#METABOLOMICS WORKBENCH shancock_20250219_181739 DATATRACK_ID:5650 STUDY_ID:ST003760 ANALYSIS_ID:AN006174 PROJECT_ID:PR002343
VERSION             	1
CREATED_ON             	February 20, 2025, 2:06 pm
#PROJECT
PR:PROJECT_TITLE                 	Untargeted lipidomics of combination gemcitabine/paclitaxel attenuated (CombAT)
PR:PROJECT_TITLE                 	PDAC cells
PR:PROJECT_SUMMARY               	Pancreatic ductal adenocarcinoma (PDAC) is a highly aggressive disease with few
PR:PROJECT_SUMMARY               	treatment options and poor survivability. In this work we sought to characterise
PR:PROJECT_SUMMARY               	metabolic adaptations to gemcitabine (GEMC)-based chemotherapy exposure to
PR:PROJECT_SUMMARY               	discover new therapeutic targets for improving treatment efficacy. This project
PR:PROJECT_SUMMARY               	examined the impact of combination gemcitabine/paclitaxel resistance on the
PR:PROJECT_SUMMARY               	lipidomics of Panc1 and MiaPaCa2 PDAC cell lines, finding upregulated de novo
PR:PROJECT_SUMMARY               	lipogenesis in both cell lines.
PR:INSTITUTE                     	Victor Chang Cardiac Research Institute
PR:LAST_NAME                     	Hancock
PR:FIRST_NAME                    	Sarah
PR:ADDRESS                       	Level 7 Lowy Packer Building, 405 Liverpool Street, Darlinghurst, NSW 2010,
PR:ADDRESS                       	Australia
PR:EMAIL                         	s.hancock@victorchang.edu.au
PR:PHONE                         	+61414537526
#STUDY
ST:STUDY_TITLE                   	Untargeted lipidomics of combination gemcitabine/paclitaxel attenuated (CombAT)
ST:STUDY_TITLE                   	PDAC cells
ST:STUDY_SUMMARY                 	In this work produced combination gemcitabine/paclitaxel attenuated (CombAT)
ST:STUDY_SUMMARY                 	Panc1 and MiaPaCa3 cells, and used untargeted lipidomics to profiled changes in
ST:STUDY_SUMMARY                 	their lipidome. This dataset includes CombAT cells and control (CON) cells,
ST:STUDY_SUMMARY                 	alongside internal quality controls (iQC) and blank samples for background
ST:STUDY_SUMMARY                 	subtraction (as described under sample prep). These data revealed extensive
ST:STUDY_SUMMARY                 	increases across 166 lipid species in Panc1 CombAT cell lines compared with CON,
ST:STUDY_SUMMARY                 	including increases in many triacylglycerol (TG) species and total TG. Increases
ST:STUDY_SUMMARY                 	were also seen in several TG species in CombAT MiaPaCa2 cells, with 30 lipid
ST:STUDY_SUMMARY                 	species increased in total when compared with CON. Data were analysed using
ST:STUDY_SUMMARY                 	MS-DIAL v4.9.
ST:INSTITUTE                     	Victor Chang Cardiac Research Institute
ST:LAST_NAME                     	Hancock
ST:FIRST_NAME                    	Sarah
ST:ADDRESS                       	Level 7 Lowy Packer Building, 405 Liverpool Street, Darlinghurst, NSW 2010,
ST:ADDRESS                       	Australia
ST:EMAIL                         	s.hancock@victorchang.edu.au
ST:PHONE                         	+61414537526
#SUBJECT
SU:SUBJECT_TYPE                  	Cultured cells
SU:SUBJECT_SPECIES               	Homo sapiens
SU:TAXONOMY_ID                   	9606
#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           	-	Blank_Neg	Sample source:Blank | group:Blank	RAW_FILE_NAME(Raw file name)=Blank_Neg.raw; protein amount=-
SUBJECT_SAMPLE_FACTORS           	-	Blank_Neg_20220922100435	Sample source:Blank | group:Blank	RAW_FILE_NAME(Raw file name)=Blank_Neg_20220922100435.raw; protein amount=-
SUBJECT_SAMPLE_FACTORS           	-	Blank_Pos	Sample source:Blank | group:Blank	RAW_FILE_NAME(Raw file name)=Blank_Pos.raw; protein amount=-
SUBJECT_SAMPLE_FACTORS           	-	Blank_Pos_20220922093322	Sample source:Blank | group:Blank	RAW_FILE_NAME(Raw file name)=Blank_Pos_20220922093322.raw; protein amount=-
SUBJECT_SAMPLE_FACTORS           	-	IQC_Neg_Start	Sample source:pool | group:iQC	RAW_FILE_NAME(Raw file name)=IQC_Neg_Start.raw; protein amount=-
SUBJECT_SAMPLE_FACTORS           	-	IQC_Neg_Start_20220922110658	Sample source:pool | group:iQC	RAW_FILE_NAME(Raw file name)=IQC_Neg_Start_20220922110658.raw; protein amount=-
SUBJECT_SAMPLE_FACTORS           	-	IQC_Pos_Start	Sample source:pool | group:iQC	RAW_FILE_NAME(Raw file name)=IQC_Pos_Start.raw; protein amount=-
SUBJECT_SAMPLE_FACTORS           	-	IQC_Pos_Start_20220922103547	Sample source:pool | group:iQC	RAW_FILE_NAME(Raw file name)=IQC_Pos_Start_20220922103547.raw; protein amount=-
SUBJECT_SAMPLE_FACTORS           	-	M8C_41_Neg	Sample source:MiaPaCa2 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=M8C_41_Neg.raw; protein amount=81.83384
SUBJECT_SAMPLE_FACTORS           	-	M8C_41_Pos	Sample source:MiaPaCa2 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=M8C_41_Pos.raw; protein amount=81.83384
SUBJECT_SAMPLE_FACTORS           	-	M8C_43_Neg	Sample source:MiaPaCa2 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=M8C_43_Neg.raw; protein amount=62.98929
SUBJECT_SAMPLE_FACTORS           	-	M8C_43_Pos	Sample source:MiaPaCa2 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=M8C_43_Pos.raw; protein amount=62.98929
SUBJECT_SAMPLE_FACTORS           	-	M8C_57_Neg	Sample source:MiaPaCa2 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=M8C_57_Neg.raw; protein amount=101.68031
SUBJECT_SAMPLE_FACTORS           	-	M8C_57_Pos	Sample source:MiaPaCa2 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=M8C_57_Pos.raw; protein amount=101.68031
SUBJECT_SAMPLE_FACTORS           	-	MiaPaCa-2_34_Neg	Sample source:MiaPaCa2 cells | group:CON	RAW_FILE_NAME(Raw file name)=MiaPaCa-2_34_Neg.raw; protein amount=79.05266
SUBJECT_SAMPLE_FACTORS           	-	MiaPaCa-2_34_Pos	Sample source:MiaPaCa2 cells | group:CON	RAW_FILE_NAME(Raw file name)=MiaPaCa-2_34_Pos.raw; protein amount=79.05266
SUBJECT_SAMPLE_FACTORS           	-	MiaPaCa-2_36_Neg	Sample source:MiaPaCa2 cells | group:CON	RAW_FILE_NAME(Raw file name)=MiaPaCa-2_36_Neg.raw; protein amount=61.26514
SUBJECT_SAMPLE_FACTORS           	-	MiaPaCa-2_36_Pos	Sample source:MiaPaCa2 cells | group:CON	RAW_FILE_NAME(Raw file name)=MiaPaCa-2_36_Pos.raw; protein amount=61.26514
SUBJECT_SAMPLE_FACTORS           	-	MiaPaCa-2_57_Neg	Sample source:MiaPaCa2 cells | group:CON	RAW_FILE_NAME(Raw file name)=MiaPaCa-2_57_Neg.raw; protein amount=75.58103
SUBJECT_SAMPLE_FACTORS           	-	MiaPaCa-2_57_Pos	Sample source:MiaPaCa2 cells | group:CON	RAW_FILE_NAME(Raw file name)=MiaPaCa-2_57_Pos.raw; protein amount=75.58103
SUBJECT_SAMPLE_FACTORS           	-	P28C_55_Neg	Sample source:Panc1 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=P28C_55_Neg.raw; protein amount=66.71797
SUBJECT_SAMPLE_FACTORS           	-	P28C_55_Pos	Sample source:Panc1 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=P28C_55_Pos.raw; protein amount=66.71797
SUBJECT_SAMPLE_FACTORS           	-	P28C_56_Neg	Sample source:Panc1 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=P28C_56_Neg.raw; protein amount=57.54543
SUBJECT_SAMPLE_FACTORS           	-	P28C_56_Pos	Sample source:Panc1 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=P28C_56_Pos.raw; protein amount=57.54543
SUBJECT_SAMPLE_FACTORS           	-	P28C_57_Neg	Sample source:Panc1 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=P28C_57_Neg.raw; protein amount=92.50384
SUBJECT_SAMPLE_FACTORS           	-	P28C_57_Pos	Sample source:Panc1 cells | group:CombAT	RAW_FILE_NAME(Raw file name)=P28C_57_Pos.raw; protein amount=92.50384
SUBJECT_SAMPLE_FACTORS           	-	Panc-1_33_Neg	Sample source:Panc1 cells | group:CON	RAW_FILE_NAME(Raw file name)=Panc-1_33_Neg.raw; protein amount=102.66325
SUBJECT_SAMPLE_FACTORS           	-	Panc-1_33_Pos	Sample source:Panc1 cells | group:CON	RAW_FILE_NAME(Raw file name)=Panc-1_33_Pos.raw; protein amount=102.66325
SUBJECT_SAMPLE_FACTORS           	-	Panc-1_34_Neg	Sample source:Panc1 cells | group:CON	RAW_FILE_NAME(Raw file name)=Panc-1_34_Neg.raw; protein amount=77.17731
SUBJECT_SAMPLE_FACTORS           	-	Panc-1_34_Pos	Sample source:Panc1 cells | group:CON	RAW_FILE_NAME(Raw file name)=Panc-1_34_Pos.raw; protein amount=77.17731
SUBJECT_SAMPLE_FACTORS           	-	Panc-1_35_Neg	Sample source:Panc1 cells | group:CON	RAW_FILE_NAME(Raw file name)=Panc-1_35_Neg.raw; protein amount=57.68309
SUBJECT_SAMPLE_FACTORS           	-	Panc-1_35_Pos	Sample source:Panc1 cells | group:CON	RAW_FILE_NAME(Raw file name)=Panc-1_35_Pos.raw; protein amount=57.68309
#COLLECTION
CO:COLLECTION_SUMMARY            	Samples were obtained from established immortalised adherent human pancreatic
CO:COLLECTION_SUMMARY            	ductal adenocarcinoma cells (Panc1 & MiaPaCa2). Cells were cultured in high
CO:COLLECTION_SUMMARY            	glucose DMEM containing 4.5 g/L glucose and 4 mM glutamine and were supplemented
CO:COLLECTION_SUMMARY            	with 10% FCS. Cells were cultured under 5% CO2 at 37ºC and routinely passaged
CO:COLLECTION_SUMMARY            	every 2-3 days (when ~80-90% confluent). Cell lines were regularly screened for
CO:COLLECTION_SUMMARY            	mycoplasma infection.
