generate PR:PROJECT_SUMMARY three cellular populations representing the proliferative, quiescent, and PR:PROJECT_SUMMARY necrotic regions of the spheroid. This analysis enabled a comprehensive PR:PROJECT_SUMMARY identification and quantification of lipids produced in each of the spheroid PR:PROJECT_SUMMARY layer and 2D cultures. We show that lipid subclasses associated with lipid PR:PROJECT_SUMMARY droplets form in oxygen-restricted and acidic regions of spheroids and are PR:PROJECT_SUMMARY produced at higher levels than in 2D cultures. Additionally, sphingolipid PR:PROJECT_SUMMARY production, which is implicated in cell death and survival pathways, is higher PR:PROJECT_SUMMARY in spheroids relative to 2D cells. Finally, we show that increased numbers of PR:PROJECT_SUMMARY lipids comprised of polyunsaturated fatty acids (PUFAs) are produced in the PR:PROJECT_SUMMARY quiescent and necrotic regions of the spheroid. The lipidomic signature for each PR:PROJECT_SUMMARY region and cell culture type highlights the importance of understanding the PR:PROJECT_SUMMARY spatial aspects of cancer biology. These results provide additional lipid PR:PROJECT_SUMMARY biomarkers in the tumor microenvironment that can be further studied during PR:PROJECT_SUMMARY potential therapeutic studies which target pivotal lipid production pathways. PR:INSTITUTE The Ohio State University PR:DEPARTMENT Department of Chemistry and Biochemistry PR:LABORATORY Amanda B Hummon Research Group PR:LAST_NAME Tobias PR:FIRST_NAME Fernando PR:ADDRESS 100 W 18th Avenue, Columbus, Ohio, 43210, USA PR:EMAIL tobias.62@osu.edu PR:PHONE 1234567890 #STUDY ST:STUDY_TITLE Lipidomic Comparison of 2D and 3D Colon Cancer Cell Culture Models ST:STUDY_TYPE Untargeted Lipidomics ST:STUDY_SUMMARY Altered lipid metabolism is one of the hallmarks of cancer. Cellular ST:STUDY_SUMMARY proliferation and de novo synthesis of lipids are related to cancer progression. ST:STUDY_SUMMARY In this study, we evaluated the lipidomic profile of two-dimensional (2D) ST:STUDY_SUMMARY monolayer and multicellular tumor spheroids from the HCT 116 colon carcinoma ST:STUDY_SUMMARY cell line. We utilized serial trypsinization on the spheroid samples to generate ST:STUDY_SUMMARY three cellular populations representing the proliferative, quiescent, and ST:STUDY_SUMMARY necrotic regions of the spheroid. This analysis enabled a comprehensive ST:STUDY_SUMMARY identification and quantification of lipids produced in each of the spheroid ST:STUDY_SUMMARY layer and 2D cultures. We show that lipid subclasses associated with lipid ST:STUDY_SUMMARY droplets form in oxygen-restricted and acidic regions of spheroids and are ST:STUDY_SUMMARY produced at higher levels than in 2D cultures. Additionally, sphingolipid ST:STUDY_SUMMARY production, which is implicated in cell death and survival pathways, is higher ST:STUDY_SUMMARY in spheroids relative to 2D cells. Finally, we show that increased numbers of ST:STUDY_SUMMARY lipids comprised of polyunsaturated fatty acids (PUFAs) are produced in the ST:STUDY_SUMMARY quiescent and necrotic regions of the spheroid. The lipidomic signature for each ST:STUDY_SUMMARY region and cell culture type highlights the importance of understanding the ST:STUDY_SUMMARY spatial aspects of cancer biology. These results provide additional lipid ST:STUDY_SUMMARY biomarkers in the tumor microenvironment that can be further studied during ST:STUDY_SUMMARY potential therapeutic studies which target pivotal lipid production pathways. ST:INSTITUTE The Ohio State University ST:LAST_NAME Tobias ST:FIRST_NAME Fernando ST:ADDRESS 100 W 18th Avenue, Columbus, Ohio, 43210, USA ST:EMAIL tobias.62@osu.edu ST:PHONE 12345678907 #SUBJECT SU:SUBJECT_TYPE Cultured cells SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 SU:GENDER Male SU:CELL_STRAIN_DETAILS HCT 116 SU:SUBJECT_COMMENTS HCT 116 cell line was cultured as a 2D monolayer and 3D spheroids #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 - 2 QC10 GROUP:QC1 | TYPE:QC FILE=QC 10; REP=QC; RAW_FILE_NAME=2 QC10 SUBJECT_SAMPLE_FACTORS - 3 QC20 GROUP:QC2 | TYPE:QC FILE=QC 20; REP=QC; RAW_FILE_NAME=3 QC20 SUBJECT_SAMPLE_FACTORS - 4 QC40 GROUP:QC3 | TYPE:QC FILE=QC 40; REP=QC; RAW_FILE_NAME=4 QC40 SUBJECT_SAMPLE_FACTORS - 5 2D1 GROUP:2D1 | TYPE:2D FILE=2D1; REP=1; RAW_FILE_NAME=5 2D1 SUBJECT_SAMPLE_FACTORS - 6 P1O GROUP:Outer1_1 | TYPE:SPHEROID FILE=P1O; REP=1; RAW_FILE_NAME=6 P1O SUBJECT_SAMPLE_FACTORS - 7 P1M GROUP:Middle1_1 | TYPE:SPHEROID FILE=P1M; REP=1; RAW_FILE_NAME=7 P1M SUBJECT_SAMPLE_FACTORS - 8 P1C GROUP:Core1_1 | TYPE:SPHEROID FILE=P1C; REP=1; RAW_FILE_NAME=8 P1C SUBJECT_SAMPLE_FACTORS - 9 2D2 GROUP:2D2_1 | TYPE:2D FILE=2D2; REP=2; RAW_FILE_NAME=9 2D2 SUBJECT_SAMPLE_FACTORS - 10 P2O GROUP:Outer2_1 | TYPE:SPHEROID FILE=P2O; REP=2; RAW_FILE_NAME=10 P2O SUBJECT_SAMPLE_FACTORS - 11 P2M GROUP:Middle2_1 | TYPE:SPHEROID FILE=P2M; REP=2; RAW_FILE_NAME=11 P2M SUBJECT_SAMPLE_FACTORS - 12 P2C GROUP:Core2_1 | TYPE:SPHEROID FILE=P2C; REP=2; RAW_FILE_NAME=12 P2C SUBJECT_SAMPLE_FACTORS - 13 QC10 GROUP:QC4 | TYPE:QC FILE=QC 10; REP=QC; RAW_FILE_NAME=13 QC10 SUBJECT_SAMPLE_FACTORS - 14 2D3 GROUP:2D3_1 | TYPE:2D FILE=2D3; REP=3; RAW_FILE_NAME=14 2D3 SUBJECT_SAMPLE_FACTORS - 15 P3O GROUP:Outer3_1 | TYPE:SPHEROID FILE=P3O; REP=3; RAW_FILE_NAME=15 P3O SUBJECT_SAMPLE_FACTORS - 16 P3M GROUP:Middle3_1 | TYPE:SPHEROID FILE=P3M; REP=3; RAW_FILE_NAME=16 P3M SUBJECT_SAMPLE_FACTORS - 17 P3C GROUP:Core3_1 | TYPE:SPHEROID FILE=P3C; REP=3; RAW_FILE_NAME=17 P3C SUBJECT_SAMPLE_FACTORS - 18 2D4 GROUP:2D4_1 | TYPE:2D FILE=2D4; REP=4; RAW_FILE_NAME=18 2D4 SUBJECT_SAMPLE_FACTORS - 19 P4O GROUP:Outer4_1 | TYPE:SPHEROID FILE=P4O; REP=4; RAW_FILE_NAME=19 P4O SUBJECT_SAMPLE_FACTORS - 20 P4M GROUP:Middle4_1 | TYPE:SPHEROID FILE=P4M; REP=4; RAW_FILE_NAME=20 P4M SUBJECT_SAMPLE_FACTORS - 21 P4C GROUP:Core4_1 | TYPE:SPHEROID FILE=P4C; REP=4; RAW_FILE_NAME=21 P4C SUBJECT_SAMPLE_FACTORS - 22 QC20 GROUP:QC5 | TYPE:QC FILE=QC 20; REP=QC; RAW_FILE_NAME=22 QC20 SUBJECT_SAMPLE_FACTORS - 23 2D1 GROUP:2D1_2 | TYPE:2D FILE=2D1; REP=1; RAW_FILE_NAME=23 2D1 SUBJECT_SAMPLE_FACTORS - 24 P1O GROUP:Outer_2 | TYPE:SPHEROID FILE=P1O; REP=1; RAW_FILE_NAME=24 P1O SUBJECT_SAMPLE_FACTORS - 25 P1M GROUP:Middle1_2 | TYPE:SPHEROID FILE=P1M; REP=1; RAW_FILE_NAME=25 P1M SUBJECT_SAMPLE_FACTORS - 26 P1C GROUP:Core_1_2 | TYPE:SPHEROID FILE=P1C; REP=1; RAW_FILE_NAME=26 P1C SUBJECT_SAMPLE_FACTORS - 27 2D2 GROUP:2D_2_2 | TYPE:2D FILE=2D2; REP=2; RAW_FILE_NAME=27 2D2 SUBJECT_SAMPLE_FACTORS - 28 P2O GROUP:Outer2_2 | TYPE:SPHEROID FILE=P2O; REP=2; RAW_FILE_NAME=28 P2O SUBJECT_SAMPLE_FACTORS - 29 P2M GROUP:Middle2_2 | TYPE:SPHEROID FILE=P2M; REP=2; RAW_FILE_NAME=29 P2M SUBJECT_SAMPLE_FACTORS - 30 P2C GROUP:Core2_2 | TYPE:SPHEROID FILE=P2C; REP=2; RAW_FILE_NAME=30 P2C SUBJECT_SAMPLE_FACTORS - 31 QC40 GROUP:QC6 | TYPE:QC FILE=QC 40; REP=QC; RAW_FILE_NAME=31 QC40 SUBJECT_SAMPLE_FACTORS - 32 2D3 GROUP:2D3_2 | TYPE:2D FILE=2D3; REP=3; RAW_FILE_NAME=32 2D3 SUBJECT_SAMPLE_FACTORS - 33 P3O GROUP:Outer3_2 | TYPE:SPHEROID FILE=P3O; REP=3; RAW_FILE_NAME=33 P3O SUBJECT_SAMPLE_FACTORS - 34 P3M GROUP:Middle3_2 | TYPE:SPHEROID FILE=P3M; REP=3; RAW_FILE_NAME=34 P3M SUBJECT_SAMPLE_FACTORS - 35 P3C GROUP:Core3_2 | TYPE:SPHEROID FILE=P3C; REP=3; RAW_FILE_NAME=35 P3C SUBJECT_SAMPLE_FACTORS - 36 2D4 GROUP:2D4_2 | TYPE:2D FILE=2D4; REP=4; RAW_FILE_NAME=36 2D4 SUBJECT_SAMPLE_FACTORS - 37 P4O GROUP:Outer4_2 | TYPE:SPHEROID FILE=P4O; REP=4; RAW_FILE_NAME=37 P4O SUBJECT_SAMPLE_FACTORS - 38 P4M GROUP:Middle4_2 | TYPE:SPHEROID FILE=P4M; REP=4; RAW_FILE_NAME=38 P4M SUBJECT_SAMPLE_FACTORS - 39 P4C GROUP:Core4_2 | TYPE:SPHEROID FILE=P4C; REP=4; RAW_FILE_NAME=39 P4C SUBJECT_SAMPLE_FACTORS - 40 QC20 GROUP:QC7 | TYPE:QC FILE=QC 20; REP=QC; RAW_FILE_NAME=40 QC20 SUBJECT_SAMPLE_FACTORS - 41 2D1 GROUP:2D1_3 | TYPE:2D FILE=2D1; REP=1; RAW_FILE_NAME=41 2D1 SUBJECT_SAMPLE_FACTORS - 42 P1O GROUP:Outer1_3 | TYPE:SPHEROID FILE=P1O; REP=1; RAW_FILE_NAME=42 P1O SUBJECT_SAMPLE_FACTORS - 43 P1M GROUP:Middle1_3 | TYPE:SPHEROID FILE=P1M; REP=1; RAW_FILE_NAME=43 P1M SUBJECT_SAMPLE_FACTORS - 44 P1C GROUP:Core1_3 | TYPE:SPHEROID FILE=P1C; REP=1; RAW_FILE_NAME=44 P1C SUBJECT_SAMPLE_FACTORS - 45 2D2 GROUP:2D2_3 | TYPE:2D FILE=2D2; REP=2; RAW_FILE_NAME=45 2D2 SUBJECT_SAMPLE_FACTORS - 46 P2O GROUP:Outer2_3 | TYPE:SPHEROID FILE=P2O; REP=2; RAW_FILE_NAME=46 P2O SUBJECT_SAMPLE_FACTORS - 47 P2M GROUP:Middle2_3 | TYPE:SPHEROID FILE=P2M; REP=2; RAW_FILE_NAME=47 P2M SUBJECT_SAMPLE_FACTORS - 48 P2C GROUP:Core2_3 | TYPE:SPHEROID FILE=P2C; REP=2; RAW_FILE_NAME=48 P2C SUBJECT_SAMPLE_FACTORS - 49 QC40 GROUP:QC8 | TYPE:QC FILE=QC 40; REP=QC; RAW_FILE_NAME=49 QC40 SUBJECT_SAMPLE_FACTORS - 50 2D3 GROUP:2D3_3 | TYPE:2D FILE=2D3; REP=3; RAW_FILE_NAME=50 2D3 SUBJECT_SAMPLE_FACTORS - 51 P3O GROUP:Outer3_3 | TYPE:SPHEROID FILE=P3O; REP=3; RAW_FILE_NAME=51 P3O SUBJECT_SAMPLE_FACTORS - 52 P3M GROUP:Middle3_3 | TYPE:SPHEROID FILE=P3M; REP=3; RAW_FILE_NAME=52 P3M SUBJECT_SAMPLE_FACTORS - 53 P3C GROUP:Core3_3 | TYPE:SPHEROID FILE=P3C; REP=3; RAW_FILE_NAME=53 P3C SUBJECT_SAMPLE_FACTORS - 54 2D4 GROUP:2D4_3 | TYPE:2D FILE=2D4; REP=4; RAW_FILE_NAME=54 2D4 SUBJECT_SAMPLE_FACTORS - 55 P4O GROUP:Outer4_3 | TYPE:SPHEROID FILE=P4O; REP=4; RAW_FILE_NAME=55 P4O SUBJECT_SAMPLE_FACTORS - 56 P4M GROUP:Middle4_3 | TYPE:SPHEROID FILE=P4M; REP=4; RAW_FILE_NAME=56 P4M SUBJECT_SAMPLE_FACTORS - 57 P4C GROUP:Core4_3 | TYPE:SPHEROID FILE=P4C; REP=4; RAW_FILE_NAME=57 P4C SUBJECT_SAMPLE_FACTORS - 58 QC10 GROUP:QC9 | TYPE:QC FILE=QC 10; REP=QC; RAW_FILE_NAME=58 QC10 SUBJECT_SAMPLE_FACTORS - 59 QC20 GROUP:QC10 | TYPE:QC FILE=QC 20; REP=QC; RAW_FILE_NAME=59 QC20 SUBJECT_SAMPLE_FACTORS - 60 QC40 GROUP:QC11 | TYPE:QC FILE=QC 40; REP=QC; RAW_FILE_NAME=60 QC40 #COLLECTION CO:COLLECTION_SUMMARY Cell Lysates from 2D Monolayers and serially-trypsinized spheroids was subjected CO:COLLECTION_SUMMARY to lipid extraction CO:SAMPLE_TYPE Cultured cells CO:STORAGE_CONDITIONS -80℃ CO:COLLECTION_TUBE_TEMP 4 CO:ADDITIVES 1X PBS #TREATMENT TR:TREATMENT_SUMMARY HCT 116 2D monolayers were cultured per ATCC protocol, while HCT 116 3D TR:TREATMENT_SUMMARY spheroids were cultured for 14 days. At Day 14, the spheroids were subjected to TR:TREATMENT_SUMMARY Serial Trypsinization in order to obtain discrete cell populations from TR:TREATMENT_SUMMARY spheroids representing the outer, middle, and core regions. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Lipid extraction by MTBE/methanol/water solvent system SP:PROCESSING_STORAGE_CONDITIONS On ice SP:EXTRACTION_METHOD liquid-liquid extraction SP:EXTRACT_STORAGE -80℃ SP:SAMPLE_RESUSPENSION 9:1 Methanol/Toluene SP:SAMPLE_SPIKING equiSPLASH LIPIDOMIX standards #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Agilent 1260 CH:COLUMN_NAME Thermo Accucore C30 (100 x 2.1 mm, 2.6 um) CH:FLOW_RATE 400uL/min CH:COLUMN_TEMPERATURE 50 CH:SOLVENT_A 50/50 Water/Acetonitrile, 10 mM Ammonium Formate CH:SOLVENT_B 90/10 Isopronanol/Acetonitrile, 10 mM Ammonium Formate CH:INJECTION_TEMPERATURE 4 CH:INTERNAL_STANDARD equiSPLASH LIPIDOMIX CH:SAMPLE_INJECTION 2 #ANALYSIS AN:ANALYSIS_TYPE MS AN:LABORATORY_NAME Campus Chemical Instrument Center AN:OPERATOR_NAME Fernando Tobias AN:DETECTOR_TYPE MS #MS MS:INSTRUMENT_NAME Agilent 6545 QTOF MS:INSTRUMENT_TYPE QTOF MS:MS_TYPE ESI MS:ION_MODE NEGATIVE MS:MS_COMMENTS MS-Only on biological samples, Auto-MSMS on Pooled Sample #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS pmol lipid/ ug protein MS_METABOLITE_DATA_START Samples 2 QC10 3 QC20 13 QC10 22 QC20 31 QC40 5 2D1 23 2D1 41 2D1 9 2D2 27 2D2 45 2D2 14 2D3 32 2D3 18 2D4 36 2D4 54 2D4 6 P1O 24 P1O 42 P1O 10 P2O 28 P2O 46 P2O 15 P3O 33 P3O 19 P4O 37 P4O 55 P4O 7 P1M 25 P1M 43 P1M 11 P2M 29 P2M 47 P2M 16 P3M 20 P4M 38 P4M 56 P4M 8 P1C 26 P1C 12 P2C 30 P2C 48 P2C 17 P3C 35 P3C 21 P4C 39 P4C 57 P4C Factors GROUP:QC1 | TYPE:QC GROUP:QC2 | TYPE:QC GROUP:QC4 | TYPE:QC GROUP:QC5 | TYPE:QC GROUP:QC6 | TYPE:QC GROUP:2D1 | TYPE:2D GROUP:2D1_2 | TYPE:2D GROUP:2D1_3 | TYPE:2D GROUP:2D2_1 | TYPE:2D GROUP:2D_2_2 | TYPE:2D GROUP:2D2_3 | TYPE:2D GROUP:2D3_1 | TYPE:2D GROUP:2D3_2 | TYPE:2D GROUP:2D4_1 | TYPE:2D GROUP:2D4_2 | TYPE:2D GROUP:2D4_3 | TYPE:2D GROUP:Outer1_1 | TYPE:SPHEROID GROUP:Outer_2 | TYPE:SPHEROID GROUP:Outer1_3 | TYPE:SPHEROID GROUP:Outer2_1 | TYPE:SPHEROID GROUP:Outer2_2 | TYPE:SPHEROID GROUP:Outer2_3 | TYPE:SPHEROID GROUP:Outer3_1 | TYPE:SPHEROID GROUP:Outer3_2 | TYPE:SPHEROID GROUP:Outer4_1 | TYPE:SPHEROID GROUP:Outer4_2 | TYPE:SPHEROID GROUP:Outer4_3 | TYPE:SPHEROID GROUP:Middle1_1 | TYPE:SPHEROID GROUP:Middle1_2 | TYPE:SPHEROID GROUP:Middle1_3 | TYPE:SPHEROID GROUP:Middle2_1 | TYPE:SPHEROID GROUP:Middle2_2 | TYPE:SPHEROID GROUP:Middle2_3 | TYPE:SPHEROID GROUP:Middle3_1 | TYPE:SPHEROID GROUP:Middle4_1 | TYPE:SPHEROID GROUP:Middle4_2 | TYPE:SPHEROID GROUP:Middle4_3 | TYPE:SPHEROID GROUP:Core1_1 | TYPE:SPHEROID GROUP:Core_1_2 | TYPE:SPHEROID GROUP:Core2_1 | TYPE:SPHEROID GROUP:Core2_2 | TYPE:SPHEROID GROUP:Core2_3 | TYPE:SPHEROID GROUP:Core3_1 | TYPE:SPHEROID GROUP:Core3_2 | TYPE:SPHEROID GROUP:Core4_1 | TYPE:SPHEROID GROUP:Core4_2 | TYPE:SPHEROID GROUP:Core4_3 | TYPE:SPHEROID SHexCer 40:1;2O 0.003958168 0.003978522 0.003695502 0.004179204 0.003757288 0.002301919 0.00270319 0.00267364 0.003624518 0.00395088 0.004088659 0.003029374 0.003745014 0.002643488 0.002889606 0.002603668 0.005218078 0.006099085 0.00596127 0.005161572 0.00602599 0.006187302 0.005250471 0.006223383 0.005973457 0.006383681 0.006121197 0.00556254 0.0063397 0.00619978 0.006742259 0.007365939 0.008245906 0.006507236 0.006790357 0.007427782 0.006749982 0.006922742 0.007689614 0.005228908 0.006025091 0.005614084 0.005531007 0.006106578 0.00707875 0.007228262 0.006891659 SHexCer 42:1;2O 0.0188869 0.01874268 0.01884251 0.02014945 0.02091553 0.01110632 0.01307294 0.01270254 0.02053779 0.02561773 0.02648022 0.01833958 0.02536188 0.01532612 0.01588171 0.01522641 0.03080532 0.03541313 0.0359574 0.02931169 0.03268446 0.03536906 0.03312673 0.03814265 0.03447118 0.03602262 0.03570697 0.02947566 0.03347101 0.03445606 0.03416705 0.03870721 0.0424833 0.03634249 0.03534885 0.03846451 0.03645266 0.03531765 0.04037875 0.02710105 0.03092778 0.03005573 0.03018207 0.03349086 0.037013 0.03630013 0.03666302 SHexCer 42:2;3O 0.002766462 0.002792621 0.002783463 0.003122609 0.002941176 0.001150728 0.001514861 0.001420357 0.00211166 0.002727729 0.002702124 0.001955289 0.002346552 0.001383289 0.001536006 0.00151668 0.0040547 0.004804167 0.004789927 0.003524084 0.004134789 0.004228536 0.00495292 0.005771319 0.004869781 0.005487885 0.005025984 0.004122419 0.00516624 0.004760395 0.00512102 0.005844216 0.005853629 0.005675698 0.005584134 0.005928414 0.005222731 0.006641163 0.008026913 0.004723365 0.005706378 0.005363512 0.005744811 0.006521609 0.005974128 0.005869118 0.005317752 SHexCer 41:2;3O 0.007013817 0.007628469 0.007261652 0.007763437 0.006815959 0.00537772 0.005743985 0.005695633 0.008286261 0.009460595 0.01054404 0.008707393 0.0112146 0.006071375 0.006226273 0.006408338 0.005521953 0.005922539 0.006114834 0.003786046 0.004176642 0.004540703 0.005773628 0.006574056 0.006537706 0.006479408 0.006518883 0.007645173 0.008345779 0.007814814 0.01066505 0.01170146 0.01369796 0.01047934 0.01143153 0.01233876 0.0104597 0.01281639 0.01147749 0.007651747 0.008236322 0.008037955 0.009360659 0.01058389 0.01004399 0.00992899 0.009715378 SHexCer 42:2;2O 0.01422743 0.0157584 0.01476441 0.01655645 0.01755 0.009237637 0.009820085 0.009090388 0.01302455 0.0133221 0.0121873 0.01007025 0.01087443 0.009491248 0.008731927 0.007805969 0.01784975 0.01803165 0.01749718 0.01768897 0.018378 0.017406 0.0169241 0.01727714 0.01933694 0.0191838 0.01769555 0.02208885 0.02296937 0.02101358 0.02463632 0.02476745 0.02716845 0.02552265 0.0245978 0.02401715 0.02107272 0.02408042 0.02301335 0.01955524 0.01929389 0.01774865 0.02017051 0.01943833 0.02385928 0.02249519 0.01959443 SHexCer 34:0;2O 0.002204602 0.002256088 0.002377217 0.002735454 0.00236136 0.000265561 0.000203138 0.000305998 0.000215357 0.001130415 0.000227277 4.63E-05 5.10E-05 0.000323281 0.000271294 0.000246028 0.003052563 0.003756313 0.00383605 0.002718074 0.003272447 0.003565997 0.002443494 0.00288345 0.003603232 0.004244493 0.004172532 0.005587782 0.006751717 0.006862232 0.007670104 0.00943089 0.01031034 0.007394281 0.007054931 0.008673907 0.007554321 0.005221176 