CO:SAMPLE_TYPE                   	Pancreas
#TREATMENT
TR:TREATMENT_SUMMARY             	Combination gemcitabine/paclitaxel attenuated (CombAT) cells were produced by
TR:TREATMENT_SUMMARY             	serial treatment with escalating doses of gemcitabine/paclitaxel (10:1) for
TR:TREATMENT_SUMMARY             	approximately 12 weeks. The final concentration of gemcitabine for Panc1 cells
TR:TREATMENT_SUMMARY             	was 28 nM (2.8 nM paclitaxel), and 8 nM (0.8 nM paclitaxel) for MiaPaCa2 cells.
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Lipids were extracted from cells grown to 80-90% confluency in 6 well plates
SP:SAMPLEPREP_SUMMARY            	using a modified methyl tert-butyl ether (MTBE) method. Adherent cells were
SP:SAMPLEPREP_SUMMARY            	washed with ice-cold PBS and scraped into methanol containing 0.01% butylated
SP:SAMPLEPREP_SUMMARY            	hydroxytoluene and 100 pmol each of internal standards (phosphatidylcholine
SP:SAMPLEPREP_SUMMARY            	19:0/19:0, phosphatidylethanolamine 17:0/17:0, phosphatidylserine 17:0/17:0,
SP:SAMPLEPREP_SUMMARY            	lysophosphatidylcholine 17:0, lysophosphatidylethanolamine 14:0,
SP:SAMPLEPREP_SUMMARY            	phosphatidylglycerol 17:0/17:0, phosphatidic acid 17:0/17:0, ceramide
SP:SAMPLEPREP_SUMMARY            	d18:1/17:0, dihydrosphingomyelin 12:0, cholesteryl ester 22:1, diacylglycerol
SP:SAMPLEPREP_SUMMARY            	17:0/17:0, D5-triacylglycerol 16:0/16:0/16:0 and cardiolipin
SP:SAMPLEPREP_SUMMARY            	14:0/14:0/14:0/14:0). An empty well was also scraped for use in background
SP:SAMPLEPREP_SUMMARY            	subtraction. To this, MTBE was added at a ratio of 3:1 v/v, and extracts were
SP:SAMPLEPREP_SUMMARY            	rotated overnight at 4ºC. Following overnight rotation, 1 part of ice-cold 150
SP:SAMPLEPREP_SUMMARY            	mM ammonium acetate was added, samples were vortexed vigorously and centrifuged
SP:SAMPLEPREP_SUMMARY            	at 2000 x g for 5 min. The upper organic phase containing lipids was transferred
SP:SAMPLEPREP_SUMMARY            	into a 1.5 mL autosampler vial and dried under N2 at 37ºC Dried lipids were
SP:SAMPLEPREP_SUMMARY            	reconstituted in chloroform:methanol:water (60:30:4.5 v/v/v), transferred to a
SP:SAMPLEPREP_SUMMARY            	sleeved vial, and stored at -20ºC until analysis. The aqueous phase containing
SP:SAMPLEPREP_SUMMARY            	the protein pellet was dried under N2 and digested with 1M NaOH overnight at
SP:SAMPLEPREP_SUMMARY            	4ºC. Digested protein was diluted 1:2 v/v with water and protein concentration
SP:SAMPLEPREP_SUMMARY            	was determined using a Pierce BCA assay kit (ThermoFisher Scientific)
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
CH:INSTRUMENT_NAME               	Thermo Dionex Ultimate 3000
CH:COLUMN_NAME                   	Waters ACQUITY UPLC CSH C18 (100 x 2.1mm,1.7um)
CH:SOLVENT_A                     	Acetonitrile:water (3:2 v/v), 10 mM Ammonium Formate, 0.1% Formic acid
CH:SOLVENT_B                     	Acetonitrile:isopropanol (1:9 v/v), 10 mM Ammonium Formate, 0.1% Formic acid
CH:FLOW_GRADIENT                 	As described by Hu et al. 2008 J Proteome Research
CH:FLOW_RATE                     	0.26 ml/min
CH:COLUMN_TEMPERATURE            	60
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Thermo Q Exactive HF hybrid Orbitrap
MS:INSTRUMENT_TYPE               	Orbitrap
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	POSITIVE
MS:MS_COMMENTS                   	Source conditions were as follows: a spray voltage 4.0 kV in positive ion mode
MS:MS_COMMENTS                   	and 3.5 kV in negative ion mode, capillary temperature 290°C, S lens RF 50, and
MS:MS_COMMENTS                   	auxiliary gas heater temperature of 250°C. Nitrogen was used as both source and
MS:MS_COMMENTS                   	collision gas, with the sheath gas flow rate set at 20 and the auxiliary gas
MS:MS_COMMENTS                   	flow rate at 5 (arbitrary units). Data were acquired in full scan/data-dependent
MS:MS_COMMENTS                   	MS2 mode (full-scan resolution 70,000 FWHM, max ion injection time 50 ms, scan
MS:MS_COMMENTS                   	range m/z 200–1,500), with the 10 most abundant ions being subjected to
MS:MS_COMMENTS                   	collision-induced dissociation using an isolation window of 1.5 Da and a
MS:MS_COMMENTS                   	normalized stepped collision energy of 15/27 eV. Product ions were detected at a
MS:MS_COMMENTS                   	resolution of 17,500. An exclusion list for background ions was developed using
MS:MS_COMMENTS                   	extraction blanks, and mass calibration was performed in both positive and
MS:MS_COMMENTS                   	negative ionization modes before analysis to ensure mass accuracy of 5 ppm in
MS:MS_COMMENTS                   	full-scan mode.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	nmol/mg protein
MS_METABOLITE_DATA_START
Samples	M8C_41_Pos	M8C_43_Pos	M8C_57_Pos	MiaPaCa-2_34_Pos	MiaPaCa-2_36_Pos	MiaPaCa-2_57_Pos	P28C_55_Pos	P28C_56_Pos	P28C_57_Pos	Panc-1_33_Pos	Panc-1_34_Pos	Panc-1_35_Pos
Factors	Sample source:MiaPaCa2 cells | group:CombAT	Sample source:MiaPaCa2 cells | group:CombAT	Sample source:MiaPaCa2 cells | group:CombAT	Sample source:MiaPaCa2 cells | group:CON	Sample source:MiaPaCa2 cells | group:CON	Sample source:MiaPaCa2 cells | group:CON	Sample source:Panc1 cells | group:CombAT	Sample source:Panc1 cells | group:CombAT	Sample source:Panc1 cells | group:CombAT	Sample source:Panc1 cells | group:CON	Sample source:Panc1 cells | group:CON	Sample source:Panc1 cells | group:CON
CE 18:1	10.83119152395439	17.034464806687783	23.62144817718845	2.4914414897029347	13.284490228266547	11.90262509195806	11.294591164862195	14.524028090732903	1.6539485625404393	1.131654269413661	1.8501245262319392	1.2273172882644576
CE 18:2	13.261853689383932	17.25470155672989	32.608486336601494	4.232523969691893	32.38889747300306	19.758296831653233	23.890637076426305	27.237520382418552	4.265741551310707	16.11091762736385	19.958562691506213	24.675453564165377
CE 20:1	1.9534347423834866	2.6963116350558125	2.0119486561663833	0.3000198872221497	1.6132635139565736	1.670207704756243	1.9555210613111091	2.2022928591308677	0.3000176204481801	0.047287273	0.18367833410197765	0
CE 20:2	6.449186590292719	10.216199958457988	11.62496216912075	1.4095797961796288	9.164728462	8.196731423651782	6.232970513121409	9.574157667186144	1.0407047093392583	0.256127463	0.8814176897851641	0.3450557371065531
CE 20:3	1.7890220163347224	2.7777134384497177	3.8311951988172113	0.4947618247314285	2.0796388305678235	2.1153344170146045	2.3685320394636946	2.893244533873658	0.35630430794345075	0.37556663587035327	0.7035131541874048	0.5844727723838232
CE 20:4	3.468429510523266	4.777464768045733	3.5971262183264843	0.7550508566236137	6.061690541835053	3.6439826638140387	4.653058813649281	6.603480254018294	0.8842925838915358	1.7931017726079392	2.451656962458389	2.5106554348609493
CE 22:2	1.3872714786283353	2.1694283401214935	0	0.2662783202130662	1.3646076153721807	1.5394103551899216	0	1.2540631735042653	0	0	0	0