0.00584371 0.003763185 0.004346548 0.004248534 0.004764935 0.006044145 0.007074011 0.007220949 0.006824407 SHexCer 42:1;3O 0.005674606 0.006195941 0.005863306 0.006534191 0.007107658 0.001099597 0.001257153 0.001288532 0.002348652 0.00291638 0.003190164 0.001777162 0.002513129 0.001270528 0.00135121 0.001343283 0.007464951 0.009161217 0.009883502 0.005291855 0.006377399 0.007227906 0.00767629 0.009212091 0.009020856 0.009925066 0.009684907 0.007726078 0.00970135 0.00960121 0.01283095 0.01649298 0.01885044 0.01261695 0.01381442 0.01617734 0.01352718 0.0159722 0.01581675 0.008380446 0.009630263 0.008710969 0.01116629 0.01362838 0.01374266 0.01382775 0.01340556 SHexCer 34:1;2O 0.05784393 0.07517716 0.06769099 0.07712032 0.07307188 0.02313764 0.02829989 0.02778977 0.04084396 0.04986706 0.05381731 0.0348728 0.04989351 0.03101632 0.03480045 0.03422979 0.05683156 0.07023566 0.07156134 0.05249267 0.06224716 0.06648838 0.06202084 0.07740528 0.06575131 0.07273391 0.07021992 0.05962059 0.07126965 0.06872898 0.08221079 0.09920112 0.1142963 0.07353648 0.088389 0.1005161 0.08392693 0.06686497 0.06981941 0.05248594 0.0581601 0.05544485 0.06254306 0.07248318 0.08991812 0.08950397 0.08680569 SHexCer 32:1;2O 0.003271912 0.00430002 0.004107025 0.004856658 0.00425243 0.00082822 0.001028804 0.000981554 0.001451136 0.001920609 0.001916658 0.001108791 0.001592051 0.001095724 0.001134832 0.001109453 0.003061701 0.004084014 0.004236059 0.002621902 0.00334909 0.003484096 0.003276061 0.004285758 0.004108078 0.00463187 0.004237966 0.004150811 0.005398898 0.005138458 0.005697271 0.007515946 0.00854785 0.00515119 0.006163875 0.00737087 0.006192272 0.004189646 0.00490699 0.003505061 0.004071713 0.003896329 0.004264114 0.005296778 0.006611006 0.006738075 0.006187484 PS 36:1|PS 18:0_18:1 0.2928793 0.3114282 0.2915431 0.3455025 0.3085886 0.234844 0.2352659 0.2225963 0.2340647 0.2353971 0.231925 0.2724784 0.2600057 0.2329549 0.224466 0.2182772 0.2727257 0.2644095 0.254635 0.251534 0.2473184 0.2398281 0.2630808 0.2503531 0.2698413 0.2585493 0.2504629 0.2979532 0.2841592 0.2782648 0.2719881 0.2659864 0.2636105 0.2813773 0.2718291 0.2647634 0.2646275 0.3016727 0.2935506 0.3164773 0.301638 0.2940327 0.2938762 0.2795602 0.2725535 0.2657001 0.2614343 PS 40:4|PS 18:0_22:4 0.006375453 0.00611772 0.007192288 0.00756962 0.005365647 0.004023259 0.003967019 0.003544582 0.007751652 0.008348865 0.008438751 0.007618892 0.007950713 0.006047057 0.005398505 0.005078135 0.008676642 0.009101105 0.008872881 0.00671093 0.006779608 0.008035246 0.01045041 0.01224132 0.008005446 0.007639685 0.007220032 0.004801493 0.004856115 0.004537621 0.007387637 0.007626165 0.008045791 0.006282168 0.007053284 0.007221436 0.005758536 0.009265798 0.007119235 0.006479416 0.005662787 0.005033077 0.006473371 0.006832629 0.00854844 0.007887709 0.007781484 PI 40:6|PI 18:0_22:6 0.288085 0.2826745 0.2893607 0.2793125 0.2869147 0.1353776 0.1413686 0.1706928 0.2474413 0.2654729 0.2952303 0.1900101 0.2233624 0.1873902 0.1902004 0.2217304 0.2366742 0.2354998 0.2844831 0.2089101 0.2231166 0.2938875 0.2918628 0.3414712 0.2860038 0.3062623 0.360935 0.212608 0.2037157 0.2199352 0.2856608 0.2942891 0.3371631 0.2290975 0.3321162 0.3608861 0.3607536 0.2698379 0.2483552 0.2216711 0.2312132 0.2473135 0.2405787 0.2733084 0.3382983 0.3498439 0.3914558 PI 36:4|PI 16:0_20:4 0.6376618 0.6322964 0.649856 0.6178104 0.617373 0.3842969 0.3672646 0.3948721 0.7065297 0.7351856 0.7874738 0.4953813 0.6240553 0.4515293 0.4396897 0.4592404 0.8082169 0.7488959 0.795904 0.7606931 0.7493917 0.8328896 0.9430557 0.9836522 0.8262073 0.8121142 0.8213185 0.583932 0.5618404 0.5571518 0.7781419 0.7897271 0.8282028 0.6708344 0.8771383 0.8774825 0.8140405 0.6702186 0.6037154 0.5461864 0.5102647 0.5176073 0.6028322 0.6269614 0.7924995 0.7465214 0.7610511 PI 40:1|PI 18:0_22:1 0.02508609 0.02551551 0.02651767 0.02532214 0.02497307 0.01770748 0.01749542 0.01770954 0.02718704 0.02767312 0.02868526 0.02383659 0.02950925 0.0183021 0.01778074 0.001250529 0.0208806 0.02038175 0.02036132 0.01521262 0.01535452 0.01470448 0.02253244 0.02048372 0.02668833 0.02555199 0.02609243 0.03207095 0.02892902 0.02795571 0.03400833 0.03123104 0.03168311 0.02996582 0.04097483 0.03968947 0.03710224 0.03461278 0.02732931 0.03326467 0.03188043 0.03152158 0.03380581 0.03416273 0.0409483 0.03712703 0.03726181 PI 40:5|PI 18:0_22:5 0.1384162 0.1355558 0.1354581 0.1430189 0.141296 0.06161058 0.0661585 0.07243019 0.0886597 0.1066569 0.1163241 0.08691831 0.1165209 0.07293582 0.07746871 0.08579315 0.1409851 0.1466403 0.1597789 0.1278371 0.1372748 0.1501792 0.1482568 0.1752072 0.1678571 0.177935 0.1816182 0.1580329 0.1622985 0.1667239 0.1717594 0.2041715 0.2419486 0.1603804 0.2205518 0.239561 0.222797 0.1666664 0.1663774 0.1579937 0.1699329 0.1692265 0.1652116 0.176855 0.2087301 0.213433 0.2170371 PI 36:3|PI 18:1_18:2 0.2026416 0.203327 0.2070361 0.2082493 0.1952821 0.1164451 0.1107714 0.1198887 0.2006048 0.2071453 0.2159073 0.1422719 0.1694429 0.1225582 0.123717 0.128906 0.2160993 0.2075467 0.2188586 0.2029501 0.200328 0.2251013 0.2609355 0.2769166 0.2314804 0.2247731 0.2288256 0.1740489 0.1709417 0.1676289 0.2326079 0.2270528 0.2344709 0.2081097 0.2515412 0.2529117 0.2321084 0.1912345 0.1714167 0.1550061 0.1461957 0.1473207 0.1788303 0.1869271 0.2358316 0.222033 0.2229891 PI 38:2|PI 18:0_20:2 0.1681298 0.1622683 0.1628255 0.1595357 0.1701234 0.1746896 0.1611336 0.1753717 0.1549941 0.1595303 0.1692833 0.2596037 0.326766 0.1875757 0.1809678 0.1945966 0.1009551 0.09352844 0.1003765 0.07426164 0.07401419 0.08103079 0.09328672 0.09150699 0.1294403 0.1188769 0.1247379 0.1529224 0.1523839 0.1522867 0.1814162 0.1807337 0.2084803 0.1691823 0.2173011 0.2230787 0.2133669 0.1674033 0.1457616 0.1491167 0.1438461 0.1460769 0.1639941 0.168682 0.1952475 0.1847484 0.187775 PI 38:3|PI 18:0_20:3 0.7832243 0.7909621 0.7898501 0.73781 0.7684568 0.5187489 0.49754 0.5159701 0.6341105 0.624989 0.6368026 0.6356189 0.7591194 0.5532431 0.5259299 0.5150954 0.773118 0.7083939 0.7275788 0.7501133 0.6989892 0.7100426 0.8178173 0.8437356 0.8627306 0.795963 0.8232873 0.8689696 0.7942464 0.7850103 0.9710861 0.9549266 1.103229 0.8483884 1.101538 1.118012 1.040206 0.8307416 0.7397565 0.8082371 0.747639 0.7521104 0.807214 0.8009161 0.9986536 0.923546 0.9390002 PI 40:3|PI 18:0_22:3 0.0315879 0.03004138 0.03068671 0.03145069 0.03255548 0.01568869 0.01695786 0.01851002 0.02244674 0.02332893 0.0241457 0.02147383 0.02585472 0.01819715 0.01897691 0.02066938 0.03014133 0.03213655 0.03385635 0.02730407 0.02955744 0.03090575 0.02747595 0.0293966 0.03496323 0.03584425 0.0359099 0.03820365 0.03942306 0.03863076 0.04092438 0.04412598 0.04868194 0.03805303 0.05238321 0.05327887 0.05111985 0.03959855 0.03794693 0.03727382 0.03958904 0.03883147 0.03846466 0.04164776 0.04813386 0.04730968 0.047668 PI 36:5 0.01505904 0.01457542 0.01489135 0.01458132 0.01569983 0.004803681 0.004798722 0.005131592 0.008523601 0.008593802 0.009466454 0.005578609 0.00782754 0.004854664 0.004906151 0.004805954 0.008997587 0.008845637 0.009612291 0.009337137 0.009153549 0.01029911 0.008174056 0.00965994 0.009471083 0.009870057 0.009980161 0.009684991 0.009041658 0.00894338 0.01247639 0.01283472 0.01474993 0.0104411 0.0140323 0.01511171 0.01310512 0.008352247 0.007630019 0.00689112 0.006860267 0.006475923 0.008075383 0.008385135 0.01114618 0.01057628 0.01067451 PI 32:2|PI 16:1_16:1 0.06667607 0.06479397 0.06534548 0.06216284 0.0620952 0.01199863 0.01111552 0.01200297 0.0488826 0.05057018 0.05260403 0.01184438 0.01568095 0.01378532 0.01344116 0.01410868 0.03120797 0.02990714 0.03173407 0.03143686 0.0311432 0.03364609 0.03654779 0.0421509 0.03894631 0.03977614 0.03966913 0.03519922 0.03360421 0.0336352 0.04798928 0.04818618 0.05287312 0.03775404 0.05921052 0.06214404 0.05656237 0.04405825 0.03962611 0.03993455 0.03726372 0.03880297 0.04217835 0.04474127 0.06639934 0.0633169 0.0624787 PI 36:0|PI 18:0_18:0 0.02263102 0.02336319 0.02254039 0.02177916 0.02386965 0.01601373 0.01532309 0.01506501 0.01791876 0.01567566 0.01467372 0.01699447 0.01708932 0.01441833 0.01253203 0.0122811 0.02316088 0.01948051 0.01816126 0.02041713 0.01795534 0.01605844 0.01789879 0.01449416 0.02111485 0.0186865 0.01809002 0.04146844 0.03622091 0.033364 0.03711222 0.03346248 0.03563998 0.04144019 0.0303447 0.02985107 0.02670667 0.01800222 0.01552734 0.01927868 0.01784829 0.01670976 0.01894422 0.01805975 0.01811401 0.01632571 0.01596985 PI 36:1|PI 18:0_18:1 2.900471 2.911179 3.062316 2.743777 2.804204 2.523388 2.420929 2.612023 3.239501 3.091223 3.083628 2.878141 2.623565 2.781383 2.602373 2.766876 1.926978 1.778351 1.874613 1.648003 1.620838 1.724027 2.050183 2.022422 2.310633 2.177853 2.287483 2.500116 2.28191 2.294623 2.549722 2.337254 2.226937 2.419216 3.064588 2.874412 2.976992 2.087946 1.948718 2.213143 2.076348 2.131948 2.343475 2.261973 2.730161 2.565365 2.728155 PI 38:4|PI 18:0_20:4 3.955584 3.658613 3.690257 3.453956 3.693545 2.173203 2.065895 2.234281 2.946944 2.862622 2.864107 2.529636 2.296764 2.55691 2.447963 2.549915 2.802333 2.459147 2.470545 3.221138 2.986791 2.903866 2.844063 2.518923 3.305883 3.05652 3.112696 3.082433 2.755694 2.782399 2.740914 2.429677 2.146342 2.516398 3.30543 2.961623 3.152279 2.1006 2.042597 3.044881 2.790459 2.928321 2.796185 2.503033 3.28704 3.106207 3.106828 PI 38:1|PI 18:0_20:1 0.1733137 0.1756407 0.1655789 0.1546642 0.1651196 0.1617381 0.152641 0.1643879 0.1812382 0.1677827 0.1672608 0.1867695 0.19863 0.1548406 0.1492452 0.1493569 0.1082158 0.09947512 0.09818593 0.09842414 0.09305369 0.08743962 0.116011 0.1074144 0.1328644 0.1274327 0.129355 0.1415213 0.1297991 0.1266459 0.1564616 0.1467482 0.1612035 0.1348608 0.1912188 0.1863368 0.1768881 0.1594199 0.1387011 0.1686025 0.1589384 0.1590534 0.1581039 0.1550931 0.1786796 0.1704796 0.1722144 PI 32:1|PI 18:0_14:1 0.05952376 0.05309787 0.05439574 0.05432329 0.05811394 0.03616286 0.03393157 0.03549898 0.1171201 0.1171231 0.1166927 0.04241919 0.05492368 0.04327663 0.0416826 0.04354176 0.04807188 0.04582415 0.04691398 0.04651866 0.04507681 0.04988177 0.06079768 0.06783232 0.05304073 0.05131558 0.05194893 0.03343004 0.03125509 0.032076 0.04224939 0.04409422 0.04753147 0.03859372 0.05305358 0.05558453 0.04949365 0.0438091 0.04037109 0.03546556 0.03373988 0.03370292 0.03972095 0.04161639 0.05804187 0.05324123 0.05374137 PI 40:2|PI 18:0_22:2 0.03340496 0.03509231 0.03695738 0.03749266 0.03778685 0.03358379 0.03427366 0.03718928 0.03516759 0.0425413 0.04790666 0.05030496 0.07317057 0.03956656 0.04081888 0.0440609 0.01965895 0.02125036 0.02455643 0.01474508 0.01652145 0.02008491 0.01936725 0.02318165 0.0303624 0.03399146 0.03571792 0.03236886 0.03673022 0.03916092 0.0440486 0.04926952 0.05167324 0.03790628 0.05451394 0.05820118 0.05576488 0.03953447 0.03673272 0.0343134 0.0382103 0.04119989 0.03933481 0.04739018 0.0508919 0.0518462 0.05166433 PI 38:5|PI 18:0_20:5 0.09655876 0.09448794 0.09765764 0.09662499 0.1075239 0.05935975 0.0567384 0.06398528 0.08541346 0.08332667 0.07948371 0.0623714 0.0639225 0.0540023 0.05387281 0.05491803 0.09996706 0.09525239 0.09687144 0.1122654 0.108707 0.1064984 0.1014304 0.09885675 0.1182112 0.1163925 0.119205 0.1253605 0.1149302 0.1181281 0.1288199 0.1207891 0.1202673 0.1118305 0.1552019 0.1446573 0.1491887 0.1015856 0.09737049 0.1122218 0.1080443 0.1130416 0.1033192 0.1032797 0.1244991 0.1226728 0.1246391 PI 39:2|PI 18:0_21:2 0.01447574 0.01391081 0.01334144 0.01266364 0.01417919 0.01069083 0.01056689 0.01031682 0.01113291 0.01109311 0.01074041 0.01393533 0.01600325 0.01178218 0.01123387 0.01075931 0.01203948 0.01104199 0.01069142 0.009578416 0.009413671 0.008798074 0.009910825 0.009283898 0.01511175 0.01324997 0.0128611 0.01736749 0.01607424 0.0156765 0.0187919 0.01851302 0.01813902 0.016219 0.02203144 0.02069402 0.02012724 0.01813372 0.01601484 0.01650353 0.01586944 0.01586453 0.01693083 0.01744079 0.02111459 0.01831367 0.01769514 PI 36:2|PI 18:0_18:2 0.199945 0.2046508 0.2042865 0.185578 0.1748165 0.1543504 0.1346794 0.1245129 0.1418737 0.1282605 0.1202294 0.2100674 0.2142704 0.174888 0.1473938 0.134122 0.1274541 0.1082379 0.1053716 0.1109594 0.09459594 0.0880553 0.1191631 0.1036681 0.1597123 0.1309273 0.1178471 0.2283305 0.1943283 0.1703424 0.2703499 0.2328758 0.221407 0.2360632 0.3133599 0.2715832 0.2263014 0.2091393 0.1697424 0.1925871 0.1547399 0.1342817 0.2237705 0.1973987 0.2551614 0.225108 0.2020983 PI 30:1|PI 16:0_14:1 0.01736543 0.0165977 0.01924596 0.01536059 0.01712016 0.004742207 0.004595352 0.004954059 0.02443542 0.02301323 0.02374879 0.004954709 0.00546793 0.005478885 0.005264632 0.005568611 0.01331427 0.01166025 0.01157917 0.01400718 0.01247054 0.01341519 0.01714389 0.01701789 0.01406588 0.01245759 0.01317864 0.008106166 0.007022948 0.006848044 0.01015607 0.009629685 0.00978058 0.008965525 0.01185264 0.01161106 0.01073915 0.01060958 0.008621061 0.009753603 0.008176985 0.008530976 0.00971792 0.009611947 0.01361054 0.01210184 0.01197833 PI 38:6|PI 16:0_22:6 0.07106708 0.07249306 0.08266739 0.06693426 0.0797072 0.02967152 0.02987061 0.03171993 0.07163179 0.08129397 0.08553375 0.03661468 0.04885881 0.03392101 0.03492036 0.03733853 0.0877119 0.08381106 0.088433 0.083451 0.08309878 0.09348607 0.09873671 0.1082689 0.09801678 0.09968573 0.1005014 0.06630871 0.06536919 0.06491517 0.08536363 0.08661492 0.0965076 0.07251304 0.1007732 0.1064119 0.099836 0.0766051 0.0748295 0.07054508 0.06782124 0.06819519 0.07466836 0.08112802 0.1058016 0.09974012 0.1000975 PI 32:1|PI 16:0_16:1 0.306752 0.3320104 0.3373156 0.3169579 0.391464 0.268495 0.2544199 0.2729799 0.6738958 0.6944275 0.7655852 0.3049491 0.3940955 0.3036429 0.3014806 0.3234112 0.266437 0.2533979 0.2702211 0.2620976 0.258776 0.2954132 0.3339562 0.3668331 0.2983217 0.2933286 0.3055553 0.2428392 0.2228422 0.2369663 0.2980868 0.3043694 0.3470573 0.2751304 0.3524097 0.3812343 0.3576466 0.2547826 0.2332431 0.2128726 0.2036581 0.2087348 0.2462596 0.2643107 0.3207335 0.3092049 0.3352104 PI 39:3|PI 18:0_21:3 0.05713923 0.05977819 0.05928127 0.04728492 0.0496559 0.0347667 0.03286245 0.03363367 0.04345075 0.03866757 0.03765469 0.04490627 0.04046071 0.04036416 0.03478127 0.0342987 0.052868 0.04376648 0.04383359 0.04826402 0.04516213 0.04071722 0.04838098 0.04149593 0.05810441 0.05483288 0.053075 0.06388035 0.05476515 0.05262889 0.06514227 0.05362473 0.05109275 0.05746311 0.07410054 0.06848371 0.06681879 0.06307848 0.05400927 0.06480881 0.0548634 0.05242121 0.06136144 0.05605654 0.06755492 0.0625086 0.05974748 PI 36:5|PI 16:1_20:4 0.02069171 0.02340785 0.02442631 0.01631394 0.0175163 0.007780518 0.006721331 0.006617516 0.01493353 0.01200362 0.01161808 0.008859809 0.009133555 0.008722771 0.007193753 0.007346557 0.01498596 0.01027746 0.0104132 0.01437486 0.01167393 0.01094996 0.01544306 0.01339083 0.0156493 0.01245006 0.01171693 0.01411511 0.01065492 0.009936053 0.01743905 0.0128207 0.01197478 0.01431282 0.01847305 0.01490122 0.01328418 0.01418633 0.009912991 0.01217198 0.00850058 0.008228969 0.01242937 0.01010661 0.01591776 0.01347624 0.01245659 PG 32:0|PG 16:0_16:0_A 0.004855454 0.004352395 0.005084522 0.005535911 0.004614541 0.000869249 0.0009971 0.001059033 0.003331721 0.004105215 0.004734027 0.001171303 0.001658442 0.001261186 0.00153558 0.001725751 0.005876613 0.007089885 0.00831439 0.005081574 0.006053834 0.007874138 0.005983019 0.008882323 0.006464999 0.007563197 0.008576629 0.007112979 0.008124017 0.008254503 0.00980956 0.01114998 0.0143603 0.008234722 0.01055476 0.01190907 0.01119013 0.006062183 0.006140634 0.004582484 0.005333023 0.005194845 0.006203524 0.007427675 0.008715422 0.009592333 0.01046008 PG 32:0|PG 16:0_16:0_B 0.00160354 0.001541891 0.001691641 0.001894446 0.001489428 0.001601929 0.001798348 0.001745018 0.001331737 0.001679072 0.001783685 0.002470492 0.00384132 0.002395132 0.002469081 0.002419105 0.001410275 0.001556949 0.001674303 0.00116946 0.001217598 0.001403006 0.003002194 0.003598667 0.001610511 0.001738198 0.001648335 0.001227008 0.001336263 0.001215569 0.001611146 0.001811832 0.002120526 0.001499642 0.001526343 0.001743484 0.001456791 0.001193039 0.001091046 0.00091177 0.000931112 0.000859328 0.001154812 0.001273275 0.001837643 0.001853544 0.001813879 PG 42:9|PG 20:3_22:6 0.001098746 0.001169464 0.001040517 0.001327817 0.001074945 0.000128606 0.000142425 0.000138751 0.000402223 0.000468921 0.000493031 0.000191023 0.000266369 0.000181614 0.000187243 0.000182226 0.000176622 0.000151264 0.000155592 0.000117766 9.50E-05 0.000120225 0.000507215 0.000624721 0.001894394 0.001943145 0.001813906 0.000851208 0.000778129 0.000718422 0.003744125 0.004342523 0.005219705 0.000650059 0.003660352 0.004219632 0.003146791 0.002904725 0.00257887 0.002077947 0.002124179 0.001944528 0.002795675 0.003215827 0.002732703 0.002653154 0.002366083 PG 44:12|PG 22:6_22:6 0.001123287 0.001094793 0.001369724 0.001377587 0.001137628 0.000411778 0.000410427 0.000423222 0.000980919 0.001202092 0.001324888 0.000585495 0.000909621 0.00056617 0.000582375 0.000560519 0.00019808 0.000237317 0.000247006 0.000166008 0.000191911 0.000208889 0.000543885 0.000735446 0.002467923 0.002747641 0.002526001 0.000434053 0.000441866 0.000396142 0.003296442 0.004263277 0.005172373 0.000298769 0.002828988 0.003528325 0.002625819 0.002626124 0.002589822 0.002155418 0.002252119 0.002091543 0.002400808 0.002912677 0.002094796 0.001921689 0.001764542 PG 38:4|PG 18:0_20:4 0.002962949 0.003000554 0.003260089 0.003533591 0.002561799 6.75E-05 0.000276586 0.000305385 0.001306175 0.00198448 0.002014331 0.000435974 0.000913649 0.000746247 0.000593866 0.001118457 0.005554774 0.00598297 0.006043288 0.00460711 0.004774782 0.005030643 0.005193116 0.006008951 0.005364718 0.005421349 0.004980227 0.00646352 0.006765387 0.006270165 0.008997107 0.009667855 0.01039884 0.008253994 0.008583347 0.008927296 0.007126238 0.005011874 0.004403903 0.003536212 0.003460733 0.003146901 0.005068253 0.00552858 0.005786187 0.005700322 0.005203858 PG 38:5|PG 18:1_20:4 0.000989109 0.000923624 0.001049434 0.001174635 0.000856476 0.000374314 0.000465951 0.00051698 0.000533225 0.000621273 0.000695545 0.000693298 0.001050068 0.000647925 0.000734088 0.0007448 0.000826929 0.000975408 0.001046538 0.000622354 0.000711814 0.000910848 0.001127554 0.001426976 0.001087079 0.001167775 0.001189281 0.00110424 0.0013205 0.001341469 0.001572318 0.001965984 0.002181187 0.001357089 0.001632341 0.001938309 0.001601561 0.001124605 0.001095309 0.000710312 0.000812776 0.000811915 0.000960449 0.001221241 0.001837242 0.001832148 0.001789083 PG 38:6|PG 16:0_22:6_A 0.001319169 0.001389556 0.001504919 0.001556184 0.001116533 0.001383405 0.001473832 0.001271767 0.004072815 0.004485654 0.004585295 0.002867287 0.004619964 0.002281373 0.002143503 0.001856017 0.000507923 0.000521114 0.00051385 0.000383078 0.000408583 0.000418618 0.00095591 0.00121867 0.002504839 0.002152623 0.001748749 0.000508142 0.000449906 0.000412549 0.003496131 0.003769526 0.004999042 0.000517492 0.002920137 0.003032604 0.002013373 0.00221732 0.001683566 0.001436366 0.00130975 0.001134673 0.001988006 0.002215071 0.001993365 0.00181309 0.00155547 PG 32:1|PG 14:0_18:1 0.000919449 0.000890105 0.000944992 0.001201682 0.000797575 0.001170715 0.001250856 0.001191091 0.001867737 0.002404668 0.003179141 0.003284925 0.007514769 0.002330255 0.002523309 0.002578832 6.08E-05 7.44E-05 8.77E-05 6.42E-05 6.07E-05 9.02E-05 0.000101019 0.000163999 0.000669518 0.000697877 0.000762507 0.000202402 0.000197725 0.00020033 0.001191966 0.001604063 0.002656499 0.000254091 0.001389522 0.001745953 0.001301873 0.00095029 0.000778727 0.000577588 0.000591604 0.00058053 0.000900384 0.001255785 0.001026012 0.00105118 0.001125193 PG 34:3|PG 16:1_18:2 0.001159438 0.001088752 0.001319781 0.001653119 0.001276876 0.000118279 0.000113888 0.000128807 0.000191634 0.000257258 0.000275265 0.00015746 0.000302218 0.000169136 0.000195235 0.000188817 0.001390044 0.001844097 0.002109267 0.00102249 0.001303076 0.001702654 0.000829237 0.001322272 0.001469049 0.001634579 0.001736236 0.002228566 0.002730408 0.002707803 0.003492923 0.005049552 0.007652007 0.003108226 0.003814343 0.004983029 0.003650784 0.001815806 0.001712562 0.001074706 0.001250424 0.001124131 0.001567447 0.002213076 0.002873654 0.002953496 0.002944086 PG 38:6|PG 16:0_22:6_B 0.000782369 0.000762054 0.000852074 0.001127157 0.000820783 0.000196479 0.000215429 0.000209437 0.000226373 0.000246063 0.000252615 0.000277369 0.000484428 0.000306371 0.000370157 0.000403995 0.005560891 0.006753949 0.007448124 0.004389482 0.005278712 0.006618477 0.005349574 0.007727134 0.001095842 0.001290405 0.00133657 0.001543044 0.001975814 0.00201518 0.000853317 0.001077988 0.001376531 0.002991735 0.000917258 0.001107352 0.000936598 0.000527777 0.000515236 0.000319493 0.00037949 0.000391856 0.000473033 0.000609864 0.001662577 0.001819129 0.001816347 PE 34:3|PE 16:1_18:2 0.01132263 0.01138298 0.01125052 0.01159756 0.01094078 0.01194188 0.01295104 0.01217807 0.01957193 0.0211305 0.02014953 0.01285846 0.01213949 0.0126612 0.01305385 0.01185181 0.01328528 0.01345547 0.01236107 0.01487086 0.01527878 0.01404923 0.01752651 0.01721054 0.01658798 0.0166747 0.0158994 0.01003497 0.01024694 0.009605267 0.01128977 0.01020193 0.008600997 0.01047177 0.01302253 0.01238756 0.01197905 0.01024539 0.01016696 0.01089862 0.0107422 0.01037008 0.01067236 0.01031067 0.01465796 0.01419208 0.01337559 PE 40:5|PE 18:0_22:5 0.006285687 0.0065269 0.006121822 0.006519283 0.006141324 0.004018351 0.004469673 0.004492894 0.007994731 0.009451988 0.01011172 0.005607767 0.007377136 0.004880993 0.005429677 0.00529787 0.008198765 0.008909288 0.009350209 0.008225233 0.009310178 0.009549919 0.01082841 0.01252552 0.01090623 0.0115117 0.01163685 0.005291814 0.005643916 0.005799301 0.00742734 0.008002641 0.009425004 0.006088105 0.008630682 0.009723728 0.008602761 0.008031807 0.007755689 0.006261859 0.006618307 0.006527568 0.006325108 0.007487452 0.009878221 0.009876716 0.009827751 PE 34:1|PE 16:0_18:1 0.2111576 0.2107167 0.2044985 0.2221829 0.2079818 0.1386659 0.151422 0.1532545 0.2163253 0.2369827 0.238305 0.1588505 0.1849865 0.1439345 0.156694 0.1544001 0.1773636 0.1894339 0.1915376 0.1727747 0.1939957 0.1869112 0.2047093 0.2312144 0.2227349 0.2372652 0.2396902 0.1625885 0.168227 0.1696905 0.1838164 0.1994057 0.2122642 0.1676455 0.2288798 0.2456209 0.2328403 0.1813176 0.1960484 0.1699398 0.1857703 0.1832035 0.1777762 0.1943315 0.2481521 0.2510191 0.2535839 PE 36:1|PE 18:0_18:1 0.3150359 0.3049963 0.2943136 0.3206432 0.3073106 0.18881 0.1976998 0.1928775 0.2741889 0.2953278 0.2942399 0.2173617 0.2452159 0.1857019 0.1989611 0.1921128 0.306238 0.3210309 0.3265081 0.2861885 0.3077888 0.3122895 0.3149028 0.3310914 0.3633545 0.3759168 0.379176 0.3534949 0.3543432 0.3568266 0.3811018 0.384919 0.3896912 0.3548999 0.432087 0.4347956 0.4302904 0.3456281 0.3351572 0.3369537 0.3434765 0.3403723 0.3504679 0.358589 0.4131542 0.4130405 0.4238359 PE 40:6|PE 18:1_22:5 0.009883871 0.009763491 0.0094286 0.01044517 0.009821145 0.005926995 0.005978646 0.006238002 0.01061004 0.01206548 0.01437716 0.007432839 0.01049721 0.007015937 0.007202809 0.007439619 0.008332415 0.009475385 0.009464681 0.008325237 0.009427126 0.009867955 0.01017079 0.01249037 0.01000571 0.01112026 0.01097802 0.006853244 0.007305226 0.007197049 0.008351997 0.009542474 0.01098212 0.007035551 0.01015478 0.01111133 0.00996314 0.008091964 0.008380209 0.007174438 0.007976369 0.007541288 0.007951209 0.00880432 0.01218475 0.0121863 0.01197054 PE 38:7|PE 16:1_22:6 0.002287937 0.002330266 0.002384992 0.002528831 0.002394074 0.00193665 0.001985332 0.001963969 0.004118709 0.004591089 0.004733099 0.002440496 0.003039337 0.002360897 0.002585438 0.002526332 0.002772391 0.002976791 0.003003228 0.002820731 0.002927075 0.003099316 0.00365462 0.00456473 0.003701737 0.004002284 0.004078619 0.001890653 0.001883231 0.001847844 0.00259364 0.002659142 0.002418675 0.002066606 0.002995722 0.003485103 0.003132659 0.002669444 0.002721399 0.002331764 0.002426229 0.00236129 0.002458125 0.002723989 0.004103567 0.004118961 0.004106422 PE 40:6|PE 18:0_22:6 0.03048952 0.0314933 0.02852739 0.03030564 0.02908703 0.02108997 0.02152028 0.02154016 0.03639429 0.04022959 0.04148329 0.02107118 0.02545259 0.02103576 0.02231453 0.02195647 0.03276533 0.03388105 0.03486444 0.03286227 0.03627068 0.03625674 0.04374417 0.04927895 0.04938073 0.05153744 0.05203933 0.02030087 0.02088866 0.02047119 0.02474188 0.02545021 0.02952116 0.02103011 0.03279072 0.03624058 0.0332891 0.02851302 0.0288775 0.02468196 0.02475085 0.02453777 0.02423648 0.02542756 0.04167123 0.04137482 0.04176101 PE 38:3|PE 18:0_20:3_A 0.01945772 0.01914566 0.01981624 0.02120238 0.01942209 0.01187388 0.01325468 0.0131714 0.02350713 0.02776298 0.02962878 0.01654167 0.02047001 0.01388778 0.0151779 0.01555551 0.02587829 0.02811823 0.02982527 0.02694871 0.03100143 0.03335319 0.03352517 0.03786368 0.03102495 0.0349567 0.0353189 0.0170784 0.01804077 0.01769387 0.01990195 0.02123344 0.0225868 0.01853894 0.02285987 0.02472443 0.02384931 0.02152112 0.02069099 0.01924342 0.01969786 0.01928626 0.01884097 0.02035175 0.02613788 0.02623885 0.02670371 PE 36:3|PE 16:0_20:3 0.004464455 0.004286545 0.00451182 0.004373795 0.004047744 0.003401274 0.00353365 0.003618522 0.006596861 0.006710442 0.006581762 0.004654028 0.005008627 0.004468314 0.004319701 0.004272143 0.004584152 0.004050822 0.00431436 0.004567506 0.00452879 0.004814 0.005884278 0.006219864 0.004967873 0.004845386 0.004872454 0.002293268 0.002051346 0.002073872 0.003094727 0.002791498 0.002849566 0.00275709 0.00310122 0.003157501 0.003115305 0.002927437 0.002595591 0.002617851 0.002359468 0.002374669 0.002611211 0.002684528 0.003560178 0.003400064 0.003418057 PE 33:1|PE 16:0_17:1 0.004973231 0.004820137 0.005156381 0.0053788 0.005270841 0.004048414 0.004246367 0.004581463 0.007463498 0.008529847 0.008915379 0.004728054 0.006280447 0.004422614 0.004986387 0.004897417 0.004950711 0.005725186 0.00581011 0.005552345 0.006625929 0.006773996 0.006495429 0.007831374 0.005551144 0.006145386 0.006261538 0.003054276 0.003243062 0.00328506 0.003532301 0.00390456 0.004056732 0.003184304 0.003938625 0.004307801 0.00423272 0.003638391 0.003817732 0.003299194 0.003596143 0.003744287 0.003434668 0.003777965 0.004744146 0.004668947 0.004644483 PE 40:2|PE 18:1_22:1 0.004242139 0.004039639 0.004165723 0.004508482 0.003938914 0.001957345 0.00202056 0.001918387 0.003011103 0.003316629 0.003462407 0.00242929 0.003136025 0.001971505 0.002101385 0.002008665 0.003203907 0.003164429 0.003519778 0.002535156 0.002724791 0.002870292 0.003261536 0.003217989 0.00459177 0.00480382 0.005003832 0.004075799 0.004176334 0.00409679 0.005644362 0.006204102 0.007294527 0.004977241 0.007000594 0.007857565 0.006794926 0.005194128 0.00393092 0.004075341 0.004224786 0.004210667 0.004649558 0.005141329 0.005882819 0.005939627 0.006075632 PE 32:2|PE 16:1_16:1 0.01711602 0.01678555 0.01564457 0.01799751 0.01616108 0.01772798 0.0184075 0.01895337 0.03333959 0.03902312 0.0418069 0.02025645 0.02894485 0.01973435 0.02216072 0.02275494 0.01693079 0.01851713 0.01899147 0.01651425 0.0182436 0.02036582 0.02343233 0.03042501 0.02077564 0.02274324 0.02328126 0.01087828 0.01119392 0.01147851 0.01484332 0.01699277 0.01780352 0.01375049 0.0182397 0.02104954 0.01965667 0.01663348 0.01690523 0.01363611 0.01407289 0.0139695 0.0153123 0.01742491 0.02313012 0.02348251 0.02462998 PE 37:2|PE 18:1_19:1 0.005102953 0.004971329 0.004563795 0.005244074 0.004786508 0.003195979 0.003437047 0.003405448 0.005307519 0.006189267 0.006383325 0.004069197 0.004800132 0.00353227 0.003792212 0.003842673 0.004526266 0.004861929 0.005024304 0.00418393 0.004820185 0.0048385 0.005013891 0.005907842 0.005700546 0.006028745 0.006056811 0.003979276 0.004060003 0.003903077 0.004307432 0.004469874 0.00455726 0.003773999 0.004767299 0.005177093 0.00507524 0.004794489 0.004765372 0.004473679 0.004797413 0.004749543 0.00439286 0.004743991 0.005819207 0.005902551 0.005745925 PE 44:5|PE 24:1_20:4 0.002833225 0.003016056 0.003185052 0.003159705 0.002836788 0.00030584 0.001364298 0.001341393 0.002193711 0.002477038 0.002675408 0.001829982 0.002467148 0.001452582 0.001536285 0.00153341 0.0034637 0.003715413 0.004084028 0.002844373 0.003001139 0.003408524 0.003594917 0.004210969 0.004676632 0.004874984 0.005019791 0.00383857 0.004052301 0.003990201 0.005926677 0.006647006 0.008920363 0.005295644 0.006752604 0.007730493 0.006545496 0.005325263 0.004603273 8.33E-05 0.003749111 0.003618365 0.004713668 0.005189136 0.006672785 0.006699306 0.006942291 PE 38:1|PE 18:0_20:1 0.007735114 0.007491804 0.007820521 0.008404903 0.007239304 0.001632571 0.001682421 0.001644723 0.0024285 0.002742875 0.002950435 0.002404261 0.00345082 0.001739125 0.001798344 0.001786401 0.006256469 0.006700846 0.007085246 0.004666567 0.005358543 0.005720173 0.004503209 0.004665213 0.00867633 0.009445528 0.009440429 0.01459859 0.01572915 0.01551812 0.01955616 0.02004609 0.02317871 0.01623654 0.0204749 0.02173238 0.01984339 0.01316317 0.00954959 0.01059359 0.01085719 0.01043761 0.01297576 0.01459676 0.01683543 0.01633838 0.01671237 PE 40:4|PE 18:0_22:4 0.01448732 0.01372541 0.01482944 0.01601745 0.01402999 0.009657165 0.01036421 0.01005736 0.02011812 0.02246206 0.0238096 0.01375575 0.01907201 0.01161685 0.01227201 0.01247901 0.01924837 0.02132148 0.02196673 0.0185428 0.02063036 0.02233268 0.02284149 0.02605214 0.02276154 0.02494849 0.02478768 0.01529233 0.0160853 0.01596418 0.02050825 0.02235631 0.02595756 0.0181164 0.02249984 0.02559808 0.02367887 0.01929799 0.01815916 0.0149392 0.01595146 0.01544306 0.01643627 0.01924512 0.02295974 0.02354567 0.02436949 PE 36:5|PE 16:1_20:4 0.01243217 0.01266296 0.0127487 0.01442789 0.01290561 0.009431469 0.009782283 0.009828618 0.01888933 0.02123746 0.02128028 0.01182986 0.01581687 0.01098073 0.01193903 0.011988 0.0155995 0.01693741 0.01797629 0.01475863 0.01660071 0.01821242 0.02013917 0.02491975 0.01905042 0.02032281 0.02122712 0.009970724 0.01091474 0.01099049 0.01467566 0.01689925 0.0180303 0.01204821 0.01675865 0.01920375 0.01699808 0.01332083 0.01314593 0.01095232 0.01114038 0.01076792 0.01175507 0.01373643 0.01941875 0.01983092 0.01970608 PE 38:3|PE 18:0_20:3_B 0.006349173 0.006060156 0.006323505 0.007090515 0.006216259 0.004509764 0.004512341 0.00471349 0.007833963 0.009256445 0.01015947 0.00685162 0.01019491 0.005178892 0.00578247 0.005626158 0.00915565 0.01005823 0.0106882 0.0086674 0.009578786 0.0106738 0.01222158 0.01426883 0.01063217 0.01199161 0.01208449 0.005150456 0.005509802 0.005890566 0.00777317 0.009011222 0.01034741 0.006387054 0.008373094 0.009887553 0.008864054 0.008043266 0.00726952 0.006017105 0.006177895 0.006128478 0.006297879 0.007701024 0.009587035 0.009906122 0.009993702 PE 36:3|PE 18:1_18:2 0.01242251 0.01240695 0.01267705 0.01440229 0.01286269 0.007171404 0.007987762 0.008115765 0.01402429 0.01620952 0.01667302 0.010055 0.013254 0.008810089 0.009674337 0.009808224 0.01143901 0.01310508 0.01350398 0.01222993 0.01391098 0.0146653 0.01506011 0.01842985 0.013839 0.01534691 0.01554486 0.008076836 0.008380135 0.008582418 0.01045706 0.0114897 0.01190969 0.009483206 0.01171873 0.01273259 0.01192966 0.01042542 0.01021384 0.008438743 0.009031114 0.008970988 0.009415246 0.01077661 0.01353211 0.01379467 0.01359511 PE 38:4|PE 16:0_22:4 0.01064093 0.0110688 0.01152125 0.01237178 0.01058676 0.007507379 0.008177028 0.008322136 0.01718022 0.01915796 0.02015923 0.01018861 0.01264285 0.00970534 0.01021676 0.01058028 0.01273314 0.01262803 0.01343976 0.01302505 0.01317509 0.01497408 0.01532422 0.0170637 0.01462491 0.01451068 0.01516835 0.008326367 0.008013895 0.008449254 0.01128081 0.01140567 0.0122388 0.009338431 0.01188112 0.01239479 0.01130524 0.009874606 0.009303143 0.008654907 0.008320429 0.008283827 0.009010614 0.009487254 0.0126336 0.0130957 0.01339799 PE 40:4|PE 20:0_20:4 0.005634932 0.005067463 0.005640916 0.005828095 0.006089076 0.003591851 0.003801431 0.003671285 0.006083351 0.007319681 0.007925346 0.005806441 0.008916639 0.00438313 0.004516691 0.004581531 0.006275969 0.006863684 0.007349265 0.006186164 0.006430851 0.007228516 0.007505174 0.008334863 0.007419602 0.007787459 0.007970588 0.004635395 0.004872501 0.004880447 0.007121576 0.008593089 0.01070707 0.005830484 0.007560032 0.008902957 0.007306765 0.006568438 0.005036626 0.004464529 0.004481779 0.004278529 0.005132724 0.005911577 0.007751213 0.007911716 0.008110002 PE 36:2|PE 18:1_18:1 0.05369971 0.05138427 0.05452873 0.06134649 0.0549202 0.03654665 0.04104668 0.04207474 0.06179647 0.07034931 0.07273836 0.05564605 0.07119799 0.04525131 0.04915647 0.048205 0.06041617 0.06892497 0.07093009 0.05855773 0.06748196 0.07357015 0.06985755 0.0817541 0.0728099 0.07969324 0.07929428 0.05087818 