CE 22:6	0.3836540788036021	0.5606481930004032	0.32844379630449444	0.10585044506458444	0.2663180324451661	0.4044078940967147	0.3548690724177792	0.7665386575820404	0.0487854	0.14144997518084923	0.6785207701324625	0.22956546657709606
CE 24:1	1.7228294274674127	1.9581730613546424	1.2821961200106686	0.22639451571975128	1.6445729564230513	1.246363770365625	2.3179909566211423	2.524470715	0.33499834055634636	0.085426151	0.20298805364451647	0
CE 26:1	1.120940038540376	1.710044832092188	1.2092324530904315	0.2655114655459794	1.6879584925328273	1.2923048997537472	1.6116037696273713	2.1521919554084055	0.28229474754797274	0.040196248	0.11298477640583289	0
CE 26:2	2.0446402171269105	2.981247633481773	1.8830206596235255	0.39630623590702824	2.802489663226267	2.1505871994702397	2.732818107860407	2.6954492977550255	0.42250144909497717	0.10057973245027155	0.23653931474180406	0
CE 26:5	0	0.14804068042745364	0	0	0	0	0.48129154246757455	0.5029367820637989	0	0.9046823609086359	1.1171991378132786	1.3815045610338248
CE 28:5	0	0	0	0	0	0	0.055870437649005004	0	0.013652087	0.5975969658711234	1.013483311767122	1.3357419672786794
Cer 16:1;2O/23:0	0.15280085642316377	0.14798838597383676	0.092761606	0.12926647739731226	0.21798149627903812	0.1438388558233981	0.13379803637156318	0.11453536708476358	0.094244724	0.014589278904776707	0.012237580991936886	0.018284604831888457
Cer 16:1;2O/24:1	0.43926170191130653	0.43083046577826145	0.36673625343886795	0.2767539444361002	0.3394479757082635	0.288601211	0.32756337061972873	0.3364368995940803	0.30288540425132715	0.1015815243442892	0.1465443224224329	0.13783366569322197
Cer 17:1;2O/24:1	0.19968175844213024	0.19230426997275096	0.16418579116007884	0.12238258070451805	0.19266956212905015	0.11716448377059858	0.15077796675856006	0	0.1330758311388795	0	0.056826145583443156	0.058244503176903266
Cer 18:0;2O/16:0	0.8882773954340552	0.86884528	0.6791065624589493	0.7487273494125579	1.1518417792391646	0.9558856861395968	0.5900945699090286	0.5668119160872567	0.4508844206543502	0.071162817	0	0
Cer 18:0;2O/18:0	0.15836034279614444	0.20840086536891567	0.12378730972752464	0.19204815111871176	0.29074120051118724	0.20355746894176718	0.11767022143477669	0	0.098119626	0	0	0
Cer 18:0;2O/22:0	0.07026033	0.094379931	0.052979062	0.070830096	0.12155462968229183	0.082037511	0.04843826	0.043435883	0.026597296	0.003463771	0.00562884	0.002089261
Cer 18:0;2O/24:0	0.085808758	0.1450110929422466	0	0.052911202	0.09721084	0.050688848	0.058258272	0.086847182	0	0	0	0
Cer 18:1;2O/14:0	0.2821207707746494	0.2907498610799254	0.26104385616522807	0.16436047255613148	0.31130786574306474	0.20763087898944496	0.2490043678128754	0.26750679046878656	0.23812163688770194	0.085343718	0.11242756070163631	0.15863178022378155
Cer 18:1;2O/16:0	0	0.26700917552168846	0	0	0	0	0	0.7694836451068737	1.5053642285238011	0	0	0
Cer 18:1;2O/18:0	1.5535736415539478	1.684057004492481	1.0605249338974756	1.107339981361124	1.6864616736403377	1.1614395597936813	0.9189754545161158	1.0484816455676613	0.7528274511255982	0.046581827786877604	0.047381767	0.050995812
Cer 18:1;2O/20:0	0.26278835729331457	0.2569081894666589	0.1735780002785046	0.22505080383884885	0.26219859893910513	0.18530012290828815	0.16796617459701518	0.17991997692344902	0.1237507234874548	0.017526208074306937	0.019692731	0
Cer 18:1;2O/22:0	0.9848533980265574	1.0359126523755546	0.6337244607010738	0.8322474163040103	1.1801226191594698	0.770163252	0.6557872745634312	0.6347871787883451	0.38780549156313326	0.15505421230247546	0.1457652704655164	0.152140486
Cer 18:1;2O/23:0	0.8782075332478788	1.0663860918624783	0.6620678902588091	0.8406511821974061	1.1777237604373807	0.7514242790566589	0.7033296324282304	0.7218777110168946	0.40340699678186526	0.10214665175256425	0.087054237	0.10823733165328846
Cer 18:1;2O/24:0	2.9207240696217935	3.3861057168910187	2.168009590104234	2.2240895440005937	3.3395279452875792	2.185854658768722	2.0828587649473254	2.213678267	1.0956552949952365	0.7073394590827983	0.5828142232344545	0.6455379347054422
Cer 18:1;2O/24:1	7.207375103446525	8.372455155131359	4.772302175	4.263100903659732	6.453881600370373	4.350542000157313	4.867477344047318	5.016733650034268	3.635867243116561	1.5310848399834693	1.820878520978519	1.9220781651326881
Cer 18:1;2O/24:2	1.7199134199074309	1.7967755667502843	1.5046420921066317	0.8778863667505199	1.2422025223321698	0.9626464086294974	1.2224687650092376	1.211644445298638	1.022879254061778	0.42502022820625923	0.5834034920901124	0.7144373280538996
Cer 18:1;2O/25:0	0.13296359858084647	0.1577580078320637	0.068126879	0.11476998878949957	0.173820734	0.11164341710656243	0.11218829178236792	0.12139874160287309	0.065510896	0.032835825	0.016530072702311376	0.020256481
Cer 18:1;2O/25:1	0.079283809	0.09293897	0.0596537	0.056365815	0.081876216	0.053332908	0.055055516	0.058008525	0.034271905	0.014936274608544544	0.013103780988338715	0.015653389
Cer 18:1;2O/26:0	0.24252807399869789	0.25143826850881607	0.15452754048214204	0.20910208332293415	0.2296908319533564	0.1693259206473804	0.11204472506274095	0.12216598256763589	0.071635082	0.031531498518037465	0.021974164	0.023925120338625802
Cer 18:1;2O/26:1	0.44306215922762704	0.64010367671488555	0.39405319946592127	0.34962416580081673	0.5446170994285682	0.35078399606347865	0.28951326414377726	0.36328849925644247	0.18564474191456865	0.068679734	0.055699317	0.061193167
Cer 18:1;2O/26:2	0.16708879327206405	0.19680571570762284	0.18234437203109727	0.099943618	0.1584478061701109	0.11248616363985862	0.11302205545211287	0.11213992926362112	0.079087274	0.040835923	0.041961008270954545	0
Cer 18:2;2O/18:0	0.2494547574349748	0.2127616575605364	0.19050108749307074	0.10963702782372975	0.17536688301611028	0.13565011377556685	0.13770820795213662	0.1415467874770574	0.13391024642789912	9.306266606546536e-4	0.004576045	0
Cer 18:2;2O/23:0	0.092291156	0.1060075701859632	0.062234746	0.066995688	0.091916643	0.073791327	0.081086296	0	0.071257577	0	0.030857704	0.031364228
Cer 18:2;2O/26:1	0.14561219751904655	0.19417336988504053	0.15399023279561438	0.084829305	0.14208666445760754	0.075565732	0.098237015	0.09018773	0.078744465	0.038088384803746524	0.032340079	0.038944723668760235
DG 16:0_16:0	0.8297817511754996	1.000390090390169	0.6665052922635006	0.8612669452672215	0.8034973078104671	0.7163805671248366	1.152894488127519	1.2742146653366144	0.7091256499492212	0.5807190856357123	0.6059350902616151	0.4686992354015363
DG 16:0_16:1	2.8290846193699335	3.267112025336851	2.972963887535615	1.8573275169915666	2.4118899238537135	2.1058547359923137	2.9782028403284415	3.1103342150351514	2.6040643596107786	1.0683772743045878	1.214817048	1.0310846802527958
DG 16:0_18:0	0.25782209956106666	1.334209710683196	0	0.8460404737919598	0.11646711187347492	0.7014782645427607	0.31279066276769896	0.606441757	0.055684876	0.16996062155498076	0	0
DG 16:0_18:1	11.344226373098817	13.07052839540076	9.915479150158395	7.040460715867929	8.329169636498738	7.231759862044644	12.380977983700387	14.049176922848257	9.275940036848029	3.194102481306522	4.686717042913976	3.4310409079987947
DG 16:0_18:2	3.402543335865069	4.668373334409914	3.1452902597124646	2.346160650123768	2.799084452326078	2.4903390347613312	3.349720273638565	4.735214039688631	3.632634939921473	0.9012503578492194	1.2781392565923462	1.1439715548786267
DG 16:0_22:1	0.3512057611676006	0.5345153873153138	0.1140632314351892	0.2281586639372388	0.3002214147002838	0.1931849000760686	0.46622329857720446	0.5263415841670466	0.23136236941138366	0.083905676	0.12899550754161332	0.11519084636841613
DG 16:0_24:1	0.2147906467318726	0.33457344733914285	0.1529872144161306	0.2553338236339266	0.29024331584247404	0.16574567773123527	0.42919003762390706	0.49967759019500996	0.27252314400506195	0.077532246	0.088315284	0.057750531
DG 16:0_26:1	0.2233345910452731	0.3796251835396082	0.2897863741860388	0.3248985318121643	0.27995250100368474	0.29866014539085584	0.38891489648796723	0.3684993722572851	0.2471303891043916	0.051257103408392554	0.050125741	0.039385575
DG 16:1_18:1	6.472918624478513	8.2723649590350945	6.091617929221094	5.551850217983896	5.474703124686598	8.713954623538873	9.488081144510367	10.637994820832004	5.009538555845177	1.1970998663901031	1.4656522589622156	1.7227371434289815
DG 18:0_18:0	0	0.15704046313088443	0	0.051807733	0	0	0.003199973	0.19484175295966136	0	0	0	0
DG 18:0_18:1	4.684668808532671	6.932295149288302	2.5261972818177396	2.9945924340025796	3.301647179680017	2.9630561358417937	4.5924548381456765	5.455281990017401	3.165225257735745	0.99559141	1.9499508790498803	1.4986096933521165
DG 18:0_20:4	0.46276039287459053	0.797441065	0.5450408150326153	0.1868367625456726	0.25361206802881386	0.2892751689273481	0.4600110314124496	0.4273476849083655	0.3386848928160366	0.31165925714958953	0.33932224888677576	0.4243551549873882
DG 18:0_22:4	0.078321014	0.12865147997600385	0.061823229	0	0	0	0	0	0	0.091823117	0	0.12372678782702304
DG 18:1_18:1	19.50560130105566	25.79498612950369	18.357520445046262	11.544438918054304	14.142525836704413	12.462666812006395	19.42427268856065	22.030555942830023	14.863355781378319	3.318549226173428	5.788352118286363	4.2948340539703835
DG 18:1_18:2	9.476056168943263	13.266086222499537	9.511505258620875	9.742847261	8.314734113	7.652906835861787	9.344125595334585	10.879669944269653	6.800886408096624	1.900364230233492	2.672987696103447	2.681519173966937
DG 18:1_19:1	0.25923370935202233	0.38096735646251045	0.24449607625325204	0.14743600892763126	0.20881968860732303	0.18749349796655987	0.3592435657553471	0.3866042061801215	0.2703233136933384	0.05132219	0.092725979	0.063501259
DG 18:1_20:1	2.492478784901156	2.906386748883551	2.0390726412013387	0.9291698175607082	2.199420227944947	1.307449640100342	3.6268114311008413	3.4842602307894004	3.1308547481259517	0.46339479358538693	0.9719856158572503	0.7060783933786897
DG 18:1_20:2	3.186590721959412	3.8234872588796907	2.481641153	2.026857175202142	2.3937875052882496	2.2245506528028955	3.3637685239058093	3.7960643233014717	2.710982849578929	1.2805088943801657	1.6723677118000213	1.2183569074175091
DG 18:1_22:1	0.42960784279967684	0.7698388856966278	0.21236637822317206	0.4060605018761652	0.5287499872713335	0.3351096164321165	0.795766464	0.9131765600295001	0.47709247524154824	0.10109306453815611	0.16005025740225104	0.13625236124165724
DG 18:1_24:1	0.7683538166092577	1.1006977701715561	0.8826743980368973	0.9780995721084106	0.95185071	0.7397685684977281	1.3621914185266302	1.563165815231647	1.0837758645739513	0.11071341287978467	0.18235305255139211	0.12610568429252092
DG 18:1_26:1	0.607423466	0.7120741212584835	0.8278066111018806	1.0200358268910892	0.6822016893524202	0.6853064624498911	0.8700364711894568	0.8943253827840667	0.6643984678198657	0.053762347	0.066145819	0.04445183
DG 18:1_26:2	0.5436832945236697	0.7681468009063922	0.6453772709105191	0.5944225434107038	0.951212094	0.6004880048323858	0.9771452037626597	1.0479996800557194	0.6701101831116774	0.059023997	0.082425003	0.078782616
DG 18:2_18:2	1.3947069590863088	2.096384877762619	1.0393117718686202	0.8971454178923186	1.304885572598702	1.2409019428494603	1.200517718805495	1.4684029387211563	1.0010754022898396	0	0.3586074462072787	0.4019277609549295
DG 18:2_20:2	1.102901683246265	1.2567091828466064	0.8177242570523965	0.6790996444713353	0.9109019520333494	0.8185478858336477	1.2776055953186132	1.535352959369602	0.946557414	0.5254000578358452	0.8703632708211291	0.8839041903467119
DG 24:1_18:2	0.26673092638146434	0.4733971253566253	0.3325615912895503	0.3090783053621365	0.3768917145836186	0.29591557485434605	0.5414712515597779	0.5711444185046577	0.35876860444438363	0.064023587	0.07800186	0.083155196
LPC 16:0/0:0	0.4920772128172136	0.5072100445782954	0.5107725759955858	0.3730842160713497	0.40303390980837267	0.36020073532223057	0.7766301467037481	0.9484721293281803	0.41455322676376016	0.36283890053424867	0.2368921800834673	0.17739834183183686
LPC 18:0/0:0	0.5120798577595752	0.4196935100479031	0.25019268305050557	0.2127862358139754	0.2763995100064539	0.19367437692787398	0.4226627941442928	0.5824377131453479	0.322050684	0.18464685398513342	0.18918777503735543	0.19962660641216096
LPC 18:1	0.5216448614701852	0.6102783345581163	0.555229501	0.5054067099943019	0.7726307653970395	0.4752977733433527	0.9407329379054733	1.1781092092820766	0.74773073	0.25860252247337073	0.31853822597124976	0.27358036
LPC 18:2	0.14851521428779535	0.14562326348856072	0.14467566181973257	0.21094197947441823	0.33949204562075197	0.16617241508670424	0.2718987499409576	0.33374305287397704	0.18227840121533292	0.045574769	0.071543219	0.086368301
LPE 18:0	0.24357977361893132	0.25690560978855503	0.22051702733050701	0.22640287495771164	0.22608669376674212	0.2255621650401985	0.25098835199608516	0.2872503843817217	0.19373596844471289	0.13713457187542824	0.13121304556990412	0.12164567515743425
SM 30:1;2O	0.047052565144297724	0.061320564	0.053257181	0.054774160612780516	0.049467846875903596	0.048382588230718136	0.072827929	0.087142823	0.053941239	0.056861937	0.049358322306898295	0.082124734
SM 32:1;2O	2.1752450779069763	2.6504709038933574	2.549919804600817	1.9587576640218138	2.8615859689436363	2.1927379058999112	2.6923075326399983	3.2674719499712133	1.990780762058314	2.7046961846379167	2.9024626423528352	2.9716682281802758
SM 33:1;2O	0.6045207138928831	0.8395412877524028	0.7062339284152862	0.6547357393621971	0.7474515488859035	0.6890898359663278	0.8587745804962483	0.8302069076020876	0.4237712271086809	0.5762732255791629	0.8355409694531314	0.8611698902767952
SM 34:0;2O	0.839973974	1.4906140084394697	1.0109280118172732	1.394343276521357	1.2529952296409215	1.3711391519662357	1.0760019696094985	1.5158865559635697	0.686809289	1.0352279457765419	0.8731045125963406	0.9039107403477822
SM 34:1;2O	32.387616307224675	41.05543070765043	27.82778773802659	36.123305628450204	39.642597340977105	33.96752970539899	35.13634809242538	42.19475465143637	21.942838088719054	22.666763119469227	28.69884906346823	41.65968883884898
SM 34:2;2O	1.5684345426071868	2.3246925814636366	1.7926219513092159	1.3628605672317533	1.8652531805642842	1.8012949939764387	1.1997612848661117	1.8432290136350822	1.0516822142441355	1.1411474402713344	1.353992219820231	1.4146065302311126
SM 36:1;2O	2.452150690452655	3.6909916637547733	2.655478101558428	3.3874249344270613	3.167563889454062	3.0610091233868757	3.4274758373588536	4.878635002931137	1.408265745775307	1.1657616639588069	0.8999961722182988	1.3029091179938845
SM 36:2;2O	0.8052578540891224	1.0163576772275331	0.7488721084652388	0.6460288852611232	0.8428836137151956	0.8418150535775497	0.6770453341341156	0.8118504639202992	0.521709732	0.18401003389272602	0	0.3185063988135469