0.05665784 0.05750237 0.06733943 0.07572538 0.08260439 0.06235726 0.07699199 0.08196923 0.07642981 0.05696933 0.05550929 0.0453479 0.05099868 0.04956238 0.05395818 0.0603763 0.07503255 0.07690872 0.07836916 PE 35:1|PE 17:0_18:1 0.002428773 0.002155482 0.00235417 0.002627704 0.002361796 0.00154746 0.001691261 0.001730556 0.002670477 0.003179675 0.0032281 0.002153074 0.0028253 0.001852608 0.001996507 0.001979051 0.001996491 0.002327788 0.002423773 0.001876 0.002132577 0.00237727 0.002250702 0.002777364 0.002364126 0.002629268 0.002644978 0.001578247 0.001673141 0.001736668 0.002084154 0.002272182 0.002613273 0.001889207 0.002264547 0.002631688 0.002426976 0.001918764 0.001933982 0.001566337 0.001737189 0.001645686 0.001734875 0.002008528 0.002454722 0.002569568 0.002548444 PE 35:2|PE 16:1_19:1 0.002919834 0.002859895 0.003112672 0.003486632 0.00322485 0.000717344 0.000787009 0.000813354 0.000674611 0.00077761 0.00090891 0.000870614 0.001182389 0.000801104 0.000878893 0.000874227 0.003873182 0.004520533 0.005027329 0.001989958 0.002413805 0.002629376 0.003387176 0.004556283 0.002876397 0.003114542 0.003162109 0.004472792 0.004984387 0.005075908 0.003474461 0.004229468 0.005077621 0.005864051 0.004263352 0.004894986 0.004649267 0.002978537 0.003262816 0.002039225 0.002287243 0.002354346 0.002559631 0.002774339 0.004343039 0.004580232 0.004669977 PE 38:6|PE 18:1_20:5 0.01382953 0.01447568 0.01467354 0.01699751 0.01467287 0.007767884 0.008198706 0.008120134 0.01381445 0.01503469 0.01619199 0.009091774 0.0100375 0.009357141 0.009736956 0.009293634 0.01332351 0.01454988 0.01484672 0.01342901 0.01496889 0.01557084 0.01593386 0.01973373 0.01807405 0.01841877 0.01840805 0.008609868 0.009263794 0.00890249 0.01224084 0.01312164 0.01332011 0.00868442 0.01430171 0.01527421 0.01334729 0.0112253 0.01136944 0.004280765 0.01174249 0.01140133 0.01180342 0.01255683 0.01952334 0.01917817 0.018431 PE 32:1|PE 16:0_16:1 0.02905914 0.03016503 0.02993215 0.03468389 0.03479233 0.03723527 0.04409308 0.04804517 0.06222394 0.07701861 0.08700753 0.03938329 0.05533757 0.04023037 0.04870567 0.05321677 0.02738156 0.03393187 0.04016885 0.01705483 0.03909501 0.04534024 0.04066247 0.05284753 0.03428184 0.04428388 0.0505506 0.01732503 0.02158634 0.02438597 0.02001053 0.02584923 0.02745838 0.02044838 0.02615273 0.03273501 0.03579524 0.01938978 0.0243243 0.01380866 0.02543739 0.02877216 0.02150979 0.02841332 0.03363732 0.03903463 0.04476 PE 39:4|PE 19:0_20:4 0.002052614 0.001958929 0.002284111 0.002447713 0.002097957 0.001169501 0.001355345 0.001247706 0.002320132 0.002789016 0.003136982 0.001691524 0.002550017 0.001495 0.001580087 0.001547941 0.002775095 0.003140954 0.003368715 0.002633193 0.003086817 0.00331732 0.003357578 0.004211662 0.003224987 0.003368496 0.003499963 0.001556247 0.001628494 0.001669022 0.002284861 0.002640821 0.002738129 0.002015616 0.002394231 0.002749367 0.002405158 0.002056338 0.00180632 0.00151816 0.001631785 0.001459918 0.0017216 0.001976284 0.002889817 0.002839812 0.002932979 PE 30:1|PE 14:0_16:1 0.003190998 0.003122973 0.00347713 0.003878029 0.003172669 0.001954323 0.002020262 0.00211313 0.004581632 0.005879413 0.00710346 0.002388131 0.003705547 0.002269651 0.002729423 0.002802197 0.003575416 0.004020147 0.004586115 0.00327633 0.003765731 0.004427851 0.005257461 0.007213816 0.004146937 0.004521409 0.004916669 0.002294354 0.002339363 0.002411557 0.003224134 0.003794804 0.004767643 0.002778254 0.003613457 0.004295759 0.00394391 0.003166657 0.003191164 0.002686073 0.002790121 0.002678677 0.003010973 0.003502186 0.004731898 0.004938187 0.005342114 PE 38:6|PE 16:0_22:6 0.00750254 0.007723323 0.007744082 0.009746635 0.009581028 0.006304971 0.007978567 0.008552177 0.01171876 0.01535344 0.01681628 0.007229445 0.01043838 0.007209497 0.008952616 0.009454438 0.009250868 0.01227278 0.01405602 0.01048156 0.01438051 0.015959 0.01311995 0.01822281 0.01250427 0.01660321 0.01806582 0.005270389 0.007086114 0.007956062 0.006850671 0.009304466 0.009531988 0.006122506 0.009260174 0.01150002 0.01192761 0.006766846 0.009123705 0.006516627 0.00915116 0.01015499 0.007241837 0.01015173 0.01258099 0.01416937 0.01535623 PE 44:4|PE 24:0_20:4 0.002398832 0.003133468 0.003597837 0.003549422 0.002939709 0.002115409 0.002239841 0.002224862 0.003610338 0.003965913 0.004135203 0.002982759 0.004005251 0.00230369 0.002439622 0.002362682 0.004539093 0.00463657 0.004624346 0.000322153 0.004383146 0.004481559 0.005920167 0.004675084 0.005024338 0.005380513 0.005255441 0.003480219 0.003507768 0.003451335 0.004749291 0.005008803 0.005756276 0.000966634 0.005101866 0.00513376 0.00448016 0.004115239 0.002389225 0.000187698 0.003884644 0.00370142 0.003873731 0.004227292 0.004671523 0.00471805 0.004579381 PC 32:1|PC 16:0_16:1 0.4507988 0.4629967 0.4645005 0.4567 0.487735 0.4605325 0.4624012 0.4422184 0.4969136 0.4585687 0.4419447 0.4592252 0.3930454 0.447344 0.4212462 0.4068851 0.4135057 0.4174289 0.4125226 0.4346966 0.4224637 0.4213971 0.4298203 0.4032591 0.3796965 0.3752882 0.3730202 0.3338425 0.3375388 0.3358046 0.2933803 0.2892604 0.2803187 0.3473279 0.3230174 0.3218051 0.3375554 0.288316 0.2912308 0.319546 0.3124057 0.3238243 0.2930606 0.3022401 0.3827269 0.3743441 0.3831835 PC 28:0|PC 14:0_14:0 0.07470331 0.07253426 0.07887085 0.08012233 0.08569035 0.06095764 0.06516398 0.06770968 0.1122853 0.1249257 0.1392869 0.07680754 0.09597052 0.07270945 0.07734387 0.08265496 0.0851968 0.08976933 0.09350253 0.08202241 0.08208084 0.09592639 0.1015445 0.1155403 0.09130507 0.09880359 0.1059593 0.05346116 0.05879191 0.06405381 0.07375299 0.0834703 0.09483095 0.06535988 0.07592896 0.09234768 0.08888864 0.06612983 0.07256161 0.06406283 0.0679818 0.06818424 0.06637368 0.08068582 0.09997049 0.09851172 0.1067629 LPS 18:0 0.1006176 0.119743 0.1458169 0.1234527 0.1414049 0.06133154 0.07133284 0.07796209 0.07101286 0.07517698 0.08890886 0.1103632 0.1610266 0.08725355 0.09075867 0.09612692 1.067698 1.50521 1.698669 0.941934 1.251352 1.596683 0.2676401 0.3365033 0.1274671 0.130621 0.1357387 0.2255816 0.2773561 0.306386 0.127991 0.1502735 0.1953787 0.3930564 0.163637 0.1721633 0.1605888 0.1341062 0.1289011 0.09156255 0.0882852 0.08837014 0.1107311 0.1234522 0.1617274 0.1854112 0.1890762 LPI 18:0 1.00506 1.097848 1.406818 1.153331 1.443266 1.083332 1.406003 1.464352 1.691394 2.020997 2.414916 2.431247 3.22674 2.692527 2.758337 2.736665 5.832891 8.378397 8.741688 5.136022 6.668262 8.075252 1.795015 2.147329 1.49295 1.538807 1.54124 1.696838 2.150769 2.32812 1.158921 1.397283 1.752016 2.925749 1.422967 1.460576 1.407153 2.16768 2.190032 0.2981887 0.3380519 0.3675061 0.3722615 0.4524564 1.494563 1.674351 1.781827 LPE 22:6_A 0.02290116 0.02212123 0.02431033 0.02349096 0.02446236 0.01740603 0.01819739 0.01788277 0.02055086 0.01874992 0.02031058 0.02526972 0.02907264 0.02470216 0.02444911 0.02397048 0.04349093 0.03844772 0.03781492 0.04521596 0.03970844 0.03713972 0.04613832 0.04734376 0.0266839 0.02734038 0.02784749 0.02155068 0.02195661 0.02266825 0.02472886 0.01680538 0.01679552 0.02707186 0.02238871 0.02376361 0.01980089 0.02154396 0.020576 0.01677434 0.01519208 0.01510174 0.01733606 0.01812107 0.02843778 0.02843106 0.02712966 LPE 18:2 0.009124358 0.008977405 0.01058278 0.009760962 0.01000141 0.006891683 0.007812962 0.008110523 0.006534262 0.00747582 0.008010979 0.01065035 0.01231495 0.01037782 0.01044735 0.01134425 0.04599607 0.05165377 0.05236545 0.03899107 0.04360459 0.04452785 0.03146261 0.03413641 0.01167817 0.01222267 0.01333729 0.01359368 0.01563332 0.01664677 0.00559604 0.006621993 0.007655813 0.01802026 0.008701364 0.01054192 0.009888094 0.007485179 0.008120802 0.005289839 0.005831094 0.006013971 0.006323535 0.007061995 0.01261622 0.0131217 0.0135115 LPE 15:0 0.02425724 0.02591961 0.02976282 0.02872817 0.02840263 0.01550799 0.01735469 0.0172319 0.01261173 0.01234319 0.013451 0.01782928 0.02260154 0.01893603 0.01891208 0.01997669 0.1477505 0.1433793 0.1446094 0.1488833 0.1385717 0.1382234 0.08960177 0.09458805 0.02981344 0.0321921 0.03324029 0.06151735 0.06622154 0.07078987 0.02783579 0.02253478 0.0233891 0.07773548 0.02259358 0.02569206 0.02266878 0.01903486 0.01984215 0.01660822 0.01648446 0.01750267 0.01754282 0.01876444 0.03455188 0.03766551 0.03855976 LPE 20:4 0.06911775 0.07224685 0.07810032 0.08709616 0.08232315 0.0410159 0.04820453 0.05161332 0.03998364 0.04961061 0.05951551 0.06140673 0.08223515 0.0621896 0.06845841 0.07700937 0.2569236 0.2946972 0.3044232 0.2261525 0.2669791 0.2898443 0.194557 0.2250517 0.08752927 0.1000555 0.1076232 0.09041236 0.1062922 0.1162427 0.0460366 0.05970718 0.08907165 0.1180741 0.07364502 0.08786717 0.08742619 0.06199984 0.06944805 0.04732407 0.05387869 0.05937004 0.05611746 0.06298102 0.09682494 0.1071858 0.1170749 LPE 16:0_A 0.05444334 0.05244916 0.06113788 0.06736276 0.05678741 0.03006596 0.03413203 0.03506736 0.04240461 0.05111092 0.05884574 0.04770748 0.06354177 0.04730802 0.05318754 0.05632706 0.2618883 0.3221818 0.3294455 0.236129 0.2699524 0.292597 0.155013 0.1911667 0.06163383 0.0704544 0.07741429 0.06990777 0.08829214 0.09772792 0.03586596 0.04419626 0.05194161 0.0866868 0.05434659 0.06444214 0.05950469 0.04245424 0.0435489 0.02995519 0.03226155 0.03237959 0.03497466 0.04263866 0.07576421 0.08385549 0.08883493 LPE 16:1 0.04596695 0.05078371 0.06086697 0.05689299 0.05783027 0.02872037 0.03260798 0.03564394 0.02809338 0.03390389 0.03946126 0.04157275 0.04908377 0.03976656 0.04406531 0.04649868 0.1642793 0.1823454 0.194348 0.1194659 0.1363762 0.1447882 0.1144433 0.1296208 0.0440708 0.05132493 0.05459379 0.05368956 0.0626613 0.06765754 0.02298239 0.02645854 0.02925796 0.07970584 0.0374689 0.04464277 0.04235617 0.03189297 0.0358901 0.02259604 0.02401187 0.02618172 0.03053659 0.03495277 0.05360589 0.05772629 0.05999324 LPE 22:4 0.009895252 0.01085602 0.01313789 0.01019715 0.01111531 0.005103239 0.005766088 0.005975094 0.005150536 0.006159924 0.006733404 0.007718462 0.01025143 0.006911088 0.007697751 0.008395353 0.02667225 0.03211571 0.03467727 0.0208169 0.0248319 0.02704594 0.02010869 0.0249407 0.009069572 0.01035254 0.0105835 0.009405079 0.0110988 0.01148248 0.005930326 0.007374468 0.008535711 0.01230409 0.008386704 0.01005658 0.008778906 0.007442525 0.007663931 0.005355729 0.006057629 0.005859303 0.006735569 0.007831122 0.0105269 0.01133825 0.01112057 LPE 16:0_B 0.007696035 0.009196899 0.01119303 0.01152096 0.009347176 0.003878765 0.004091063 0.004632197 0.005684335 0.006488071 0.00767212 0.005553614 0.007438596 0.004865014 0.005595891 0.005822293 0.03813007 0.04933315 0.05067999 0.03321661 0.03992981 0.04301618 0.02167737 0.02714526 0.008224862 0.009659314 0.01082622 0.01054193 0.01226673 0.01391331 0.006113566 0.007642929 0.008974822 0.01417339 0.007882327 0.009916244 0.009333189 0.00581528 0.006517739 0.005389972 0.006458988 0.007081362 0.006361921 0.008801353 0.009885198 0.01081704 0.01156783 LPE 22:6_B 0.006268098 0.006513807 0.008901338 0.007862572 0.009017231 0.004794144 0.005381127 0.005091859 0.01015733 0.01156674 0.01170156 0.008011496 0.010013 0.00691559 0.007258424 0.00730376 0.01301949 0.01536153 0.01547467 0.009672931 0.01048969 0.01113688 0.01231661 0.01349145 0.006507434 0.006953842 0.007477929 0.00469995 0.0059204 0.006209787 0.006190466 0.007046056 0.007149557 0.006289377 0.00601322 0.006813488 0.006146727 0.00757627 0.007865609 0.005138416 0.005353258 0.005178109 0.005246981 0.006008151 0.006909048 0.007129952 0.007044983 LPA 28:2 0.1385228 0.1539347 0.1570284 0.1295194 0.1605223 0.1398801 0.149455 0.1470596 0.1429589 0.145565 0.1602885 0.1618133 0.1907711 0.1612843 0.1721923 0.1663972 0.1549315 0.1631831 0.1750383 0.1496937 0.1568605 0.1661154 0.1641362 0.1821759 0.1562151 0.1696499 0.1732781 0.1563814 0.1599551 0.1669155 0.1537375 0.1765679 0.1908 0.1637483 0.1574461 0.1762974 0.1663197 0.1682851 0.1580477 0.1353753 0.1481472 0.1489541 0.1529946 0.1715492 0.1669212 0.1797548 0.1780386 HexCer 42:1;3O|HexCer 16:1;2O/26:0;O 0.001498867 0.001508498 0.001505423 0.001518737 0.001560339 0.00052557 0.000531185 0.00051507 0.000987823 0.001121053 0.001253912 0.000823261 0.001098927 0.000632873 0.000637389 0.000671977 0.001594999 0.001686958 0.001807853 0.001311075 0.001380294 0.00159382 0.00144089 0.001646163 0.001955847 0.001937006 0.001941179 0.002401142 0.002501213 0.002417302 0.002760353 0.002902233 0.003141187 0.002379836 0.003085202 0.003113566 0.003059353 0.002936866 0.002999416 0.002468857 0.002424633 0.002444403 0.002673938 0.00271161 0.003209001 0.003185756 0.003277594 HexCer 42:0;3O|HexCer 16:0;2O/26:0;O 0.002995035 0.003159315 0.002901192 0.00277853 0.003100657 0.000911245 0.000925053 0.000908589 0.001705178 0.001769627 0.002156352 0.001392622 0.001934046 0.001044559 0.001085014 0.001147915 0.003436166 0.00371826 0.004054079 0.002679959 0.002927637 0.003372183 0.003182522 0.003463492 0.003728659 0.003816101 0.004077579 0.004592034 0.004919859 0.004774231 0.006794324 0.007980904 0.01009859 0.005582471 0.007053464 0.008195052 0.006922232 0.007114939 0.006061419 0.004627185 0.004583481 0.004630316 0.005334311 0.006242193 0.006714798 0.006859357 0.007191618 HexCer 42:0;2O|HexCer 21:0;2O/21:0;O 0.004539925 0.004905714 0.004395365 0.004722213 0.00404429 0.000397797 0.000437188 0.0004161 0.000763387 0.000839197 0.000877447 0.000693116 0.001007526 0.000436603 0.000480738 0.000483759 0.00410709 0.00452021 0.004749922 0.003277889 0.003425258 0.003852413 0.002432356 0.002661107 0.004863874 0.004928427 0.005196501 0.009717222 0.0106322 0.01081642 0.01558186 0.01778982 0.02162839 0.01165492 0.01474229 0.01802483 0.01598902 0.012563 0.01033008 0.008354954 0.008581274 0.008841722 0.01122642 0.01301368 0.01298363 0.01360941 0.01389815 HexCer 52:7;4O 0.001426701 0.001523554 0.00144346 0.001533584 0.001327797 0.000400016 0.000413604 0.00039368 0.000575982 0.00062425 0.000610209 0.000530112 0.000697208 0.00040952 0.000416824 0.000440787 0.001791298 0.001917497 0.001943781 0.001537435 0.0016234 0.001878905 0.001571328 0.001800457 0.002037401 0.00218724 0.00213385 0.002652983 0.00281229 0.002730269 0.003331963 0.003879201 0.004602557 0.003161652 0.003301764 0.003889144 0.003303422 0.002771891 0.002605416 0.001941525 0.001934968 0.001925374 0.002335278 0.002601587 0.002884215 0.002996401 0.00295444 HexCer 52:6;4O 0.00244401 0.002808939 0.002446073 0.002713592 0.002520689 0.000762275 0.000758671 0.000697725 0.000954019 0.001057846 0.001124339 0.001004775 0.001315228 0.000732127 0.000810253 0.000744375 0.003344684 0.003538041 0.003594196 0.002977164 0.003140581 0.003525906 0.003435194 0.003707765 0.003726697 0.00394625 0.003940898 0.004057168 0.003909453 0.004118699 0.005339646 0.006079378 0.007226622 0.005099331 0.005299506 0.005995616 0.005235703 0.005009246 0.004543711 0.000594088 0.00336376 0.003543085 0.003961502 0.004412119 0.004509898 0.00490025 0.004745652 FA 44:5 1.65737 1.685605 1.713355 1.755069 1.805881 2.340545 2.287872 2.394154 3.106862 3.196525 3.442434 2.9772 3.659913 2.026691 2.07752 2.261173 2.245002 2.603438 2.692177 2.406427 2.58447 3.11532 2.127725 0.3023807 0.06734683 0.07240032 0.08132839 2.17807 2.212466 2.476263 3.359679 3.414971 1.084884 2.45181 0.4301352 0.4508592 0.4251396 2.373374 0.2363992 2.548142 2.4543 2.486057 2.078532 2.153852 0.1108771 0.1205256 0.1304816 FA 24:0 4.368588 5.125039 6.348766 5.081749 5.685168 1.079119 1.103032 1.101631 1.773525 1.269799 1.352214 2.106271 1.36375 1.618324 1.08313 1.160574 6.359346 5.013127 4.623439 5.470971 3.847213 4.106568 6.220701 3.486628 6.965061 4.704221 5.114142 7.992236 6.596917 6.593036 9.336982 5.954504 5.883654 11.16121 11.18262 7.419092 8.287715 7.022418 4.462094 4.893852 3.496741 3.566762 6.728614 4.080532 5.505601 5.159239 5.887036 FA 17:1 0.4441444 0.4744247 0.5617795 0.5523891 0.6434427 0.4143549 0.4831276 0.4972462 0.4713707 0.537774 0.6373069 0.7170848 0.9733062 0.72 0.7437572 0.7842335 0.6873413 0.7051076 0.7806251 0.4916718 0.5121855 0.6281217 0.8071265 0.987201 0.6457414 0.6530493 0.6742888 0.3936712 0.4080261 0.4381212 0.5678122 0.6406578 0.8248502 0.5377511 0.8460253 0.8784322 0.831257 0.4582818 0.4308134 0.263109 0.2650029 0.2610388 0.3697287 0.3816443 0.6106614 0.6537139 0.692706 FA 40:6 0.1352544 0.1525472 0.1791382 0.1712714 0.2010932 0.07923733 0.09405378 0.09130248 0.09202197 0.0995317 0.1028012 0.1046175 0.09762134 0.1017793 0.09232573 0.09738307 0.1283744 0.1567664 0.1568234 