SM 38:1;2O	0.19513560668601967	0.3444808262868799	0.23667509939711973	0.31276185640444026	0.30271144834755837	0.3012677653284744	0.2553456846890814	0.34063965882515784	0.15568585187596612	0.21279041687021566	0.1445233556700865	0.23000194491094636
SM 40:2;2O	0.7913005578408923	1.1716497460612136	0.8748808	0.7204470077377092	0.8070670116584852	0.8966189946905383	0.8019801044472371	0.8988035003622781	0.7926695421262672	0.7627960032245859	0.9197642240824203	1.1317823440607375
SM 41:1;2O	0.14887440217374429	0.2297542988942041	0.2200302662992275	0.26151377919576646	0.33677412107645843	0.26181362951067183	0.23494463234462523	0.26672804015636764	0.097234598	0.21434664634875347	0.13237755914240443	0.17901776384577173
SM 41:2;2O	0.26004770999973326	0.28183992618717507	0.36413618653431024	0.21150682968637047	0.3034667231038377	0.28229176867839234	0.21178053101055497	0.2852205541981046	0.21571272617160034	0.20374874788825695	0.2144950353795082	0.23783656451615193
SM 42:1;2O	1.2261709694410174	2.000115694286556	1.110197952081435	2.3869405278376434	1.6859930805929466	2.868175092680554	1.4658058019320612	1.6040542409599714	0.5650681495865095	1.169300083867683	0.7019166207113874	0.7308453866370036
SM 42:2;2O	6.932561414215247	11.267365034222545	8.135472354946712	9.853548262335167	12.384877725897327	9.535057605736483	8.657378691742116	10.760329537568063	8.723717873675453	8.768873705355961	7.946527631594042	9.538211107793282
SM 42:3;2O	2.288164145745583	3.313591365	2.4305442266895887	2.5591590508953046	3.135622889745054	3.0769941602408935	3.068743976576853	4.0640159690098185	1.9114535611964614	2.276364255	2.2839075570325593	2.8584406489602614
SM 44:2;2O	0.19995562300754716	0.37468231879072067	0.24822415049375796	0.25308954571600145	0.31360609831360314	0.2789080424631335	0.30294978410515866	0.28547293194953016	0.11865562297759127	0.10700230816799204	0.082375084	0.078665372
SM 44:3;2O	0.12224948503014772	0.15999060006747337	0.165630646	0.12886301455144536	0.1445979962731716	0.13815919033170226	0.10467742763245802	0.12889557678638294	0.084493402	0.078553521	0.068442848	0.075772528
TG 12:0_14:0_16:0	0.002368759	0.029156125387766935	0	0.046228685	0	0.058783411954623846	0	0.005399379	0	0	0	0
TG 12:0_14:0_16:1	0	0.004331005	0	0.015797997072220626	0	0.025887483	0	0	0	0	0	0
TG 12:0_14:0_18:1	0.27038451206141384	0.4108076142128577	0.5453662096221755	0.256335774	0.15050200155898924	0.24157834519139199	0.20376831606999318	0.2193025758591768	0.20683115678201466	0.035646746077890236	0.064878677	0.027564909973108502
TG 12:0_14:0_18:2	0.067426884	0.10767053285891352	0.16033767725086134	0.066778952	0.07310081	0.0639032	0.085510777	0.084209872	0.06831656	0.010566017337252277	0.019918505	0.010166610761519595
TG 12:0_16:0_18:2	0.7093886681087019	0.8312854748788091	0.9222614035740457	0.6652728686559645	0.5546867859849135	0.6783745351128333	0.6295585209940537	0.557732576	0.5186567731966008	0.083531427	0.1573224660164017	0.10321677880750058
TG 12:0_16:1_18:2	0.095269345	0.12986187440877525	0.17477456876148004	0.07832466	0.096650093	0.076819036	0.090313822	0.093415407	0.10379379119635973	0.015268155018923986	0.036278098	0.020126382846913708
TG 12:0_18:2_18:2	0.11414935861745727	0.16301879684650816	0.19231912838252804	0.099087604	0.14292631958717103	0.095683083	0.091138517	0.1042211613390714	0.1134982378836517	0.021662906	0.042289759	0.039058047
TG 14:0_14:0_16:0	0.26099530976820506	0.650140702	0.22218753729324023	0.423809638	0.12286874837933773	0.3362422386350403	0.2453414328063951	0.47932698620889835	0.12701346174477915	0.10025397431764729	0.054653909	0.023737076225539014
TG 14:0_15:0_16:0	0.030104513385328328	0.03482022	0.034291135	0.024144254534966367	0.025832686	0.010689440615964347	0.031645535130618165	0.026869427511034515	0.02784974	0.003731455	0.010616477991886444	3.447292767154542e-4
TG 14:0_15:0_16:1	0.027095561657754355	0.053664355873527955	0.066244919	0.033713787206103955	0.012985206298225908	0.031084871072366096	0.026981930395391675	0.028279731556333246	0.015977802358478337	0.004748689	0.009433191	0.005595895
TG 14:0_16:0_16:0	1.6419987303953685	2.2740428123918015	1.8484397367646275	1.072178975013788	1.2143202244334659	0.8369877176054983	1.6554623321185438	1.6710428359262495	1.1525604043790867	0.2523164773191421	0.4466798599557569	0.26165391700801705
TG 14:0_16:0_16:1	2.104728241056196	3.3190575402569005	3.2531521545709237	1.4013412460354058	1.9533718276117154	1.4714077853272765	2.3657863614558985	2.427911336085667	1.6904086756402732	0.24280159510817334	0.5328140941007898	0.3329673522425886
TG 14:0_16:0_17:0	0.13825221700899057	0.15027119933029162	0.068426473	0.10182097751559993	0.14092189038544076	0.093168493	0.14666061998056834	0.13060566023207343	0.072731098	0.022804332577332012	0.030430974	0.029525983733847818
TG 14:0_16:0_17:1	0.2971562524812271	0.3172862221517672	0.3030897269615261	0.22099609457343458	0.21923250051733953	0.1842946168280541	0.33218113620717504	0.21937526186005737	0.2034484426412167	0.023602937537435892	0.055565142270771695	0.041094047
TG 14:0_16:0_18:0	1.5424085791865279	1.8891800787714323	1.793627614320851	0.9851741840613012	1.690877497652995	0.9973361798161509	1.8008182195670728	1.306409279519067	0.8324813225322356	0.4480809859759892	0.4830513735495409	0.3410095718891137
TG 14:0_16:0_18:1	7.146422805	9.894859064150635	11.708913950504687	3.974220685	5.296579284820231	3.779920996096195	7.239417513292857	7.6388621852853635	5.359113784	1.0648597176975816	1.869794608923443	1.2065391473495826
TG 14:0_16:1_17:1	0.10708811769626654	0.13399235754058905	0.18176230779819824	0.07056284	0.08463224	0.11117672688609982	0.093330701	0.090160012	0.074705509	0.01260534	0.019288891388339103	0.018170943
TG 14:0_16:1_18:1	4.652951001606048	6.4477574513311815	7.408891897892658	2.6544475755988866	4.077198224784384	3.258963535767008	4.614824406781639	3.327026447901153	3.6333618385251647	0.38129484107897593	0.8592642778595793	0.6055676004883027
TG 14:0_16:1_18:2	1.1020690227915368	1.2280505851741974	1.7608853730026166	0.642634642	0.8489950528290648	0.6636010587988125	0.8526006795293618	0.6333761516868367	0.6909752572096258	0.1296622252691407	0.18703208455145398	0.17131458725275536
TG 14:0_17:1_18:1	0.69593959	0.8061035600058579	0.6235138314726301	0.3566075277327791	0.5548615530540788	0.38180892442699876	0.6123498915629849	0.5006228646640125	0.4567394157847285	0.049704841870850565	0.17363678319396256	0.083752546
TG 14:0_18:1_18:2	6.396398967292859	8.435256087700335	10.272008660938962	3.800756081424258	4.680010907	3.968209262443705	5.4951397145035354	4.374325588910066	4.2226366674300575	0.45663806157179215	1.103163928885155	0.8568258938869016
TG 14:0_18:1_20:4	1.127864145588343	1.1753829013246353	1.5106238620541244	0.607398642	0.6685914071738148	0.6429513079220197	0.6234114143120187	0.5866800068757485	0.8103946816290788	0.1211261636996878	0.2314179589767627	0.24781599051390343
TG 14:0_18:2_18:2	1.0536067585383837	1.191829475723249	1.7176449236812592	0.6398201209903188	0.8361827165727853	0.6808565008224907	0.8323890252461745	0.59888689	0.5944692627135344	0.1215217664692988	0.22044354942357652	0.22984329422093733
TG 14:0_18:2_18:3	0.11224154520658863	0.14377092070371783	0.13531756435074588	0.11835364125411513	0.091516772	0.085301901	0.079552355	0.078735338	0.078181212	0.022091155051810862	0.052893267	0.043025797124651044
TG 15:0_16:0_18:0	0.18808134293397827	0.24384943101300652	0.1914072995155363	0.190597696	0.1863127548490142	0.1435411873164948	0.23118633974643876	0.26481448863865625	0.1324377547745239	0.049615818552099324	0.068518234	0.059155267
TG 15:0_16:0_18:1	0.9377869954762583	1.2362799415658392	1.1365816313018824	0.5862953580698885	0.6355382510043492	0.5712876614313653	0.8893172945040971	0.8366123893021883	0.6759656098652811	0.076772012	0.22494474710766998	0.14034201494715048
TG 16:0_16:0_18:0	1.5398704555270801	1.977906073962721	0.6899515275186516	1.0849152631718662	1.3373624408307212	0.8092037444479491	1.4717732351004709	1.3607100394891962	0.8382488741655233	0.4071472272360948	0.6915131181497302	0.4516037781274706
TG 16:0_16:0_18:1	12.503062155312548	15.066099193599344	12.895591356390863	6.279778385955571	9.703809424572333	6.289948385364254	13.145695661318632	10.589241541299597	8.854910433478539	1.7680855402359688	3.9611206429368417	2.781479335129707
TG 16:0_16:1_17:1	0.6736034389528823	0.7532761711949966	0.5804411553103159	0.34949282243451263	0.5102888571847225	0.3768576806715813	0.5829439355588885	0.48258202385464277	0.6652023699089543	0.045264377	0.15883561599964194	0.11800458132469367
TG 16:0_16:1_18:1	17.622392325680803	21.168367140397258	24.897929117057124	8.213470436	12.013795845283052	8.140605134433345	15.533769634746694	16.914403558852833	12.925020218966957	1.4723374661061728	3.6433335774468207	2.6669092527133604
TG 16:0_16:2_18:2	1.0404175677647003	1.6600390345463922	1.513640435746161	0.7767138186043077	0.810070879	0.7938556454257325	0.6886110543746559	0.6419435005165665	0.5466397378141882	0.10704729854030658	0.21324046753384446	0.19848527430967408
TG 16:0_17:0_18:0	0.16450277839743396	0.2258053224351474	0.041124129	0.12765821462677182	0.12058618474488468	0.1028715874731719	0.16469690283816768	0.13378573854215334	0.094915646	0.035799681	0.054609369	0.037420777053348474
TG 16:0_17:0_18:1	1.164002289076937	1.5697953051618303	0.8492956218748104	0.9649357297190085	0.9720277497237917	0.7042026359212333	1.2726682019054285	1.2083907063910078	0.8700618291219576	0.13410573684606247	0.34138154694719614	0.2417013308235705
TG 16:0_17:1_18:1	2.0900247081346337	2.9216142068037403	2.372194787399433	1.2746108812629728	1.5892025160663192	1.650478771055483	2.0578740378751164	1.7823935731499292	1.5988971832018872	0.15507966363930586	0.41075129228715124	0.3372681813333322
TG 16:0_18:0_18:0	0.9347490550164979	1.1613574783676286	0.19421338382514314	0.8184029079475428	0.8460740776759393	0.5842981883506293	0.8497809164396887	0.7774390431566491	0.4133388639665327	0.2597117677657546	0.42704751804457114	0.31198440805991645
TG 16:0_18:0_18:1	9.783907162825502	12.55976381497806	4.8090946144047635	5.5647036571391135	8.199712931320166	4.747602225614232	9.821049367635709	8.651214247852531	6.3717150346386635	1.2978363518901501	3.3807531596245326	2.402782513142777
TG 16:0_18:0_19:0	0.030383234	0.052540283	0.002359375	0.056736283421069206	0.058291790516308124	0.044583054562017825	0.040285778	0.041321975	0.018983587460517568	0.012189909581495918	0.019866211669995047	0.012716379642806898
TG 16:0_18:0_20:0	0.15443998746871243	0.19863570871112685	0.029939724	0.14584983003653815	0.16482022688926978	0.10706038125492166	0.1599206470064864	0.16406708403642445	0.063388061	0.045841133	0.065089551	0.052046728
TG 16:0_18:0_20:1	3.2324600548081057	4.348528981754051	0.9098360951054418	2.1764926276391003	2.643874751448985	1.7458167175892818	3.4265183716854475	3.1582252757203233	2.1194098658041836	0.3267233308080613	1.0431929998105203	0.5928249115653446
TG 16:0_18:0_22:0	0.10428137261126041	0.1298730436609359	0.017446583299650657	0.076678882	0.069650482	0.046849283	0.11666242052512238	0.09853035	0.045624523	0	0	0
TG 16:0_18:0_24:0	0.092607375	0.1258818571750127	0.026601237099789263	0.074093381	0.061091102	0.043688069414546234	0.097958606	0.08323281	0.038999838	0.00823396	0.009749013	0.006070456
TG 16:0_18:0_26:0	0.036806353	0.045914712	0.012428949637852607	0.030785173328271416	0.029525572196729424	0.019016557	0.03878428	0.033606384	0.017395281	0.002512043	0.003533467	0.002494647
TG 16:0_18:1_18:1	35.962868566356036	38.70153845584219	35.58008629932939	15.005136551856676	25.964447511208526	15.291611768076883	34.253465831978346	28.61700209500346	26.14915180875728	3.0766938720043844	10.028746372051756	6.583984739062993
TG 16:0_18:1_18:2	26.890872267953167	31.17157405	26.49024479032159	11.665581184539244	18.477001224098206	12.254048985597949	22.148505707320528	19.867205156452233	18.06054696743976	1.6423478740505408	4.659928233540947	4.016318575868675
TG 16:0_18:1_19:1	2.7590658055262813	3.563581124071143	1.7683282023207116	1.6136605191903617	1.8417961235049585	1.4834902309002878	2.597617647561791	2.654288813116029	2.130264215271503	0.1843539786993432	0.6595121666782786	0.4590068876341201
TG 16:0_18:1_20:1	22.19761336146383	25.611116169913895	10.912265119427296	9.575496352065072	15.910405966008316	10.159526966773296	20.47625457483592	18.469131281271963	16.79394066601478	1.5824487026179677	5.919230694891789	4.221129444799818
TG 16:0_18:1_22:6	0	0.11171442400109145	0	0.046026258	0	0.038752156	0	0.068958973	0	0.050881756872297165	0	0.15092501724615182
TG 16:0_18:1_24:1	3.8923642907591667	0	1.3334454604042671	0	2.652932877712765	1.6041329260704535	4.202914289280367	3.4206148042161915	2.8883813428404372	0.15015607171438586	0.5841582359158167	0.25793478388122415
TG 16:0_18:1_25:1	1.1272487030030176	1.6166788831564034	0.24278892834203447	0.7645437832540354	0.5772170565661512	0.5541796334775548	0.8086309706366804	0.9426214238889051	0.8224469261634285	0.06345003	0.26878491061220255	0.19597705632948637
TG 16:0_18:1_26:1	3.059603496078123	3.927578749751241	1.1417340254756985	1.689687187238523	2.181456138936228	1.5230577913425392	3.434426519745119	2.8648214570092865	2.2734745755400767	0.079542475	0.2503553345162682	0.11415624410014559
TG 16:0_18:2_20:4	0.3918642468109593	0.5067948670286148	0.3384070385598164	0.1813478397431744	0.14988495221638834	0.21864111549758644	0.26767728273135216	0.2837859328707152	0.24158030802433358	0.07833373	0.15338330252460122	0.17686670568922225
TG 16:0_18:2_22:6	0.089716168	0.11059297616665441	0.075092215	0.058817931283630935	0.057158516	0.055222196	0.068496058	0.06507234	0.054802858368273505	0.021687667653391297	0.055709285895346114	0.063558003
TG 16:0_22:4_22:5	0.033910201671910035	0.039841134338318644	0.015132680773000938	0.014249876612222292	0.015468854817860032	0.010897538927243244	0.05865242	0.053760954	0.034780357062344336	0.027900401528426617	0.089715377	0.13478985765731627
TG 16:0_24:0_18:1	0.9087308771314057	0	0.3104385284384322	0.6132981119173391	0.6548591570554987	0.42711265376590996	1.1321271387369232	0.9197720685177092	0.5580106110412999	0	0.10074577974681341	0.04221001
TG 16:0_24:0_26:1	0.014081154234157732	0.016047364490043653	0.006158549	0.009961886	0.008356776	0.005440735	0.017410504304770286	0.011948539691480365	0.006096342	1.9861451927584802e-4	3.1638994655602213e-4	1.860077207652525e-4