0.131553 0.1466456 0.1463545 0.118062 0.1162547 0.1520738 0.145029 0.1377437 0.1960817 0.2213337 0.2177577 0.1941728 0.2031776 0.1863588 0.2509305 0.2141656 0.1841971 0.1738329 0.1057613 0.1141412 0.1256815 0.1135022 0.1155223 0.1396132 0.1331262 0.1354475 0.1314512 0.1263729 FA 20:5 0.1036252 0.1158841 0.1419238 0.1341078 0.1556149 0.01906446 0.01781868 0.01656513 0.0156136 0.01509298 0.01581012 0.03491804 0.03482499 0.009696312 0.009651036 0.0115662 0.03281577 0.04496804 0.04331529 0.09200535 0.1178674 0.1347798 0.02506333 0.02110608 0.04422871 0.04978455 0.05057456 0.0197497 0.02233444 0.02645579 0.01701456 0.01503756 0.01707706 1.414874 0.06827156 0.0731984 0.07387879 0.05657063 0.06920148 0.01976261 0.02017577 0.02213177 0.02035088 0.01638796 0.0194213 0.02094325 0.02001656 FA 17:0 1.247401 1.606049 1.893574 1.854512 1.822106 0.6997615 0.865842 1.106945 0.903615 1.082917 1.842395 1.181006 2.000836 0.9530601 1.101722 1.820014 1.477351 1.844143 2.625455 1.282856 1.480645 2.522942 1.482401 2.259866 1.096454 1.306134 2.181886 0.9175485 1.110084 1.580679 1.304482 1.738335 3.411913 1.243613 1.668102 2.318165 3.157832 1.068974 1.123841 0.873607 0.9711871 1.407797 1.014439 1.263082 1.159166 1.529147 2.512309 FA 13:0 0.09291381 0.09699854 0.1218746 0.09227642 0.1284838 0.05466036 0.06158542 0.07098518 0.09137628 0.1014346 0.1152071 0.1044063 0.1301187 0.08956008 0.08007065 0.09255342 0.09453855 0.1175409 0.1242876 0.1152718 0.1283036 0.1539746 0.1142546 0.1392962 0.08249096 0.07977455 0.07975578 0.07479306 0.08326755 0.09092832 0.1346472 0.1590421 0.1920223 0.09200554 0.1187881 0.1198864 0.1172714 0.07840198 0.07541646 0.08217534 0.08576921 0.08132868 0.08480502 0.0854872 0.08034121 0.07820918 0.08763223 FA 15:4 0.07091264 0.08269564 0.09092649 0.08602517 0.1131818 0.04595794 0.05340627 0.05496345 0.05957291 0.05859095 0.07183947 0.06968018 0.09112477 0.05628958 0.05882136 0.05566311 0.1031512 0.1274276 0.1288687 0.07196044 0.07483742 0.09421087 0.1456358 0.1790107 0.09113432 0.09498019 0.09442507 0.09047145 0.09646836 0.09646375 0.1480794 0.1643869 0.1976627 0.1587988 0.1268233 0.1276959 0.1372086 0.08545592 0.09228759 0.07806256 0.06653897 0.06915131 0.08416709 0.08997638 0.08958878 0.09457229 0.1064083 FA 16:0 52.26884 52.38364 60.41513 56.46835 78.78257 42.05307 49.60561 51.41393 45.53432 47.07881 47.67295 46.32787 41.50325 46.20742 46.5421 46.39629 42.86598 53.09182 50.67606 49.04176 53.57477 52.12406 49.21537 45.52751 50.55775 51.03113 50.70642 47.00792 52.13904 54.30605 42.54747 44.09528 41.50531 49.30945 51.83573 45.6474 52.01842 41.90922 48.94352 52.37587 54.40886 55.87615 49.2803 45.49925 46.43781 48.09782 49.22987 FA 14:0 39.30462 43.80804 53.90633 49.10119 63.73846 41.63889 49.32357 51.15834 45.25305 47.29094 47.85875 45.91729 41.36011 45.88911 46.67794 46.47572 42.00027 52.36104 50.162 48.64846 53.64794 52.2275 48.63222 45.1027 49.74225 50.2565 49.98541 46.13522 51.57451 53.66257 42.32394 43.73338 41.10938 48.82277 51.00935 45.29398 51.20224 41.27907 48.27554 52.00203 54.53842 56.18687 48.61247 45.27598 45.90131 47.48344 48.62443 FA 18:0 52.84678 55.52736 63.41881 61.51467 84.07954 41.74414 49.3703 51.03499 45.20087 47.04868 47.69337 45.98622 41.2966 45.84978 46.42645 46.25658 42.671 53.11135 50.74068 48.71904 53.5696 52.17799 48.8687 45.13791 50.18124 50.96801 50.60195 46.61189 52.08361 54.24801 42.67332 43.63406 41.00029 48.97558 51.44296 45.70826 52.03006 41.71276 48.96968 52.04276 54.39968 55.90677 48.90908 45.51435 46.28831 48.15618 49.22467 FA 20:4 0.1529547 0.1717028 0.2182036 0.236565 0.2492875 0.08505139 0.1177162 0.1293017 0.1356459 0.1750116 0.1944081 0.1727508 0.2118413 0.1444317 0.1503637 0.1509534 0.1930577 0.2821857 0.2832555 0.1991685 0.2382133 0.2616009 0.2504442 0.2537135 0.2687921 0.2779943 0.2902417 0.1962014 0.2515672 0.2754173 0.2784199 0.3248808 0.3807833 0.2705527 0.3480067 0.3503144 0.3446044 0.2603099 0.2689683 0.2163328 0.2431227 0.2512838 0.2555822 0.2686674 0.3098936 0.3147556 0.3446628 PE O-38:7|PE O-16:1_22:6 0.119951 0.1178988 0.1235589 0.1216341 0.1213017 0.09485744 0.09576397 0.09658795 0.1289488 0.1351981 0.1352754 0.1061145 0.1113636 0.09990782 0.1031385 0.1030803 0.1297252 0.1312449 0.1326705 0.132573 0.1412123 0.1404708 0.1443088 0.1452179 0.1461885 0.1501653 0.1495835 0.115586 0.1089757 0.109831 0.1249463 0.1206992 0.12245 0.1080043 0.149959 0.1463455 0.1444028 0.1065956 0.1076453 0.1202738 0.1148474 0.1158319 0.1139939 0.110396 0.154333 0.153995 0.1534271 PE O-36:4|PE O-16:1_20:3_A 0.03122225 0.03068485 0.03027276 0.03188336 0.03006794 0.01832131 0.01888086 0.019307 0.02331579 0.02636218 0.02770296 0.02269099 0.02705697 0.0192195 0.02088781 0.0209695 0.03567317 0.03884926 0.04092217 0.03284392 0.03616697 0.03930116 0.04222723 0.05311879 0.04903165 0.05263181 0.05392178 0.02534563 0.02641959 0.02706975 0.03048717 0.03307314 0.03925253 0.02909729 0.04255944 0.04619574 0.0432271 0.02751594 0.02963475 0.02398092 0.0248536 0.02470071 0.02587067 0.0281071 0.04595595 0.0459477 0.04692841 PE O-32:2|PE O-16:1_16:1 0.1872038 0.1841201 0.1808112 0.1902983 0.1920126 0.1378749 0.145726 0.1474911 0.1863902 0.2055847 0.204668 0.161433 0.187768 0.1451173 0.1556155 0.1557535 0.2038101 0.2229987 0.2286966 0.1912442 0.2081382 0.2099094 0.2208833 0.2386282 0.231141 0.2395539 0.2430619 0.228996 0.2387249 0.2371116 0.2557462 0.2591096 0.2723605 0.2489786 0.2945394 0.3041075 0.2971087 0.1973439 0.2014057 0.1981362 0.2027218 0.2056204 0.2148753 0.2254992 0.2690842 0.2708663 0.2778343 PE O-35:2|PE O-17:1_18:1 0.008995186 0.008737404 0.008712445 0.009315594 0.008726763 0.004105177 0.004360057 0.004498166 0.006231808 0.007037679 0.007368435 0.005897301 0.007466192 0.004658199 0.004949764 0.005041397 0.009506837 0.01047164 0.01066484 0.007930974 0.009117253 0.009277739 0.008532737 0.009351147 0.01000109 0.01071127 0.0105018 0.01076758 0.01073956 0.01125768 0.01189752 0.01265659 0.01402771 0.0112582 0.01263827 0.01380419 0.0126466 0.009697691 0.009489609 0.008643637 0.009190603 0.009160705 0.009560077 0.01028423 0.01161083 0.01185271 0.01188974 PE O-36:5|PE O-16:1_20:4_A 0.4310256 0.4380441 0.4308887 0.4346248 0.4024878 0.2809233 0.2787375 0.2758508 0.3745263 0.3706658 0.3560025 0.2986779 0.2573092 0.2988574 0.2881532 0.2844231 0.4245346 0.4064696 0.4060202 0.4360515 0.4434624 0.435063 0.4302118 0.4075627 0.4339463 0.4151004 0.4205808 0.3855394 0.3602134 0.3576814 0.3728806 0.3305939 0.2763918 0.3310818 0.4118099 0.3717434 0.3797024 0.3237711 0.3078059 0.3811023 0.3630703 0.3572017 0.3630978 0.3294831 0.4349461 0.415506 0.4012502 PE O-38:4|PE O-18:1_20:3 0.01563615 0.0155797 0.01573665 0.01653727 0.01498086 0.01516494 0.01610992 0.01552788 0.0166433 0.01842748 0.01786958 0.01564893 0.01683283 0.01390459 0.0154573 0.01425746 0.01878688 0.0207331 0.02138165 0.01717278 0.01898449 0.01939035 0.02040155 0.02412334 0.02226353 0.02385031 0.0231082 0.01505975 0.0158544 0.01604209 0.01844284 0.01938915 0.02602842 0.01551146 0.02247503 0.02478818 0.02290945 0.01738254 0.0183807 0.01400032 0.01509715 0.01501496 0.01541434 0.01773593 0.02405568 0.0241491 0.02434014 PE O-39:6|PE O-17:1_22:5 0.002714175 0.002833187 0.002897856 0.002991352 0.002769893 0.001690266 0.001762946 0.001841665 0.002338924 0.002668352 0.002805054 0.002135504 0.002940325 0.00192454 0.002174123 0.002101565 0.003403721 0.003743365 0.00397512 0.00316761 0.003543878 0.003933319 0.003291448 0.004027626 0.003345788 0.003531329 0.003840259 0.00238098 0.002435406 0.002691115 0.002582448 0.003007816 0.003409637 0.002127467 0.002871739 0.003155092 0.002798565 0.001981198 0.002691464 0.002285366 0.002514235 0.002592834 0.002404987 0.002073597 0.003357647 0.003561407 0.00351508 PE O-38:3|PE O-18:2_20:1 0.02607855 0.02591383 0.02585914 0.02785562 0.02517899 0.00584444 0.006168733 0.006246776 0.008923057 0.01047763 0.01094264 0.009292286 0.01260641 0.006292571 0.006703676 0.007045384 0.01527586 0.0166239 0.0172796 0.01124899 0.01254896 0.01369785 0.009952434 0.01100374 0.01845341 0.01978273 0.02006693 0.02965854 0.02913501 0.02897715 0.03371113 0.03794454 0.04323104 0.02955476 0.03623506 0.04161057 0.03632701 0.02392636 0.02099818 0.02342584 0.02379283 0.0236801 0.02502967 0.02681822 0.02998494 0.03330139 0.03338545 PE O-40:2|PE O-22:1_18:1 0.002620572 0.00258935 0.00264369 0.002831545 0.002583543 0.000824999 0.000809676 0.000814183 0.001084486 0.00120873 0.00123428 0.001057775 0.001415907 0.000762467 0.000794137 0.00082992 0.002096236 0.002119686 0.002264307 0.00164519 0.001783531 0.001745644 0.001819137 0.001410674 0.002262898 0.002350407 0.002472111 0.002711124 0.002743242 0.002782477 0.003362738 0.003630862 0.004143644 0.002711203 0.003685688 0.003994809 0.003426893 0.002754598 0.001487969 0.002586294 0.002505247 0.00246044 0.002783987 0.002913797 0.003326344 0.003370998 0.003604104 PE O-39:5|PE O-21:4_18:1 0.003034896 0.003251279 0.00318474 0.003378194 0.003273651 0.000729311 0.000938161 0.000917361 0.001769125 0.002008792 0.002037647 0.001154686 0.001428853 0.002145865 0.002121997 0.00219647 0.004994139 0.005540623 0.005814655 0.006838765 0.007445799 0.008073119 0.008665289 0.009497793 0.004284937 0.004123803 0.004239497 0.004324923 0.004405877 0.004615712 0.004174425 0.004332732 0.00474541 0.003282832 0.008155727 0.008408817 0.008092916 0.000971117 0.001050476 0.00381194 0.004032487 0.004140712 0.002741122 0.002954739 0.007407923 0.007281512 0.007448189 PE O-40:3|PE O-22:2_18:1 0.007651777 0.007526878 0.007435321 0.007881046 0.007064401 0.001496045 0.001496344 0.001445666 0.002271511 0.002535807 0.00254738 0.00206657 0.002753804 0.001422196 0.001537836 0.001513505 0.004896712 0.005276257 0.005551226 0.003466077 0.003716545 0.004068255 0.003340714 0.003400437 0.00597327 0.006279053 0.006289694 0.009939448 0.009710201 0.009829744 0.01274042 0.01403898 0.01659633 0.01013368 0.01409001 0.01573449 0.01298632 0.01000697 0.006321629 0.007741549 0.007602279 0.007239315 0.009465136 0.01009928 0.01181246 0.01186308 0.01223056 PE O-33:2|PE O-16:1_17:1 0.01333006 0.01260155 0.01259759 0.01395809 0.01337595 0.007567278 0.008068416 0.008380837 0.01016875 0.01175403 0.01181701 0.009845604 0.01172403 0.008164106 0.009314441 0.009388916 0.01390118 0.01532296 0.0160741 0.01246318 0.01410078 0.01449114 0.01401538 0.01627755 0.01500651 0.01594025 0.01637434 0.01260726 0.01381125 0.0135533 0.01428579 0.01605941 0.01723528 0.01389908 0.01652837 0.01801615 0.01758444 0.01210301 0.01277496 0.01110985 0.01203697 0.0120252 0.01220364 0.01392436 0.01623322 0.01659431 0.01690174 PE O-30:1|PE O-16:1_14:0 0.008045889 0.007632487 0.00751557 0.008356346 0.007643651 0.002352569 0.002458026 0.002531726 0.004564943 0.004851214 0.004883009 0.002838552 0.003264101 0.002516036 0.002841123 0.002765995 0.01017405 0.01086282 0.01088009 0.00846245 0.009237684 0.009274831 0.009865504 0.01078643 0.0111596 0.01161758 0.01132698 0.009351064 0.009626608 0.009297645 0.01038566 0.01056548 0.01000971 0.009831524 0.01206832 0.01260375 0.01145423 0.009371418 0.00968667 0.008826388 0.009211823 0.008902953 0.009771489 0.01037471 0.01329436 0.01277663 0.01216005 PE O-37:5|PE O-17:1_20:4 0.006286327 0.006397615 0.006216253 0.006972624 0.006527952 0.003890237 0.004325453 0.004848022 0.006134352 0.007161963 0.00784255 0.005539652 0.00748697 0.004797761 0.005360872 0.005707529 0.007521065 0.008383774 0.008719116 0.007032563 0.008139644 0.009061486 0.008032276 0.009677751 0.007504654 0.00823964 0.009094673 0.005285429 0.005789261 0.00578163 0.006275663 0.006898081 0.008239745 0.005466626 0.00696544 0.007883711 0.007689426 0.00580501 0.005985823 0.005259975 0.005769147 0.005877493 0.005544096 0.006275192 0.007946731 0.008244304 0.008939473 PE O-45:5|PE O-25:1_20:4 0.005004948 0.004507918 0.004522609 0.004729625 0.004490928 0.000872295 0.000940697 0.000902757 0.000226983 0.000215276 0.000411009 0.001340575 0.001812054 0.000961685 0.000866918 0.000849896 0.003151647 0.003248194 0.00336471 0.002669801 0.002972425 0.003095476 0.002003466 0.002376977 0.003484251 0.003425411 0.00349162 0.005903216 0.005988534 0.006111924 0.006945518 0.00727544 0.007865353 0.006085943 0.008333717 0.008827743 0.008067667 0.006393319 0.006186699 0.005217035 0.005359421 0.005187165 0.006252042 0.006194254 0.009297614 0.009100231 0.009268708 PE O-34:1|PE O-18:1_16:0 0.02043346 0.02038734 0.02045374 0.02251168 0.01976759 0.006716024 0.00709362 0.007113761 0.01367905 0.01616511 0.0181926 0.01161308 0.01651323 0.008594901 0.009348976 0.009322134 0.02713315 0.02945855 0.03251536 0.02051703 0.02215182 0.02481408 0.02116189 0.02372727 0.03044666 0.03217271 0.03321867 0.03240323 0.03345672 0.03534904 0.039198 0.04192753 0.04613736 0.03430534 0.04381816 0.04716402 0.04301882 0.03475945 0.02997375 0.02702838 0.0273261 0.02747019 0.03030186 0.03460514 0.04155736 0.04161807 0.04414697 PE O-34:3|PE O-16:1_18:2 0.04160066 0.04281294 0.03863006 0.04015101 0.04417444 0.04400515 0.044855 0.04435128 0.04504405 0.04240677 0.03603743 0.02896454 0.01880154 0.04448112 0.04257072 0.04047783 0.04815366 0.04541792 0.04141843 0.05992487 0.05847814 0.0512507 0.05373967 0.04621253 0.05050791 0.04486994 0.04167782 0.0329963 0.0300661 0.02729928 0.02560895 0.02003216 0.01657184 0.02484452 0.02963378 0.02309612 0.02402184 0.0164549 0.01991693 0.03375565 0.02938734 0.02829421 0.029573 0.02259737 0.03369104 0.03012721 0.02669174 PE O-34:5|PE O-14:1_20:4 0.01105382 0.01071627 0.01183836 0.01227419 0.01150157 0.002415034 0.002942403 0.002963528 0.004636657 0.005384087 0.005663634 0.002985232 0.003468768 0.002824378 0.002970197 0.002932282 0.02069295 0.02144592 0.02185995 0.02085806 0.02188982 0.02293054 0.02425914 0.02733633 0.02168299 0.02123402 0.02187186 0.01312899 0.01338563 0.01271376 0.01628093 0.01654934 0.01759171 0.01517819 0.0182035 0.01840724 0.01680198 0.01603593 0.01566681 0.01405249 0.01422146 0.01375985 0.01630582 0.01647547 0.01901169 0.01923698 0.01975008 PE O-34:2|PE O-16:1_18:1 0.5583847 0.5426221 0.5497736 0.6050915 0.6085834 0.3205283 0.3270784 0.330345 0.4001857 0.408075 0.4072632 0.3524107 0.3662222 0.3203088 0.3251232 0.3213803 0.4774364 0.4868807 0.4916835 0.459532 0.4786057 0.4679362 0.452267 0.4571755 0.5130545 0.5117878 0.5205103 0.5710565 0.5528499 0.5585101 0.5346159 0.518235 0.4927543 0.5434433 0.5892288 0.5782256 0.6003576 0.4570167 0.463287 0.5127834 0.5120404 0.5024651 0.5152867 0.4974498 0.5618617 0.5561898 0.5731253 PE O-42:6|PE O-22:2_20:4 0.004127992 0.00421408 0.004300042 0.004615563 0.003976805 0.00093801 0.000993166 0.000986154 0.001425465 0.001585519 0.001706196 0.001381766 0.001949869 0.000989346 0.001126543 0.001044315 0.004506909 0.004998479 0.005351156 0.003726932 0.00406267 0.0043469 0.003782979 0.004049359 0.005737609 0.005914902 0.005919716 0.00670604 0.007094787 0.007036296 0.008521088 0.009480405 0.01085298 0.006432139 0.009467124 0.01115012 0.009619505 0.007493673 0.006217843 0.00594406 0.006331671 0.006234682 0.006518149 0.007322544 0.009850687 0.009963154 0.01012642 PE O-32:3|PE O-16:2_16:1 0.002067396 0.00205333 0.002081623 0.002305888 0.00199309 0.001290337 0.001381563 0.001360265 0.002287905 0.002614161 0.002649739 0.001410575 0.001641722 0.001382819 0.001354161 0.001349265 0.002205711 0.00223771 0.002323235 0.001942416 0.002076152 0.002149915 0.002586375 0.002774922 0.00264013 0.00255054 0.002777791 0.002020415 0.00208945 0.001991111 0.002679165 0.002739429 0.002900704 0.002449188 0.003221847 0.003242624 0.0029105 0.002195093 0.002093489 0.002084004 0.002117997 0.001971312 0.002392682 0.002355425 0.003069913 0.003027362 0.003148986 PE O-40:8|PE O-20:4_20:4 0.002551008 0.002693994 0.002861094 0.002967063 0.002701805 0.001186203 0.001371524 0.001385098 0.001388727 0.00148058 0.001686591 0.00132254 0.00172603 0.00143246 0.001459414 0.001473829 0.006354715 0.007074295 0.007559441 0.004261129 0.004880247 0.005091681 0.00634575 0.007765344 0.004094544 0.004461382 0.00452417 0.004140622 0.004375711 0.004614946 0.003935441 0.004474233 0.005173291 0.002839666 0.004628569 0.004959309 0.004694137 0.002421013 0.002748295 0.002415034 0.00280356 0.002696058 0.0024816 0.00265533 0.004303819 0.004421654 0.004443767 PE O-40:5|PE O-18:1_22:4 0.01878087 0.01755361 0.01740594 0.01906988 0.01652523 0.00725494 0.007678751 0.007897755 0.01376128 0.01550009 0.01797018 0.01277858 0.01786363 0.009267796 0.009982571 0.009912292 0.02285881 0.02364979 0.02666606 