TG 16:0_24:1_26:1	0.060408745	0.074760093	0.037058647	0.040222042	0.041133997	0.030492328	0.071063736	0.058217230105185876	0.039030090326685016	8.886336461269264e-4	0.002434296	8.011342320474302e-4
TG 16:0_25:0_18:1	0.057491102326168636	0.083369301	0.01840666	0.041709503	0.045574154	0.035077769	0.093907666	0.072983747	0.051727311	0.002916268	0.004465109	0.003083992
TG 16:0_26:0_18:1	0.548783594	0.7411018640141923	0.1778796852596992	0.4168565372513735	0.42775098995416805	0.2894731979741216	0.6451467345955528	0.5194956380714885	0.3214438665710562	0.017789194663635176	0.03566904	0.015684416124169015
TG 16:1_16:1_17:1	0.12737465083911703	0.1761563329036301	0.2311609893766457	0.089876925	0.11649892275633872	0.0981436	0.10044171039355268	0.098829884	0.088172757	0.012984088047251732	0.029176156241616992	0.027307761736795135
TG 16:1_17:1_18:1	0.8691980655997121	1.0886763440740699	0.9113192709210783	0.47415154377988844	0.6258094706324663	0.5420707857052044	0.655406996	0.7114220418826335	0.5632565796827341	0.053945088	0.15508992649123887	0.10961820410100062
TG 16:1_17:1_18:2	0.1398118926851603	0.19818241313247725	0.17613268764145973	0.094133773	0.10512861586431846	0.10356122409090687	0.094561604	0.09546035	0.092589916	0.015585927	0.037694093703657644	0.037246425
TG 16:1_18:1_18:1	0.017556020957551505	0.020590326569690072	0.010133560268406377	0.006757262	0.010027871456742417	0.008263622	0.018119631	0.014351103776456547	0.011797051235783867	0.001096913	0.002296682	0.002194377
TG 16:1_18:1_18:2	6.91854007	9.131631880738723	9.949540389111672	3.981855182	5.1134274721942194	4.3159010285748645	4.851296507176011	4.517679415792913	4.0721062104603805	0.5485492906154189	1.3650137062086332	1.2065711680747286
TG 16:1_18:2_18:2	0.9326949251744937	1.2097185957846839	1.3926490564609457	0.6166311933423533	0.684895153	0.6518732362244806	0.6441105978875348	0.5672574237405908	0.5392720875817527	0.13116457498371653	0.26521224284291517	0.27600724452048514
TG 16:1_18:2_18:3	0.035153225	0.033308115185165535	0.051355125584344706	0.025010473	0.025263811	0.023761447	0.019782971	0.018432117478425415	0.026763933444023558	0.003859336	0.011436829808044141	0.014314113363888355
TG 17:0_18:0_18:1	0.6440678946633676	0.7446473222311365	0.19600846163988245	0.40342744633022826	0.4557696008441205	0.34579737717868203	0.6281448832713202	0.5834110593892788	0.4129384750412039	0.055524144	0.17450426753056958	0.11874453815466797
TG 17:0_18:1_18:2	2.363401931490164	3.166468773597954	1.9142563201114537	1.256553811444752	1.5044029868671525	1.3700379051127445	1.9888807882502504	1.8206152857880051	1.6426172737336953	0.10873436444541094	0.41237858663590593	0.3329274886877266
TG 17:0_18:1_26:1	0.17511474965851306	0.2323445844168762	0.066992048	0.10710959201448492	0.13775892054276614	0.10754272301317214	0.22036901307330042	0.17658625774187117	0.1363966851133508	0.005622053	0.016482360442337952	0.006680487
TG 17:1_18:1_18:2	0.7542731801242819	0.8909568693887019	0.8415789412418847	0.3763321294762511	0.537678232	0.43030847565354274	0.4791920565851265	0.656681732	0.5723011215902591	0.039005376	0.16120578465766042	0.1280267519179907
TG 17:1_18:2_18:2	0.057669306	0.064889511	0.036404596	0.031351167	0.046129502	0.038000718	0.044311285	0.037443187	0.034956411837985084	0.003153136	0.014733231763242281	0.014823436605499153
TG 18:0_18:1_19:1	1.050070382	1.2053404185359022	0.3560369747529175	0.5308083851258814	0.6805202030029897	0.5190093475198275	0.9604853677072736	0.8972278594342006	0.7800435901516659	0.061895602622183965	0.28031132826352767	0.17479598217544767
TG 18:0_18:1_20:1	6.305850257953637	7.655432421	2.022615897	3.0125648324297587	4.305354341338439	2.8961322973985517	6.360165844212314	5.500471731150189	5.295230817351667	0.3690809712721514	1.6941254574210516	0
TG 18:0_18:1_26:1	1.1875938668327763	1.5118598854100243	0.3881310506950565	0.7720133427147999	0.9709095209112444	0.6389998675492384	1.343548983996236	1.073284059152388	0.8547184891310505	0.021914726459385928	0.063285827	0.030860869
TG 18:0_19:0_18:1	0.1663628499112345	0.18489613138750666	0.036184795	0.1001425664260805	0.10074629741039602	0.078651653	0.15791294424020538	0.23125259288097672	0.14801529279261713	0.011905898467124199	0.038904619	0.016274171386596516
TG 18:0_20:0_18:1	1.2501628621965053	1.553711250930235	0.5229533135909826	0.5382841072485869	0.7420270491310421	0.5154731628287326	1.1710058740812197	1.466746819553558	0.9861855213582534	0.076999459	0.21199399683821418	0.083908731
TG 18:0_22:4_22:4	0.029320396678715253	0.036557745703885446	0	0.015916687655477893	0.022207068005497082	0.011086130975706637	0.057581405934176384	0.046300463134276035	0.039436573080781155	0.047327962	0.13990132237282232	0.19459871092217215
TG 18:0_26:0_18:1	0.14611703425651745	0.18529324150897508	0.049114121	0.12053515325122326	0.11586382416201217	0.089247073	0.17297223183946278	0.14755483488492335	0.083307222	0.004118667	0.008282196	0.003893496
TG 18:0_28:0_18:1	0.026303063827795205	0.032385598	0.009058391	0.022426858674581503	0.020599282451361528	0.012403173217648002	0.028406155266764686	0.024347631401412027	0.014802706336142729	6.887855473764653e-4	0.001060781	5.224223768759577e-4
TG 18:1_18:1_18:1	34.13139663248694	37.47810988165591	29.41274278447168	14.451986517187256	25.30526665809066	15.946321644568103	31.46337884180188	27.89848403084813	25.453785067701084	1.9765924766650251	7.732257499447424	6.066169911
TG 18:1_18:1_18:2	25.040957728356315	24.77767336569061	22.873134618576675	9.755951071762748	15.063631775316088	11.34483613	18.347057779078796	22.80059300791519	24.827828737160115	1.2648525256002436	4.702830917730374	3.8177437778502323
TG 18:1_18:1_19:1	1.9640236463441365	2.5078543646107136	0.9779214342052142	0.9885759690570255	1.223269299125319	0.9933556605035601	1.8320476989308145	1.8221442889397073	1.567826288670477	0.10345217713511831	0.46999393674815315	0.31328209387669115
TG 18:1_18:1_20:1	14.38533082543041	17.144409955569305	6.515650920542306	5.628132934286451	9.867204633482729	6.489993149	13.136376690101615	12.598964815193325	12.05402759406376	0.8616203280464201	3.7752156543540702	2.5321651532217753
TG 18:1_18:1_20:4	2.1082175419364635	2.507862674921974	1.4011207069971128	0.93045961	1.2234318729833034	1.0267079885460844	1.7833262503721243	2.021965943980607	1.2487124909673182	0.33069018316406107	0.9695625249993646	1.1844961722970206
TG 18:1_18:1_22:4	1.3199098561997635	1.3340945744874442	0.7966171407987358	0.5196626307837697	0.6485775019584467	0.5551039037984518	1.0484713867516864	1.4686530141427758	1.3952562568226732	0.35612401786140957	1.4452648950080496	1.1592005209941696
TG 18:1_18:1_22:5	0.12593071333850317	0.12630351865336353	0.035404011	0.056784877021465806	0.046786107	0.047242373	0.13702483553101188	0.1905866068731504	0.09689568	0.093091261	0.27542433339093386	0.3653601705369131
TG 18:1_18:1_22:6	0.2557579265222956	0.24672370843507418	0.1424714282422694	0.11328649137474908	0.1306174859718522	0.097530773	0.18793105109610084	0.19005769563555955	0.1456875531214931	0.066061125	0.21143782025560928	0.2707996444424541
TG 18:1_18:1_24:1	5.506798534039989	6.575570789595665	1.9613035420390048	2.4412490857505857	4.0129509235136105	2.5536814215429513	5.503517285503011	4.632066437842239	4.091688141488273	0.14483777342093973	0.6040647248261203	0.28639047945621177