0.02021928 0.02180685 0.02449784 0.02045357 0.02211431 0.02386961 0.02525108 0.02544064 0.02469397 0.024677 0.0259264 0.03218378 0.03380561 0.03771256 0.02619235 0.032701 0.03541882 0.03208214 0.02778117 0.02244498 0.02149302 0.02196318 0.02149992 0.02269702 0.02592451 0.03176627 0.03201513 0.03366049 PE O-36:1|PE O-16:1_20:0 0.005443122 0.005397481 0.00506429 0.005779431 0.004937251 0.000814857 0.000700533 0.000253793 0.001890675 0.002037172 0.002147648 1.04E-05 1.04E-05 0.000927598 0.001010527 0.000103821 0.005937772 0.006618258 0.006977811 0.004189592 0.004857065 0.005172861 0.004039626 0.00387016 0.006142996 0.006734677 0.006716264 0.01055159 0.01125402 0.01146503 0.01468948 0.01639077 0.01817686 0.01071511 0.01469305 0.01709712 0.01437974 0.01102102 0.007067132 0.008384313 0.009175698 0.008850473 0.009849003 0.01132528 0.0129245 0.01346815 0.0137686 PE O-38:2|PE O-16:1_22:1 0.01779158 0.0179275 0.01765097 0.01890772 0.01584378 0.006537668 0.00659189 0.006608333 0.009403336 0.01053087 0.01088347 0.01011169 0.01345554 0.006960549 0.007392386 0.007250781 0.01216699 0.01232244 0.01326985 0.008922967 0.00962706 0.01031214 0.01020935 0.009833694 0.01412126 0.01378817 0.0150025 0.01890934 0.0189303 0.01900738 0.02389571 0.02592916 0.03115595 0.01986748 0.02553399 0.02811295 0.02376819 0.01896041 0.01286459 0.01539901 0.01491489 0.01394756 0.0188246 0.02017363 0.02024687 0.0217451 0.02110788 PE O-44:6|PE O-24:2_20:4 0.004612536 0.004801179 0.004807409 0.005466947 0.004740329 0.001010504 0.001070148 0.001055669 0.001558243 0.001869768 0.001921277 0.001506408 0.002095809 0.001048237 0.001185508 0.001126236 0.005090788 0.006199341 0.006341223 0.003742164 0.004763629 0.005103582 0.004270597 0.004697918 0.006276357 0.007263192 0.006923521 0.006287094 0.00710251 0.007130129 0.008885316 0.01093588 0.01350875 0.006690371 0.01009191 0.01183584 0.009754825 0.008178031 0.0054046 0.005851326 0.00676029 0.006697132 0.007153133 0.008265086 0.01114953 0.01110261 0.01104282 PE O-36:4|PE O-16:1_20:3_B 0.01350329 0.01296989 0.01317909 0.01499127 0.01257712 0.01008318 0.01142578 0.01154825 0.01451069 0.01737534 0.01858116 0.01523768 0.01963497 0.01306948 0.01441003 0.01470239 0.01636392 0.01858608 0.01933701 0.01598175 0.01836521 0.01924702 0.01831921 0.02056891 0.01771271 0.01873339 0.01887782 0.01248805 0.01365197 0.01369138 0.01598916 0.01741185 0.01862446 0.01475093 0.01728185 0.01876417 0.01745588 0.01309349 0.0130053 0.01086407 0.01154421 0.01170241 0.01289752 0.01393734 0.01725347 0.0173068 0.0175922 PE O-42:7|PE O-20:1_22:6 0.003015746 0.003302743 0.003113181 0.003609903 0.00320226 0.001386114 0.001512798 0.001561702 0.002416085 0.002825171 0.003065786 0.002034645 0.00274824 0.001591421 0.001713886 0.001743368 0.004064451 0.004746403 0.004841802 0.003430382 0.004045064 0.004459378 0.004145237 0.004622215 0.00471698 0.005276582 0.005343401 0.003447888 0.003618692 0.003608305 0.003805265 0.004221397 0.004763832 0.003405185 0.004698133 0.00520706 0.004791617 0.004288169 0.003865588 0.003846932 0.004141333 0.004093044 0.003856274 0.004427501 0.005385092 0.005346738 0.005554445 PE O-40:5|PE O-20:1_20:4 0.0110373 0.01105223 0.01229726 0.0129253 0.01127249 0.004387567 0.004615713 0.004695524 0.00734161 0.009014901 0.009933481 0.006887656 0.01065743 0.004987269 0.005413912 0.005637513 0.01695908 0.0194819 0.02134206 0.01463581 0.01605905 0.01847511 0.01702535 0.01933369 0.01891009 0.02060219 0.02182481 0.01631554 0.01849885 0.01904454 0.0207092 0.02460155 0.0304462 0.01780044 0.02353124 0.02796413 0.02415619 0.01964312 0.01679747 0.01524518 0.01749337 0.01696904 0.0164899 0.02005532 0.02368362 0.02527894 0.02558307 PE O-42:3|PE O-24:2_18:1 0.004497508 0.004265456 0.004435227 0.005003117 0.004098766 0.000948265 0.000895524 0.000924088 0.001316964 0.001439353 0.001557037 0.001197387 0.001559901 0.000843753 0.00086683 0.000865545 0.003545688 0.003672494 0.003904943 0.00256887 0.003007888 0.002958194 0.002548688 0.002099985 0.004191358 0.004547295 0.004494153 0.006035104 0.0062054 0.006321289 0.007371028 0.007995763 0.009296488 0.005935022 0.008412464 0.009171937 0.008041682 0.006021522 0.003140218 0.00560099 0.005605308 0.005352597 0.005806585 0.006413119 0.007456114 0.007630324 0.007893951 PE O-36:5|PE O-16:1_20:4_B 0.008701178 0.00925483 0.009717605 0.009590785 0.0108507 0.005043916 0.006367524 0.007181344 0.006475757 0.007593193 0.007702688 0.004886664 0.005028361 0.00562515 0.007089754 0.007292458 0.01026516 0.01215975 0.01362792 0.01176138 0.0145571 0.01487735 0.01011491 0.01197066 0.01313204 0.01516269 0.01637232 0.009265426 0.01012522 0.0113572 0.008493961 0.007316517 0.006386324 0.009213083 0.01129923 0.01188018 0.01378345 0.006846906 0.008760617 0.008038092 0.008457012 0.009519312 0.008779087 0.008991377 0.01277955 0.01415606 0.01461721 PE O-38:4|PE O-18:0_20:4 0.01196144 0.01240463 0.01292805 0.01516121 0.01306315 0.00579223 0.006268323 0.006821911 0.0056181 0.00720353 0.008493773 0.01179405 0.01767112 0.007287173 0.008767876 0.009183632 0.01248508 0.01476755 0.01617934 0.01129647 0.01300316 0.01584893 0.01200648 0.01549798 0.01298846 0.01468522 0.01531761 0.01512463 0.01654826 0.01748687 0.02102895 0.0250261 0.03226752 0.02026618 0.02002897 0.02275589 0.02173717 0.01322353 0.01245943 0.009728924 0.01097447 0.01088782 0.01233223 0.01504854 0.01931759 0.02026482 0.02223328 PE O-40:7|PE O-18:1_22:6 0.04538028 0.04554424 0.04572135 0.05569384 0.057785 0.03886929 0.03939722 0.03949213 0.04684801 0.04928923 0.04959579 0.04220148 0.04802581 0.03848926 0.03966847 0.03914736 0.05027106 0.05272972 0.05174244 0.05013713 0.05203097 0.05230628 0.05387934 0.05548562 0.05597738 0.05736799 0.05748423 0.04254914 0.04223462 0.04235338 0.04549445 0.04449642 0.04482488 0.03964592 0.052276 0.0530203 0.05139102 0.04980128 0.04832618 0.0503265 0.05057621 0.05024041 0.0476563 0.04804327 0.06028467 0.06052091 0.05964353 DMPE 36:1|DMPE 18:0_18:1 0.1192447 0.1385322 0.1620942 0.1702554 0.1883337 0.05515511 0.06068637 0.07166845 0.07757065 0.08552837 0.09847021 0.08512255 0.09223741 0.07820907 0.08190058 0.08352269 0.1191196 0.1494152 0.1604082 0.118763 0.1320564 0.1409738 0.1298132 0.1327194 0.1495677 0.1525139 0.1686983 0.1377993 0.153497 0.1708115 0.1666699 0.1859717 0.2119186 0.1740374 0.1980518 0.1949646 0.2010595 0.1361421 0.139691 0.133125 0.1342509 0.1370014 0.1438809 0.1500864 0.1685395 0.1791661 0.1955492 DMPE 34:2|DMPE 16:1_18:1 0.136573 0.1531883 0.1972902 0.1820862 0.2120318 0.1190987 0.1524468 0.1594536 0.1882673 0.2054251 0.2199258 0.1703706 0.1862082 0.166378 0.1699511 0.1865383 0.1106139 0.1327707 0.1420885 0.1156283 0.1283558 0.141382 0.1426392 0.1450528 0.1330884 0.1386499 0.1421646 0.1030765 0.1173067 0.1232095 0.1142399 0.1261042 0.1451674 0.1232524 0.1523271 0.1392278 0.1507628 0.1129124 0.1140197 0.117769 0.1114282 0.1178078 0.1201322 0.122572 0.1433065 0.151593 0.154517 DMPE 36:2|DMPE 18:1_18:1 0.1727452 0.1998671 0.253192 0.2533948 0.2723765 0.1140817 0.1426279 0.1492572 0.1704976 0.1823611 0.2066453 0.1763958 0.1980283 0.1631924 0.1695058 0.1803566 0.1273158 0.1673422 0.1681109 0.1304936 0.1433455 0.156433 0.1477677 0.1646696 0.1739089 0.1797091 0.1859456 0.1464638 0.1658873 0.1725922 0.1703939 0.1837313 0.2135179 0.1771668 0.2188153 0.2073734 0.2184042 0.1485518 0.1580298 0.1535572 0.1581112 0.1589492 0.1656158 0.1660823 0.2051216 0.207501 0.2259686 Cer 34:2;2O|Cer 18:2;2O/16:0 0.006833521 0.00780063 0.007252106 0.007462186 0.006742496 0.007369607 0.007553171 0.007533757 0.006889754 0.006343442 0.005792349 0.007959772 0.007045081 0.008436724 0.007841224 0.007640155 0.009479252 0.009372719 0.009460298 0.009491892 0.009517796 0.009928377 0.01019681 0.009759174 0.009275096 0.008527722 0.008448816 0.009327565 0.00874506 0.008891601 0.01005036 0.009535604 0.008816238 0.01100378 0.01039043 0.00940224 0.009101761 0.005892657 0.005526171 0.005913638 0.005758753 0.005657198 0.006957226 0.006590602 0.00810582 0.00769022 0.007279664 Cer 36:1;2O|Cer 18:1;2O/18:0 0.004856045 0.005465514 0.005278271 0.005891118 0.005151522 0.001019141 0.001158784 0.001172468 0.001951738 0.002034245 0.002404407 0.001720268 0.002334221 0.001526887 0.001434909 0.00152628 0.006797054 0.007208294 0.007835785 0.005856841 0.006002507 0.007153873 0.00403669 0.004554725 0.007410043 0.007305814 0.007525889 0.01436848 0.01499198 0.01568103 0.01594163 0.0167521 0.01814448 0.01753266 0.01368072 0.01445618 0.01340533 0.006618031 0.006128856 0.005395593 0.005238447 0.005437954 0.007288578 0.00805941 0.007214861 0.007300218 0.007521505 Cer 42:2;2O|Cer 18:1;2O/24:1 0.03786605 0.04218636 0.04274904 0.04719611 0.04246155 0.01452136 0.01573052 0.0159381 0.01879849 0.01960605 0.02349517 0.02233959 0.03229117 0.01783419 0.01884278 0.01951932 0.04564718 0.04970209 0.0558809 0.03770867 0.03857931 0.04790334 0.03253684 0.03448392 0.05276119 0.05263899 0.05625987 0.08633444 0.08950847 0.09467648 0.1068781 0.1151545 0.1378538 0.1072798 0.1010499 0.1109324 0.09891159 0.06100458 0.04867426 0.04350005 0.04131439 0.04238014 0.05809096 0.06260341 0.06711727 0.07053769 0.0750434 Cer 38:1;2O|Cer 18:1;2O/20:0 0.004913395 0.005329445 0.00571663 0.006222629 0.005149053 0.000715137 0.000742071 0.000714204 0.001025461 0.001180325 0.001398429 0.001249694 0.001975421 0.000863648 0.000891617 0.000945651 0.006284243 0.006693858 0.007684178 0.004845929 0.005071453 0.006280981 0.003521014 0.004044569 0.007142599 0.007127879 0.007379605 0.01425968 0.0149375 0.0156972 0.0174154 0.01900681 0.02433666 0.01790238 0.01637954 0.01810631 0.01560559 0.008333804 0.006855217 0.005766566 0.005412119 0.005667866 0.008058304 0.008874986 0.008998735 0.009354879 0.009760044 Cer 42:3;2O|Cer 18:2;2O/24:1 0.008011248 0.009225876 0.009740098 0.0103852 0.008534536 0.004594421 0.004655133 0.004864523 0.005895357 0.006473596 0.00795141 0.007755113 0.01149267 0.006528926 0.006307231 0.006786458 0.009491951 0.01004242 0.01203098 0.008167181 0.008529547 0.01121169 0.009252579 0.01068161 0.01165787 0.01130497 0.01244308 0.01452017 0.01562874 0.01673603 0.02077787 0.02272085 0.0293025 0.01967146 0.02027127 0.02359953 0.02044997 0.01306222 0.01037503 0.008002608 0.007976176 0.008300263 0.01156394 0.01300817 0.01607868 0.01636851 0.01798372 Cer 42:1;2O|Cer 18:0;2O/24:1 0.01845073 0.0210436 0.02216945 0.02196109 0.02033529 0.00601078 0.006608856 0.006826295 0.005330078 0.005839502 0.006647567 0.008478162 0.0111326 0.008525164 0.008433037 0.009141793 0.01998424 0.02085679 0.02310425 0.01747716 0.01821234 0.02061144 0.01047463 0.01127233 0.02253493 0.02231045 0.02450536 0.04502305 0.04668419 0.04891258 0.06086024 0.06405008 0.07890031 0.06036881 0.05095495 0.05552046 0.05014566 0.02558917 0.01997719 0.01954849 0.01982784 0.0199126 0.02721828 0.02909276 0.02851321 0.02944873 0.03056676 Cer 42:0;2O|Cer 18:0;2O/24:0 0.04041511 0.04973792 0.04731998 0.04877719 0.0413866 0.01218532 0.01263473 0.01287229 0.007380933 0.008225434 0.00992816 0.01547099 0.01946418 0.01560184 0.01533926 0.01653405 0.05011648 0.05097229 0.05604855 0.04478865 0.04485008 0.05268248 0.02429488 0.02272665 0.05314913 0.05254744 0.05543118 0.1042222 0.1046598 0.1053558 0.1267928 0.1329377 0.1478851 0.1217454 0.1039333 0.1109376 0.099626 0.06429724 0.04632623 0.04771712 0.04733444 0.04722274 0.06622646 0.06676225 0.0652684 0.06633941 0.07017534 Cer 44:1;2O|Cer 18:0;2O/26:1 0.003053958 0.003854682 0.003762275 0.004108976 0.003629165 0.000726201 0.000719735 0.00079197 0.001170238 0.001265716 0.0014753 0.000827838 0.001102983 0.000997867 0.000998534 0.001052037 0.003240478 0.003456894 0.003794842 0.002688978 0.002835225 0.003425976 0.001619904 0.001538194 0.003634801 0.003622883 0.003820935 0.007245686 0.007828507 0.008263635 0.01021286 0.0113344 0.01426836 0.009933061 0.008295864 0.009597697 0.007952757 0.004214689 0.003016376 0.002899738 0.002859174 0.002999123 0.004157544 0.004677887 0.004262343 0.004587024 0.004906468 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name Alignment ID Average Rt(min) Average Mz Adduct type POLARITY Post curation result Fill % MS/MS assigned Reference RT Reference m/z Formula Ontology INCHIKEY SMILES SHexCer 40:1;2O 19293 15.593 862.61084 [M-H]- NEGATIVE 0.293 TRUE 9.65 862.6084 C46H89NO11S SHexCer QOLPJRGLDWCGJQ-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(OS(=O)(=O)O)C1O)C(O)C=CCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCCCCCC SHexCer 42:1;2O 19967 17.047 890.64136 [M-H]- NEGATIVE ion correlated with 19968; adduct linked to 18586_[M-H2O-H]- 0.586 TRUE 10.51 890.63971 C48H93NO11S SHexCer YMXSSEPSWDLDTL-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(OS(=O)(=O)O)C1O)C(O)C=CCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCCCCCC SHexCer 42:2;3O 20323 15.637 904.61975 [M-H]- NEGATIVE 0.724 TRUE 9.2 904.6189 C48H91NO12S SHexCer FUJNTQNROAHGFC-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(OS(=O)(=O)O)C1O)C(O)C=CCCCCCCCCC)C(O)CCCCCCCCCCCCCCC=CCCCCCCCCCC SHexCer 41:2;3O 19957 14.136 890.58716 [M-H]- NEGATIVE 0.172 TRUE 9.06 890.60327 C47H89NO12S SHexCer SMNXJGBSQBBSKA-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(OS(=O)(=O)O)C1O)C(O)C=CCCCCCCCC)C(O)CCCCCCCCCCCCCCC=CCCCCCCCCCC SHexCer 42:2;2O 19898 15.464 888.62549 [M-H]- NEGATIVE similar chromatogram in higher mz_23310 0.828 TRUE 9.74 888.62402 C48H91NO11S SHexCer ZAUFNJHPYFKTHJ-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(OS(=O)(=O)O)C1O)C(O)C=CCCCCCCCCC)CCCCCCCCCCCCCCCC=CCCCCCCCCCC SHexCer 34:0;2O 16832 11.071 780.53094 [M-H]- NEGATIVE 0.621 TRUE 8.51 780.53009 C40H79NO11S SHexCer TVPZOCANXQKJBW-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(OS(=O)(=O)O)C1O)C(O)CCCCCCCCC)CCCCCCCCCCCCCCCCCCCCC SHexCer 42:1;3O 20366 16.738 906.63696 [M-H]- NEGATIVE 0.81 TRUE 9.84 906.63458 C48H93NO12S SHexCer ZHDPOGHAYPFGQT-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(OS(=O)(=O)O)C1O)C(O)C=CCCCCCCCCC)C(O)CCCCCCCCCCCCCCCCCCCCCCCCCC SHexCer 34:1;2O 16762 10.433 778.51538 [M-H]- NEGATIVE 0.983 TRUE 8.49 778.51453 C40H77NO11S SHexCer GNEPXEXPDFPEGA-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(OS(=O)(=O)O)C1O)C(O)C=CCCCCCCC)CCCCCCCCCCCCCCCCCCCCC SHexCer 32:1;2O 15838 8.701 750.48547 [M-H]- NEGATIVE 0.81 TRUE 8.18 750.48322 C38H73NO11S SHexCer QEDLGVDQCKJDSB-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(OS(=O)(=O)O)C1O)C(O)C=CCCCCCCC)CCCCCCCCCCCCCCCCCCC PS 36:1|PS 18:0_18:1 17084 14.239 788.54761 [M-H]- NEGATIVE 0.897 TRUE 8.85 788.54468 C42H80NO10P PS AJFWREUFUPEYII-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCC(N)C(=O)O)CCCCCCCCCCCCCCCCC PS 40:4|PS 18:0_22:4 18641 14.137 838.56323 [M-H]- NEGATIVE 0.81 TRUE 8.85 838.56042 C46H82NO10P PS LJUFXCVFKSJRPV-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCC(N)C(=O)O)CCCCCCCCCCCCCCCCC PI 40:6|PI 18:0_22:6 20406 12.575 909.55157 [M-H]- NEGATIVE adduct linked to 18437_[M-H2O-H]- 0.862 TRUE 8.45 909.54993 C49H83O13P PI DJVOKHFQPGWUPK-UHFFFAOYSA-N O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 36:4|PI 16:0_20:4 19113 11.077 857.51923 [M-H]- NEGATIVE found in higher mz's MsMs_20930 0.948 TRUE 8.13 857.51862 C45H79O13P PI VWRYMIZQLPXULA-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCC PI 40:1|PI 18:0_22:1 20651 16.995 919.6308 [M-H]- NEGATIVE ion correlated with 20650; adduct linked to 19549_[M-H]- 0.276 TRUE 10.58 919.62811 C49H93O13P PI WMWWIUFCIQYQIF-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCCCC=CCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 40:5|PI 18:0_22:5 20452 13.59 911.5686 [M-H]- NEGATIVE adduct linked to 19865_[M+Cl]-; similar chromatogram in higher mz_22325 0.845 TRUE 8.52 911.56549 C49H85O13P PI QLABQLNIHHHJCI-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 36:3|PI 18:1_18:2 19182 11.708 859.53571 [M-H]- NEGATIVE adduct linked to 18706_[M-H2O-H]-; adduct linked to 20089_[M+Cl]-; similar chromatogram in higher mz_22863 0.828 TRUE 8.21 859.53418 C45H81O13P PI MXJMOLQIXMJUEL-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCC=CCCCCCCCC PI 38:2|PI 18:0_20:2 19921 14.83 889.58398 [M-H]- NEGATIVE similar chromatogram in higher mz_23328 0.81 TRUE 8.97 889.58118 C47H87O13P PI RZFIPFIGUWXYNB-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 38:3|PI 18:0_20:3 19863 13.477 887.56622 [M-H]- NEGATIVE similar chromatogram in higher mz_21431; found in higher mz's MsMs_21431; similar chromatogram in higher mz_22661 0.948 TRUE 8.73 887.56549 C47H85O13P PI GGSSNEAFVQRIHU-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 40:3|PI 18:0_22:3 20553 15.147 915.599 [M-H]- NEGATIVE 0.81 TRUE 9.15 915.5968 C49H89O13P PI FPMGZGDSFLCJRN-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCC=CCC=CCC=CCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 36:5 19056 10.038 855.50366 [M-H]- NEGATIVE 0.81 TRUE 8.08 855.50293 C45H77O13P PI OTIOSSJINHDJFG-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCC PI 32:2|PI 16:1_16:1 17624 9.218 805.48938 [M-H]- NEGATIVE adduct linked to 18704_[M+Cl]- 0.81 TRUE 7.89 805.4873 C41H75O13P PI HBPXEBWVNAJRCA-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCC=CCCCCCC PI 36:0|PI 18:0_18:0 19377 15.49 865.58258 [M-H]- NEGATIVE 0.655 TRUE 9.36 865.58118 C45H87O13P PI FQZQXPXKJFOAGE-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 36:1|PI 18:0_18:1 19323 14.131 863.56769 [M-H]- NEGATIVE 0.966 TRUE 8.87 863.56549 C45H85O13P PI YOBFISPJJWPPTK-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 38:4|PI 18:0_20:4 19808 12.869 885.55365 [M-H]- NEGATIVE similar chromatogram in higher mz_22242; found in higher mz's MsMs_21403; similar chromatogram in higher mz_21767; similar chromatogram in higher mz_21150; similar chromatogram in higher mz_23485 1 TRUE 8.45 885.54993 C47H83O13P PI OJESNYFIPWSOPO-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 38:1|PI 18:0_20:1 19996 15.558 891.59845 [M-H]- NEGATIVE 0.845 TRUE 9.47 891.5968 C47H89O13P PI LTAQEXVIISNEHI-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCC=CCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 32:1|PI 18:0_14:1 17727 10.886 807.50531 [M-H]- NEGATIVE 0.741 TRUE 8.19 807.50293 C41H77O13P PI BYMPXXIMCOADAJ-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 40:2|PI 18:0_22:2 20604 16.008 917.61371 [M-H]- NEGATIVE 0.81 TRUE 9.74 917.61249 C49H91O13P PI VIFLBOZTTASJKF-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCCCC=CCC=CCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 38:5|PI 18:0_20:5 19772 11.827 883.53827 [M-H]- NEGATIVE similar chromatogram in higher mz_23058 0.81 TRUE 8.26 883.53418 C47H81O13P PI SUYDNPBYMBTSMM-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 39:2|PI 18:0_21:2 20289 15.283 903.59711 [M-H]- NEGATIVE adduct linked to 19842_[M-H2O-H]- 0.81 TRUE 9.28 903.5968 C48H89O13P PI DKDHMBPPRHUOTR-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 36:2|PI 18:0_18:2 19251 13.269 861.55078 [M-H]- NEGATIVE 0.81 TRUE 8.61 861.54993 C45H83O13P PI KZVRAFHIKMDULK-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 30:1|PI 16:0_14:1 16800 9.052 779.47314 [M-H]- NEGATIVE similar chromatogram in higher mz_19620 0.345 TRUE 7.84 779.47162 C39H73O13P PI OWZHSYUXZCOOOJ-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCC PI 38:6|PI 16:0_22:6 19736 10.787 881.51959 [M-H]- NEGATIVE similar chromatogram in higher mz_21300; similar chromatogram in higher mz_22305; similar chromatogram in higher mz_22647 0.81 TRUE 8.1 881.51862 C47H79O13P PI FPHAZHKZJQOPBU-UHFFFAOYSA-N O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCC PI 32:1|PI 16:0_16:1 17725 10.69 807.50415 [M-H]- NEGATIVE found in higher mz's MsMs_19911; adduct linked to 16499_[M-H]- 0.879 TRUE 8.18 807.50293 C41H77O13P PI QAWXBJDYTIBLRK-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCC PI 39:3|PI 18:0_21:3 20236 14.387 901.58423 [M-H]- NEGATIVE 0.81 TRUE 8.96 901.58118 C48H87O13P PI CYMDUGNVEBGOQY-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCC=CCC=CCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC PI 36:5|PI 16:1_20:4 19057 9.614 855.5047 [M-H]- NEGATIVE similar chromatogram in higher mz_19409 0.81 TRUE 8 855.50293 C45H77O13P PI HBRQUUCXZMGFFA-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCC=CCCCCCC PG 32:0|PG 16:0_16:0_A 14832 12.576 721.50488 [M-H]- NEGATIVE similar chromatogram in higher mz_19256 0.81 TRUE 8.78 721.5025 C38H75O10P PG BIABMEZBCHDPBV-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC(O)CO)CCCCCCCCCCCCCCC PG 32:0|PG 16:0_16:0_B 14830 11.765 721.50366 [M-H]- NEGATIVE similar chromatogram in higher mz_16051; similar chromatogram in higher mz_22665 0.793 TRUE 8.78 721.5025 C38H75O10P PG BIABMEZBCHDPBV-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC(O)CO)CCCCCCCCCCCCCCC PG 42:9|PG 20:3_22:6 18757 9.41 843.51971 [M-H]- NEGATIVE adduct linked to 19405_[M+Hac-H]-; similar chromatogram in higher mz_20735 0.724 TRUE 8.12 843.51819 C48H77O10P PG IUAHNRBNAVSHBB-UHFFFAOYSA-N O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCC(O)CO)CCCCCCCCCC=CCC=CCC=CCC PG 44:12|PG 22:6_22:6 19364 8.974 865.50433 [M-H]- NEGATIVE 0.81 TRUE 7.84 865.5025 C50H75O10P PG XACKZSRNTPEYBU-UHFFFAOYSA-N O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCC(O)CO)CCC=CCC=CCC=CCC=CCC=CCC=CCC PG 38:4|PG 18:0_20:4 17380 13.277 797.53815 [M-H]- NEGATIVE 0.741 TRUE 8.56 797.53381 C44H79O10P PG JDHPBMPBPWNFFB-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCC(O)CO)CCCCCCCCCCCCCCCCC PG 38:5|PG 18:1_20:4 17310 10.947 795.51752 [M-H]- NEGATIVE adduct linked to 19078_[M+Hac-H]- 0.793 TRUE 8.39 795.51819 C44H77O10P PG ODHQFFNXKQCMPG-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCC(O)CO)CCCCCCCC=CCCCCCCCC PG 38:6|PG 16:0_22:6_A 17239 10.231 793.5036 [M-H]- NEGATIVE similar chromatogram in higher mz_22111 0.81 TRUE 8.26 793.5025 C44H75O10P PG HUFCXYMYEWLLHT-UHFFFAOYSA-N O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCC(O)CO)CCCCCCCCCCCCCCC PG 32:1|PG 14:0_18:1 14757 10.012 719.48871 [M-H]- NEGATIVE adduct linked to 15599_[M+Hac-H]- 0.534 TRUE 8.47 719.48688 C38H73O10P PG GKSUEOBCMJKHAW-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCC(O)CO)CCCCCCCCCCCCC PG 34:3|PG 16:1_18:2 15601 10.17 743.48755 [M-H]- NEGATIVE adduct linked to 17729_[M+FA-H]- 0.776 TRUE 8.15 743.48688 C40H73O10P PG PTJBFPPEYDFAAQ-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCC(O)CO)CCCCCCCC=CCCCCCC PG 38:6|PG 16:0_22:6_B 17241 10.614 793.50494 [M-H]- NEGATIVE adduct linked to 18389_[M+Cl]- 0.793 TRUE 8.26 793.5025 C44H75O10P PG HUFCXYMYEWLLHT-UHFFFAOYSA-N O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCC(O)CO)CCCCCCCCCCCCCCC PE 34:3|PE 16:1_18:2 14541 11.804 712.4942 [M-H]- NEGATIVE similar chromatogram in higher mz_21116; similar chromatogram in higher mz_20044 0.81 TRUE 8.77 712.49231 C39H72NO8P PE SSRRIJSEUKHYFB-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCC PE 40:5|PE 18:0_22:5 17217 15.704 792.55756 [M-H]- NEGATIVE similar chromatogram in higher mz_20263; adduct linked to 17982_[M+Hac-H]-; similar chromatogram in higher mz_18660 0.793 TRUE 10.11 792.55487 C45H80NO8P PE KYERVKWKQQBRQB-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC PE 34:1|PE 16:0_18:1 14662 14.617 716.52435 [M-H]- NEGATIVE adduct linked to 12528_[M-H2O-H]- 0.948 TRUE 9.91 716.52362 C39H76NO8P PE FHQVHHIBKUMWTI-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC PE 36:1|PE 18:0_18:1 15646 16.309 744.55585 [M-H]- NEGATIVE adduct linked to 23339_[2M-H]- 0.966 TRUE 10.8 744.55487 C41H80NO8P PE JQKOHRZNEOQNJE-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC PE 40:6|PE 18:1_22:5 17139 13.582 790.54071 [M-H]- NEGATIVE 0.81 TRUE 9.76 790.53918 C45H78NO8P PE IZEXFAOLFRVCJS-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE 38:7|PE 16:1_22:6 16153 11.35 760.49603 [M-H]- NEGATIVE adduct linked to 15555_[M-H2O-H]- 0.759 TRUE 8.54 760.49231 C43H72NO8P PE PMUXXFUNXMXIFC-UHFFFAOYSA-N O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCC PE 40:6|PE 18:0_22:6 17138 14.714 790.54047 [M-H]- NEGATIVE similar chromatogram in higher mz_23011; adduct linked to 17474_[M+FA-H]- 0.862 TRUE 9.87 790.53918 C45H78NO8P PE XYYHNDVKALDFHQ-UHFFFAOYSA-N O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC PE 38:3|PE 18:0_20:3_A 16407 15.636 768.55609 [M-H]- NEGATIVE similar chromatogram in higher mz_20323; adduct linked to 14839_[M-2H]-; similar chromatogram in higher mz_20976 0.81 TRUE 10.38 768.55487 C43H80NO8P PE MSYFXMJDQLPRGO-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC PE 36:3|PE 16:0_20:3 15499 14.424 740.52637 [M-H]- NEGATIVE ion correlated with 14462 0.793 TRUE 9.66 740.52362 C41H76NO8P PE IQLKOURRKVPATH-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC PE 33:1|PE 16:0_17:1 14168 13.789 702.50977 [M-H]- NEGATIVE adduct linked to 16246_[M+Hac-H]- 0.81 TRUE 9.66 702.50787 C38H74NO8P PE CBDUTJYWWDMHBN-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC PE 40:2|PE 18:1_22:1 17412 17.825 798.60248 [M-H]- NEGATIVE adduct linked to 14808_[M-H2O-H]- 0.81 TRUE 12.61 798.60181 C45H86NO8P PE HIGXQDJTUMSNNI-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE 32:2|PE 16:1_16:1 13622 11.324 686.47778 [M-H]- NEGATIVE similar chromatogram in higher mz_17282; similar chromatogram in higher mz_18954; similar chromatogram in higher mz_22953 0.81 TRUE 8.62 686.47662 C37H70NO8P PE PGPMCWZMPPZJML-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCC PE 37:2|PE 18:1_19:1 16032 15.582 756.55518 [M-H]- NEGATIVE adduct linked to 15440_[M-H2O-H]- 0.81 TRUE 10.63 756.55487 C42H80NO8P PE VYGBMMLRWMCCRC-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE 44:5|PE 24:1_20:4 18918 18.116 848.63397 [M-H]- NEGATIVE similar chromatogram in higher mz_23075; similar chromatogram in higher mz_23108 0.638 TRUE 12.55 848.61749 C49H88NO8P PE CORIUPZXHHSRSP-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCC=CCCCCCCCCCC PE 38:1|PE 18:0_20:1 16537 17.697 772.58765 [M-H]- NEGATIVE adduct linked to 23473_[2M-H]- 0.81 TRUE 12.18 772.58618 C43H84NO8P PE DBYSGBYABPVNGO-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC PE 40:4|PE 18:0_22:4 17288 16.152 794.57269 [M-H]- NEGATIVE adduct linked to 23482_[2M-H]-; similar chromatogram in higher mz_19628 0.81 TRUE 10.87 794.5705 C45H82NO8P PE TVACGFJBGVEGCR-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC PE 36:5|PE 16:1_20:4 15343 11.672 736.49384 [M-H]- NEGATIVE adduct linked to 17464_[M+FA-H]-; adduct linked to 17940_[M+Hac-H]- 0.81 TRUE 8.76 736.49231 C41H72NO8P PE CXGZFWPMXPAZEA-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCC PE 38:3|PE 18:0_20:3_B 16408 16.129 768.55725 [M-H]- NEGATIVE similar chromatogram in higher mz_22336 0.81 TRUE 10.38 768.55487 C43H80NO8P PE MSYFXMJDQLPRGO-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCC PE 36:3|PE 18:1_18:2 15498 13.883 740.52533 [M-H]- NEGATIVE 0.81 TRUE 9.35 740.52362 C41H76NO8P PE GKAFCSRKMWFPSJ-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE 38:4|PE 16:0_22:4 16351 14.464 766.5412 [M-H]- NEGATIVE similar chromatogram in higher mz_16664; similar chromatogram in higher mz_19920; similar chromatogram in higher mz_19990; similar chromatogram in higher mz_17975 0.81 TRUE 9.97 766.53918 C43H78NO8P PE ICYDFONFTSPCRL-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC PE 40:4|PE 20:0_20:4 17289 16.694 794.5733 [M-H]- NEGATIVE adduct linked to 18410_[M+Cl]-; similar chromatogram in higher mz_19629 0.81 TRUE 11.22 794.5705 C45H82NO8P PE MIPOZDXFSKBSGM-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCCCC PE 36:2|PE 18:1_18:1 15564 15.149 742.54083 [M-H]- NEGATIVE similar chromatogram in higher mz_20429; similar chromatogram in higher mz_23284; similar chromatogram in higher mz_18216 0.81 TRUE 9.93 742.53918 C41H78NO8P PE MWRBNPKJOOWZPW-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE 35:1|PE 17:0_18:1 15141 15.14 730.5448 [M-H]- NEGATIVE 0.81 TRUE 10.29 730.53918 C40H78NO8P PE UAKUCJGIIYSFFK-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCC PE 35:2|PE 16:1_19:1 15081 13.582 728.52557 [M-H]- NEGATIVE similar chromatogram in higher mz_15497; similar chromatogram in higher mz_18404; similar chromatogram in higher mz_20509; adduct linked to 15051_[M-2H]- 0.81 TRUE 9.7 728.52362 C40H76NO8P PE WCYWDSBANAFPOJ-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCC PE 38:6|PE 18:1_20:5 16210 12.38 762.51038 [M-H]- NEGATIVE adduct linked to 15427_[M+Cl]- 0.81 TRUE 8.97 762.50787 C43H74NO8P PE AMKOUQLHUASJMB-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE 32:1|PE 16:0_16:1 13701 12.918 688.49451 [M-H]- NEGATIVE adduct linked to 23132_[2M-H]- 0.845 TRUE 9.11 688.49231 C37H72NO8P PE CZOSTDZGCCEZTJ-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC PE 39:4|PE 19:0_20:4 16838 15.879 780.5567 [M-H]- NEGATIVE adduct linked to 19147_[M+Hac-H]- 0.345 TRUE 10.46 780.55487 C44H80NO8P PE OFDOGRFSVOUXHN-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCCC PE 30:1|PE 14:0_16:1 12732 10.991 660.46228 [M-H]- NEGATIVE 0.81 TRUE 8.55 660.461 C35H68NO8P PE AZKOMSGSPCBHKK-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCC PE 38:6|PE 16:0_22:6 16209 12.928 762.51007 [M-H]- NEGATIVE adduct linked to 17437_[M+Cl]-; similar chromatogram in higher mz_20059 0.81 TRUE 8.99 762.50787 C43H74NO8P PE MPWUZHVZZKSTPV-UHFFFAOYSA-N O=C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC PE 44:4|PE 24:0_20:4 18969 19.624 850.64221 [M-H]- NEGATIVE adduct linked to 18596_[M+FA-H]- 0.655 TRUE 12.93 850.63312 C49H90NO8P PE XDYQJJJMHMWXMC-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCCCCCCCC PC 32:1|PC 16:0_16:1 16695 12.489 776.54675 [M+HCOO]- NEGATIVE adduct linked to 14660_[M-H]-; adduct linked to 16341_[M+Cl]- 0.81 TRUE 9.09 776.54468 C40H78NO8P PC QIBZFHLFHCIUOT-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C)CCCCCCCCCCCCCCC PC 28:0|PC 14:0_14:0 14858 10.265 722.49847 [M+HCOO]- NEGATIVE ion correlated with 18030; adduct linked to 15345_[M+Hac-H]- 0.81 TRUE 8.26 722.4978 C36H72NO8P PC CITHEXJVPOWHKC-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C)CCCCCCCCCCCCC LPS 18:0 8815 3.443 524.2998 [M-H]- NEGATIVE adduct linked to 7361_[M-H]- 0.828 TRUE 6.2 524.29938 C24H48NO9P LPS ZPDQFUYPBVXUKS-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)OCC(N)C(=O)O)CCCCCCCCCCCCCCCCC LPI 18:0 10716 3.444 599.32129 [M-H]- NEGATIVE adduct linked to 9175_[M-2H]-; similar chromatogram in higher mz_16239; similar chromatogram in higher mz_18809 0.862 TRUE 6.19 599.32019 C27H53O12P LPI MXAFDFDAIFZFET-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC LPE 22:6_A 8812 2.324 524.28009 [M-H]- NEGATIVE adduct linked to 7287_[M-H2O-H]-; adduct linked to 21226_[2M-H]-; similar chromatogram in higher mz_22104 0.81 TRUE 5.69 524.27832 C27H44NO7P LPE XEVRBOQZSXWGQO-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC LPE 18:2 7625 2.426 476.27954 [M-H]- NEGATIVE 0.828 TRUE 6.13 476.27829 C23H44NO7P LPE DBHKHNGBVGWQJE-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC LPE 15:0 6781 2.331 438.2623 [M-H]- NEGATIVE 0.828 TRUE 5.91 438.2626 C20H42NO7P LPE FGHPDPYCRTXYNZ-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCCCCCCCC LPE 20:4 8243 2.402 500.27902 [M-H]- NEGATIVE adduct linked to 7360_[M-H]- 0.845 TRUE 5.83 500.27829 C25H44NO7P LPE JPNPIRVRGLGTRE-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC LPE 16:0_A 7101 3.008 452.27817 [M-H]- NEGATIVE adduct linked to 20343_[2M-H]-; similar chromatogram in higher mz_12599; similar chromatogram in higher mz_9507; similar chromatogram in higher mz_13817 0.845 TRUE 6.33 452.27829 C21H44NO7P LPE YVYMBNSKXOXSKW-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC LPE 16:1 7069 2.043 450.26205 [M-H]- NEGATIVE adduct linked to 8137_[M+FA-H]-; similar chromatogram in higher mz_7681; similar chromatogram in higher mz_9346; similar chromatogram in higher mz_13019; similar chromatogram in higher mz_17066; similar chromatogram in higher mz_20708; similar chromatogram in higher mz_22300 0.845 TRUE 5.86 450.2626 C21H42NO7P LPE DSOWUEHXZJUNID-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCC LPE 22:4 8930 3.472 528.31085 [M-H]- NEGATIVE similar chromatogram in higher mz_11623 0.81 TRUE 6.32 528.30957 C27H48NO7P LPE RSVFMXVZJZRSQQ-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCCC=CCC=CCC=CCC=CCC LPE 16:0_B 7104 2.741 452.27936 [M-H]- NEGATIVE similar chromatogram in higher mz_8575; adduct linked to 6190_[M-H]-; similar chromatogram in higher mz_10020; similar chromatogram in higher mz_13080; similar chromatogram in higher mz_13818 0.81 TRUE 6.33 452.27829 C21H44NO7P LPE YVYMBNSKXOXSKW-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC LPE 22:6_B 8811 2.157 524.27783 [M-H]- NEGATIVE adduct linked to 10792_[M+Hac-H]- 0.81 TRUE 5.69 524.27832 C27H44NO7P LPE XEVRBOQZSXWGQO-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC LPA 28:2 10043 2.956 573.38989 [M-H]- NEGATIVE adduct linked to 11059_[M+Cl]- 0.828 TRUE 8.23 573.39258 C31H59O7P LPA MQWVUCNFXZWOSO-UHFFFAOYSA-N O=C(OCC(O)COP(=O)(O)O)CCCCCCCCCCCCCCCC=CCC=CCCCCCCC HexCer 42:1;3O|HexCer 16:1;2O/26:0;O 18295 17.071 826.67944 [M-H]- NEGATIVE ion correlated with 19301; ion correlated with 20305; adduct linked to 19301_[M+Cl]-; adduct linked to 19848_[M+Hac-H]-; found in higher mz's MsMs_19301; adduct linked to 17775_[M-H2O-H]- 0.81 TRUE 12.72 826.6778 C48H93NO9 HexCer_HS DFFBNIJKKUVWPO-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C=CCCCCCCCCCCC)C(O)CCCCCCCCCCCCCCCCCCCCCCCC HexCer 42:0;3O|HexCer 16:0;2O/26:0;O 18359 18.642 828.69598 [M-H]- NEGATIVE adduct linked to 19355_[M+Cl]- 0.586 TRUE 12.99 828.69342 C48H95NO9 HexCer_HDS XDLGVHOEYSAYLK-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)CCCCCCCCCCCCC)C(O)CCCCCCCCCCCCCCCCCCCCCCCC HexCer 42:0;2O|HexCer 21:0;2O/21:0;O 18358 19.342 828.69562 [M-H]- NEGATIVE adduct linked to 19356_[M+Cl]-; similar chromatogram in higher mz_20437; similar chromatogram in higher mz_22629 0.81 TRUE 13.04 828.69342 C48H95NO9 HexCer_HDS JJTPIEYEJJPFIP-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)CCCCCCCCCCCCCCCCCC)C(O)CCCCCCCCCCCCCCCCCCC HexCer 52:7;4O 21465 17.224 970.72272 [M-H]- NEGATIVE ion correlated with 19231; adduct linked to 21996_[M+Cl]-; adduct linked to 22089_[M+FA-H]- 0.81 TRUE 12.12 970.73529 C58H101NO10 HexCer_AP AZEWCBYEJRLSGW-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)CCCC=CCCCCCCCCCCCCC)C(O)CCCCCCCCCC=CCC=CCC=CCC=CCC=CCC=CCC HexCer 52:6;4O 21494 18.792 972.73773 [M-H]- NEGATIVE adduct linked to 22017_[M+Cl]-; adduct linked to 22100_[M+FA-H]- 0.569 TRUE 12.66 972.75092 C58H103NO10 HexCer_AP XSCLNLBLDJIXMD-UHFFFAOYSA-N O=C(NC(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)C=CCCC=CCCC=CCC)C(O)CCCCCCCCCCCCCCCCCCCC=CCC=CCC=CCCCCCCC FA 44:5 12069 18.054 637.58948 [M-H]- NEGATIVE 0.845 TRUE 13.99 637.5929 C44H78O2 FA MGPNPEMAXBEYOX-UHFFFAOYSA-N O=C(O)CCCCCCCCCCCCCCCCCCCCCCCCCCCC=CCC=CCC=CCC=CCC=CCC FA 24:0 5487 12.136 367.35852 [M-H]- NEGATIVE similar chromatogram in higher mz_10151; similar chromatogram in higher mz_19776 0.086 TRUE 8.5 367.35818 C24H48O2 FA QZZGJDVWLFXDLK-UHFFFAOYSA-N O=C(O)CCCCCCCCCCCCCCCCCCCCCCC FA 17:1 3153 3.437 267.23428 [M-H]- NEGATIVE similar chromatogram in higher mz_9687 0.81 TRUE 5.96 267.233 C17H32O2 FA QSBYPNXLFMSGKH-UHFFFAOYSA-N O=C(O)CCCCCCCC=CCCCCCCC FA 40:6 10169 14.011 579.5116 [M-H]- NEGATIVE ion correlated with 2493; adduct linked to 11633_[M+FA-H]- 0.81 TRUE 12.54 579.51471 C40H68O2 FA MTFKNULUZHJPFJ-UHFFFAOYSA-N O=C(O)CCCCCCCCCCCCCCCCCCCCC=CCC=CCC=CCC=CCC=CCC=CCC FA 20:5 4178 3.238 301.21835 [M-H]- NEGATIVE 0.638 TRUE 5.69 301.21729 C20H30O2 FA JAZBEHYOTPTENJ-UHFFFAOYSA-N O=C(O)CCCC=CCC=CCC=CCC=CCC=CCC FA 17:0 3179 4.752 269.24811 [M-H]- NEGATIVE similar chromatogram in higher mz_6162; similar chromatogram in higher mz_5181 0.828 TRUE 6.45 269.2486 C17H34O2 FA KEMQGTRYUADPNZ-UHFFFAOYSA-N O=C(O)CCCCCCCCCCCCCCCC FA 13:0 1706 1.782 213.1848 [M-H]- NEGATIVE similar chromatogram in higher mz_2964; similar chromatogram in higher mz_13149; similar chromatogram in higher mz_10977 0.81 TRUE 4.7 213.186 C13H26O2 FA SZHOJFHSIKHZHA-UHFFFAOYSA-N O=C(O)CCCCCCCCCCCC FA 15:4 2325 1.691 233.15466 [M-H]- NEGATIVE 0.828 TRUE 4.33 233.15469 C15H22O2 FA VYNPFWKAZJBFBM-UHFFFAOYSA-N O=C(O)CC=CCC=CCC=CCC=CCC FA 16:0 2926 3.866 255.23872 [M-H]- NEGATIVE found in higher mz's MsMs_9049; found in higher mz's MsMs_11325; adduct linked to 2488_[M-H2O-H]- 1 TRUE 6.14 255.233 C16H32O2 FA IPCSVZSSVZVIGE-UHFFFAOYSA-N O=C(O)CCCCCCCCCCCCCCC FA 14:0 2195 2.348 227.20612 [M-H]- NEGATIVE similar chromatogram in higher mz_10683; adduct linked to 1678_[M-H2O-H]- 1 TRUE 5.3 227.20171 C14H28O2 FA TUNFSRHWOTWDNC-UHFFFAOYSA-N O=C(O)CCCCCCCCCCCCC FA 18:0 3582 5.645 283.27045 [M-H]- NEGATIVE similar chromatogram in higher mz_7025; found in higher mz's MsMs_7025; found in higher mz's MsMs_15943; adduct linked to 3120_[M-H2O-H]- 1 TRUE 6.93 283.26431 C18H36O2 FA QIQXTHQIDYTFRH-UHFFFAOYSA-N O=C(O)CCCCCCCCCCCCCCCCC FA 20:4 4227 15.772 303.23328 [M-H]- NEGATIVE found in higher mz's MsMs_15853; similar chromatogram in higher mz_21952; similar chromatogram in higher mz_9338 0.81 TRUE 5.96 303.233 C20H32O2 FA HQPCSDADVLFHHO-UHFFFAOYSA-N O=C(O)CCCCCCC=CCC=CCC=CCC=CCC PE O-38:7|PE O-16:1_22:6 15707 13.665 746.5144 [M-H]- NEGATIVE similar chromatogram in higher mz_23316; found in higher mz's MsMs_18328; adduct linked to 17249_[M+FA-H]- 0.931 TRUE 9.52 746.513 C43H74NO7P EtherPE WVGALBKSWOUIEZ-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC PE O-36:4|PE O-16:1_20:3_A 14937 14.691 724.53003 [M-H]- NEGATIVE similar chromatogram in higher mz_19517 0.845 TRUE 10.28 724.52869 C41H76NO7P EtherPE FUKISTPVIDDUQU-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCC=CCC=CCC=CCC PE O-32:2|PE O-16:1_16:1 13166 13.755 672.50018 [M-H]- NEGATIVE adduct linked to 23096_[2M-H]-; similar chromatogram in higher mz_23173 0.948 TRUE 9.53 672.49738 C37H72NO7P EtherPE QXSTVVHZCWJIBU-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCC PE O-35:2|PE O-17:1_18:1 14614 16.265 714.5459 [M-H]- NEGATIVE 0.81 TRUE 10.81 714.54431 C40H78NO7P EtherPE FDQGSTMMGFGRFB-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE O-36:5|PE O-16:1_20:4_A 14868 14.003 722.51666 [M-H]- NEGATIVE adduct linked to 23238_[2M-H]-; found in higher mz's MsMs_22977; found in higher mz's MsMs_17590 0.948 TRUE 9.73 722.513 C41H74NO7P EtherPE YITZQGLIICATLN-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC PE O-38:4|PE O-18:1_20:3 15920 16.384 752.56238 [M-H]- NEGATIVE 0.69 TRUE 11.21 752.56 C43H80NO7P EtherPE ADYILQKXUHGAJF-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCC=CCC=CCC=CCC PE O-39:6|PE O-17:1_22:5 16219 15.057 762.54565 [M-H]- NEGATIVE adduct linked to 16703_[M+Hac-H]- 0.81 TRUE 10.27 762.54431 C44H78NO7P EtherPE PYMLHWKEUVUNIM-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCC=CCC=CCC=CCC=CCC=CCC PE O-38:3|PE O-18:2_20:1 15979 17.085 754.57715 [M-H]- NEGATIVE ion correlated with 15151; adduct linked to 17493_[M+FA-H]- 0.81 TRUE 12.29 754.57562 C43H82NO7P EtherPE CJTMZOOUZQGAPV-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCC=CCCCCCCCC PE O-40:2|PE O-22:1_18:1 16983 19.972 784.62445 [M-H]- NEGATIVE 0.81 TRUE 13.13 784.62262 C45H88NO7P EtherPE XKVIDVSVAFBWFT-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE O-39:5|PE O-21:4_18:1 16289 15.283 764.56189 [M-H]- NEGATIVE similar chromatogram in higher mz_23227 0.81 TRUE 10.91 764.56 C44H80NO7P EtherPE BQIZMKLLXVLBSC-UHFFFAOYSA-N O=C(OC(COCCCCCCCCC=CCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE O-40:3|PE O-22:2_18:1 16919 18.533 782.60876 [M-H]- NEGATIVE adduct linked to 14847_[M-2H]- 0.741 TRUE 13.05 782.60687 C45H86NO7P EtherPE VUPSAIIDYHGNAU-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE O-33:2|PE O-16:1_17:1 13627 14.592 686.51508 [M-H]- NEGATIVE 0.81 TRUE 10.01 686.513 C38H74NO7P EtherPE AUVOXOHIAIQYLU-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCC PE O-30:1|PE O-16:1_14:0 12354 13.445 646.48346 [M-H]- NEGATIVE similar chromatogram in higher mz_22086; similar chromatogram in higher mz_18843; similar chromatogram in higher mz_18082 0.81 TRUE 9.14 646.48169 C35H70NO7P EtherPE RMKKROAVVNFRJY-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCC PE O-37:5|PE O-17:1_20:4 15349 14.546 736.5304 [M-H]- NEGATIVE 0.81 TRUE 10.15 736.52869 C42H76NO7P EtherPE SUCZWPZZJOWHRI-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC PE O-45:5|PE O-25:1_20:4 18920 18.233 848.65906 [M-H]- NEGATIVE ion correlated with 19553 0.052 TRUE 13.09 848.65387 C50H92NO7P EtherPE NBDULLQDBAHHIL-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC PE O-34:1|PE O-18:1_16:0 14183 16.889 702.54584 [M-H]- NEGATIVE adduct linked to 16357_[M+FA-H]- 0.793 TRUE 11.17 702.54431 C39H78NO7P EtherPE HEASGCOZOMIKFU-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC PE O-34:3|PE O-16:1_18:2 14044 14.183 698.51471 [M-H]- NEGATIVE similar chromatogram in higher mz_18392; similar chromatogram in higher mz_23389 0.845 TRUE 9.8 698.513 C39H74NO7P EtherPE LJVXDBWIBQQKFU-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC PE O-34:5|PE O-14:1_20:4 13906 12.168 694.48419 [M-H]- NEGATIVE 0.81 TRUE 9 694.48169 C39H70NO7P EtherPE JFCWDSVCBUBNNJ-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC PE O-34:2|PE O-16:1_18:1 14114 15.43 700.53131 [M-H]- NEGATIVE adduct linked to 23170_[2M-H]-; similar chromatogram in higher mz_16904; similar chromatogram in higher mz_22935; similar chromatogram in higher mz_23207; found in higher mz's MsMs_23170; found in higher mz's MsMs_16904; similar chromatogram in higher mz_22295; similar chromatogram in higher mz_20790 0.983 TRUE 10.41 700.52869 C39H76NO7P EtherPE ZVVYJAAMWXATNY-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE O-42:6|PE O-22:2_20:4 17607 17.356 804.59229 [M-H]- NEGATIVE ion correlated with 18533; adduct linked to 19351_[M+Hac-H]- 0.81 TRUE 12.36 804.59131 C47H84NO7P EtherPE SYZKTPNEFMFVSV-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC PE O-32:3|PE O-16:2_16:1 13093 12.176 670.48334 [M-H]- NEGATIVE ion correlated with 13765; similar chromatogram in higher mz_19741 0.81 TRUE 9.01 670.48169 C37H70NO7P EtherPE WZASOWGYTFVEQY-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCC=CCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCC PE O-40:8|PE O-20:4_20:4 16525 13.577 772.53021 [M-H]- NEGATIVE adduct linked to 15008_[M-H]- 0.672 TRUE 10.06 772.52869 C45H76NO7P EtherPE OHLCERCNAUUADO-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCC=CCC=CCC=CCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC PE O-40:5|PE O-18:1_22:4 16786 16.881 778.57812 [M-H]- NEGATIVE ion correlated with 14183 0.81 TRUE 11.61 778.57562 C45H82NO7P EtherPE YARMYJKPPFMPIW-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCC=CCC=CCC=CCC=CCC PE O-36:1|PE O-16:1_20:0 15153 18.453 730.57672 [M-H]- NEGATIVE similar chromatogram in higher mz_22799 0.224 TRUE 12.57 730.57562 C41H82NO7P EtherPE LGFRBARRRZCSBV-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCCCCCCCCC PE O-38:2|PE O-16:1_22:1 16049 18.562 756.59296 [M-H]- NEGATIVE 0.19 TRUE 12.82 756.59131 C43H84NO7P EtherPE OSDKOUUHCQCQEG-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCCCC=CCCCCCCCC PE O-44:6|PE O-24:2_20:4 18474 18.779 832.62451 [M-H]- NEGATIVE 0.81 TRUE 12.82 832.62262 C49H88NO7P EtherPE PKINGLCDNYVYIK-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCC=CCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC PE O-36:4|PE O-16:1_20:3_B 14936 15.198 724.52948 [M-H]- NEGATIVE similar chromatogram in higher mz_22485; adduct linked to 15438_[M+Hac-H]-; similar chromatogram in higher mz_16317; similar chromatogram in higher mz_17479; similar chromatogram in higher mz_16753 0.741 TRUE 10.28 724.52869 C41H76NO7P EtherPE FUKISTPVIDDUQU-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCCCC=CCC=CCC=CCC PE O-42:7|PE O-20:1_22:6 17544 17.097 802.57574 [M-H]- NEGATIVE adduct linked to 16976_[M-H2O-H]- 0.81 TRUE 11.61 802.57562 C47H82NO7P EtherPE GWWKPJFGKBNJDJ-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC PE O-40:5|PE O-20:1_20:4 16785 17.403 778.57788 [M-H]- NEGATIVE adduct linked to 15573_[M-H]- 0.81 TRUE 12.1 778.57562 C45H82NO7P EtherPE QVNQNWKELAFJOX-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC PE O-42:3|PE O-24:2_18:1 17835 19.855 810.6402 [M-H]- NEGATIVE similar chromatogram in higher mz_20029 0.81 TRUE 13.2 810.63818 C47H90NO7P EtherPE VWOWHNPNQLTDRV-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCC=CCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC PE O-36:5|PE O-16:1_20:4_B 14866 14.316 722.51501 [M-H]- NEGATIVE 0.81 TRUE 9.73 722.513 C41H74NO7P EtherPE YITZQGLIICATLN-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC PE O-38:4|PE O-18:0_20:4 15919 16.051 752.56226 [M-H]- NEGATIVE adduct linked to 13704_[M-H2O-H]- 0.81 TRUE 11.26 752.56 C43H80NO7P EtherPE RXEVLILBESBJQS-UHFFFAOYSA-N O=C(OC(COCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCCCCCC=CCC=CCC=CCC=CCC PE O-40:7|PE O-18:1_22:6 16629 15.448 774.54626 [M-H]- NEGATIVE similar chromatogram in higher mz_19898 0.862 TRUE 10.18 774.54431 C45H78NO7P EtherPE FIJFPUAJUDAZEY-UHFFFAOYSA-N O=C(OC(COC=CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN)CCC=CCC=CCC=CCC=CCC=CCC=CCC DMPE 36:1|DMPE 18:0_18:1 16536 15.941 772.58685 [M-H]- NEGATIVE ion correlated with 17573; ion correlated with 17545; ion correlated with 3431; found in higher mz's MsMs_18859; found in higher mz's MsMs_18471 0.397 TRUE 11.03 772.58618 C43H84NO8P DMPE JPXWWRACEORTKX-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN(C)C)CCCCCCCCCCCCCCCCC DMPE 34:2|DMPE 16:1_18:1 15562 12.74 742.54004 [M-H]- NEGATIVE adduct linked to 17540_[M+HCOO]-; similar chromatogram in higher mz_15606; found in higher mz's MsMs_17540; adduct linked to 15226_[M+Cl]- 0.81 TRUE 9.38 742.53918 C41H78NO8P DMPE IAYTZZZFSDDELX-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN(C)C)CCCCCCCC=CCCCCCC DMPE 36:2|DMPE 18:1_18:1 16480 14.412 770.57446 [M-H]- NEGATIVE ion correlated with 13625; found in higher mz's MsMs_18791; found in higher mz's MsMs_18403; adduct linked to 14419_[M-2H]- 0.638 TRUE 10.09 770.5705 C43H82NO8P DMPE XHPZRQBHFOVLEJ-UHFFFAOYSA-N O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCCN(C)C)CCCCCCCC=CCCCCCCCC Cer 34:2;2O|Cer 18:2;2O/16:0 9079 12.538 534.49097 [M-H]- NEGATIVE adduct linked to 9972_[M+Cl]-; adduct linked to 10217_[M+FA-H]-; adduct linked to 10621_[M+Hac-H]-; found in higher mz's MsMs_10621; found in higher mz's MsMs_10217; similar chromatogram in higher mz_21965 0.81 TRUE 8.95 534.4892 C34H65NO3 Cer_NS GMWIWVUTMCBDSP-UHFFFAOYSA-N O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCCCCC Cer 36:1;2O|Cer 18:1;2O/18:0 9788 15.815 564.53754 [M-H]- NEGATIVE ion correlated with 11168; adduct linked to 10755_[M+Cl]-; adduct linked to 11579_[M+Hac-H]-; found in higher mz's MsMs_11579; found in higher mz's MsMs_11168; found in higher mz's MsMs_10755; similar chromatogram in higher mz_18409 0.81 TRUE 10.71 564.53607 C36H71NO3 Cer_NS VODZWWMEJITOND-UHFFFAOYSA-N O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCC Cer 42:2;2O|Cer 18:1;2O/24:1 12370 18.926 646.61584 [M-H]- NEGATIVE adduct linked to 13857_[M+FA-H]-; adduct linked to 14313_[M+Hac-H]-; adduct linked to 13496_[M+Cl]- 0.845 TRUE 13.03 646.61438 C42H81NO3 Cer_NS HZPUWSUHFOTSAY-UHFFFAOYSA-N O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCC=CCCCCCCCCCC Cer 38:1;2O|Cer 18:1;2O/20:0 10579 17.492 592.5686 [M-H]- NEGATIVE adduct linked to 11688_[M+Cl]-; adduct linked to 12116_[M+FA-H]-; adduct linked to 12537_[M+Hac-H]-; found in higher mz's MsMs_12537; found in higher mz's MsMs_12116 0.81 TRUE 12.05 592.56738 C38H75NO3 Cer_NS XWBWIAOWSABHFI-UHFFFAOYSA-N O=C(NC(CO)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCC Cer 42:3;2O|Cer 18:2;2O/24:1 12311 17.799 644.60004 [M-H]- NEGATIVE ion correlated with 18244; ion correlated with 13781; adduct linked to 13430_[M+Cl]-; adduct linked to 13781_[M+FA-H]-; adduct linked to 14264_[M+Hac-H]-; similar chromatogram in higher mz_14351; similar chromatogram in higher mz_15010; similar chromatogram in higher mz_19420; similar chromatogram in higher mz_20222; similar chromatogram in higher mz_14933 0.81 TRUE 12.67 644.59869 C42H79NO3 Cer_NS RYZWCKUTHDRXFD-UHFFFAOYSA-N O=C(NC(CO)C(O)C=CCCC=CCCCCCCCCC)CCCCCCCCCCCC=CCCCCCCCCCC Cer 42:1;2O|Cer 18:0;2O/24:1 12432 19.415 648.63049 [M-H]- NEGATIVE ion correlated with 13919; adduct linked to 13571_[M+Cl]-; adduct linked to 13919_[M+FA-H]-; adduct linked to 14388_[M+Hac-H]-; found in higher mz's MsMs_13919 0.776 TRUE 13.22 648.63 C42H83NO3 Cer_NDS WLDYKNUYRLBSJM-UHFFFAOYSA-N O=C(NC(CO)C(O)CCCCCCCCCCCCCCC)CCCCCCCCCCCC=CCCCCCCCCCC Cer 42:0;2O|Cer 18:0;2O/24:0 12491 20.849 650.64685 [M-H]- NEGATIVE adduct linked to 13639_[M+Cl]-; adduct linked to 13987_[M+FA-H]-; adduct linked to 14477_[M+Hac-H]- 0.931 TRUE 13.42 650.64569 C42H85NO3 Cer_NDS BPLYVSYSBPLDOA-UHFFFAOYSA-N O=C(NC(CO)C(O)CCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCC Cer 44:1;2O|Cer 18:0;2O/26:1 13321 20.713 676.66248 [M-H]- NEGATIVE ion correlated with 14622; ion correlated with 14885; adduct linked to 15370_[M+Hac-H]-; similar chromatogram in higher mz_15481; similar chromatogram in higher mz_16109; adduct linked to 14885_[M+FA-H]- 0.776 TRUE 13.49 676.66132 C44H87NO3 Cer_NDS RAJZZVUBSHAQSL-UHFFFAOYSA-N O=C(NC(CO)C(O)CCCCCCCCCCCCCCC)CCCCCCCCCCCCCC=CCCCCCCCCCC METABOLITES_END #END