TG 18:1_18:1_25:1	0.31402200283553294	0.38660472507611293	0.11319113800863426	0.15808717114974788	0.22959951370243187	0.1645234512297534	0.31386970390249636	0.2850951241116335	0.26986255817707894	0.005467504	0.031080862	0.011062896890113893
TG 18:1_18:1_26:1	3.2856776512405386	4.0649318327004424	1.2643621988065443	1.7219279136246446	2.4781579042674036	1.775422085888962	3.281547216835698	2.9323987282205337	2.793296607965198	0.053110469	0.1950744344842452	0.089536375
TG 18:1_18:1_26:5	0.073880999	0.085115742	0.03909908	0.039145088	0.05393625	0.034481281	0.08737078	0.10303762412491893	0.079560389	0.078520228	0.2244291292862439	0.26793712815623005
TG 18:1_18:1_28:5	0.054267613107885485	0.054049748	0.015244541962300892	0.02594471	0.034536865146239805	0.024735033	0.047256909	0.044578381679353386	0.038600121	0.042847293	0.11939070943062924	0.1293390743532799
TG 18:1_18:2_18:2	4.276546346927005	5.841520237	4.030812279	2.545849626000115	2.504934484698928	2.8773751867850366	2.5857356070970177	2.7216871317303983	2.094776616567527	0.20860837161328796	0.6149896311567912	0.622404657
TG 18:1_18:2_19:2	0.22695841184280108	0.28349561627113307	0.18567629467948474	0.12077191903066808	0.16052486238949099	0.12664309659036974	0.2099923542059839	0.20703524312550495	0.16775241332645127	0.029055492	0.085804726	0.096619732
TG 18:1_18:2_20:2	5.025572157102846	6.270651077829453	3.8651829209144903	2.703243836144406	3.7021546308516458	2.9756405550452736	4.783224229913322	4.524782844954606	3.8292555693493666	0.657206965	2.0839560892709597	2.2579325806571102
TG 18:1_18:2_20:4	0.5058326486263631	0.6045032507228697	0.3729612597955687	0.28428700633377124	0.3109412365387323	0.30149635997569463	0.3926062050685095	0.37227965823957976	0.309641556	0.098004748	0.2930626135879068	0.32765475371463754
TG 18:1_18:2_21:3	0.068270255	0.070230772	0.016148408681702604	0.027734352	0.036328016	0.036894017	0.06501079	0.06412384	0.062940216	0.016179653	0.055541133973390985	0.065629065
TG 18:1_18:2_22:2	1.5203667305438069	1.8038265677965268	0.8054202308610745	0.8101667124622127	1.2032312480526344	0.9174579433594491	1.6073199238918128	1.7288674064732676	1.3598729573835107	0.43614320770330944	1.4151351238603909	1.3633522258974236
TG 18:1_18:2_22:4	0.3480266928424844	0.44513777654150355	0.23937475014297563	0.17257086847472428	0.24358695522138393	0.17729469129990208	0.3311196889549322	0.3939391016151076	0.2809371629913647	0.067566886	0.23806574341923925	0.3037723436934278
TG 18:1_18:2_22:6	0.061966654304553774	0.067260784	0.034806077	0.026551411	0.027851328830356518	0.025636832019466642	0.050258783	0.048652103170932284	0.038252193	0.014858045354691537	0.047990556550412164	0.06721647
TG 18:1_18:2_24:2	0.8209897959457413	0.9593002069546668	0.35242860396474174	0.44870990385085074	0.6396137390522225	0.4830465616320159	0.6654697593821836	0.6735963549571976	0.6252657020307374	0.154863469	0.5365892099485869	0.45384693843585644
TG 18:1_18:2_24:4	0.21643873730117577	0.26845262840849776	0.083082188	0.11609861687590951	0.1449250577072452	0.1024923410400884	0.2833732099557169	0.2888206948370458	0.22934946284810254	0.14237814753037215	0.43968648641961156	0.5708808738374018
TG 18:1_18:2_26:2	0.9641258637198804	1.1665273884192418	0.3881215240553085	0.5776250377762392	0.8170329897349744	0.6238424057255074	0.773827459	0.7154971934839279	0.7078248508366638	0.071016726	0.2487937234316291	0.17759561151143682
TG 18:1_19:1_18:2	1.0029847012770567	1.3022494536610292	0.582754145	0.5106386255630547	0.6227491120917765	0.5403671671437559	0.8198241958712472	0.7716717682006555	0.640796873	0.076791284	0.23352266827094267	0.14415755992968735
TG 18:1_19:1_20:1	0.608214701	0.717844897	0	0	0.3733164125097047	0.2831103667535788	0.500606777	0.4961764444380809	0	0.03381157	0.16407624059707826	0.097746758
TG 18:1_19:1_20:2	0.33381736522198246	0.462825107	0.1714722331268145	0.17838106307577664	0.23339259213305344	0.19889316836718332	0.3117372768553806	0.3375929002408948	0.26603926292477115	0.038112461739130826	0.16296293915104196	0.10842078772429588
TG 18:1_19:1_22:1	0.32707613228816823	0.4024150559067822	0.11024223791488622	0.171459515	0.20755322562700576	0.15465742410355565	0.3078419594460667	0.27753502449039397	0.22191618343402705	0.013351302041220304	0.051491669	0.022209261914175864
TG 18:1_19:1_22:3	0.042487206	0.05866172	0.024276672	0.024800670339726764	0.034253823	0.026389155063298145	0.051870988317109755	0.054803774	0.041774361	0.019654724567297582	0.061995825	0.043124073942026005
TG 18:1_19:1_22:4	0.013470729083785623	0.008537799	2.5273998315024265e-5	0.007285058	0.006791619	0.005661259	0.018612686674535413	0.024181766	0.016507527	0.017893399233787313	0.048390444599317184	0.053756142
TG 18:1_19:1_26:1	0.11999379529745019	0.13455736179305353	0.040198285	0.058227889	0.085752284	0.063092483	0.1234856803171609	0.099204175	0.089197511	0.002705902	0.009677808	0.005323089
TG 18:1_20:1_18:2	8.336440719581265	9.80115726	6.004548020426566	4.103272276944023	7.101846362174697	4.923172713659921	8.435782402386694	7.904838523389417	6.713928289253057	0.9655189046979482	3.4016244600691765	2.7932327840180178
TG 18:1_20:1_20:1	5.157906923718403	6.900745475779204	1.840915842540367	2.5407935223186504	3.320158102244633	2.5390866681395776	4.893715910994473	4.566566745028876	4.293670523	0.2544235235802417	1.1796612541930034	0.6299495205006365
TG 18:1_20:1_20:2	0	3.8543135758275304	1.3116689588081707	1.5397918113970264	2.5644921765994995	1.729958340746959	2.859293557835039	2.778619367781223	0	0.3356389976773054	1.4555917472919124	1.0174157417567018
TG 18:1_20:1_22:4	0.3758248559516258	0.4278571747821656	0.16929723515391085	0.19644160983094094	0.2698195149849402	0.18869281077078165	0.4043181389535911	0.46013321388245226	0.3636460303991834	0.19430603736418323	0.5939287091196066	0.643294403
TG 18:1_20:1_26:1	0.7317014100715281	0.881347961	0.2331931901903148	0.393019304	0.5152757499652969	0.3740345615962683	0.7300528384224371	0.6316217645931004	0.59483122	0.009646396	0.034765294	0.016058335380697807
TG 18:1_20:1_26:2	0.7039707053718475	0.8038202918918997	0.2408241217530544	0.3871693419284813	0.5454628622915351	0.4158349661335147	0.6535434665535623	0.5754037941414618	0.5336057314231594	0.015189997	0.055314297	0.031966042
TG 18:1_20:2_26:2	0.35436128073609574	0.37858441056655817	0.10617114994606311	0.18140561140215336	0.2903593435035421	0.2054114309894031	0.3089507749435482	0.27696770266449555	0.23861752097807665	0.019161519	0.065023517	0.049933238
TG 18:1_20:3_26:5	3.555555105339515e-4	0	0	2.606515889930075e-4	0	0	7.568647101747734e-4	0.001453113	7.23188514423602e-4	0.015317307	0.043885153	0.066959549
TG 18:1_22:1_26:1	0.19744012752952583	0.23491571719028026	0.067107308	0.096791507	0.12624599294499292	0.094718606	0.20802995156146878	0.1764337824121354	0.1624645191430978	0.002917679	0.0087941	0.003790002
TG 18:1_22:4_22:4	0.004025604	0.003906735	0	0.001191143	0.001148471	5.455910302564215e-4	0.016010028612880867	0.020172521	0.014386365121285213	0.027181808589011917	0.076083692	0.12754205061029358
TG 18:1_22:4_22:5	0.003318861	0.002267108	0	4.458215582654861e-4	3.179857508893174e-4	2.655687455124221e-4	0.005806058	0.008439401	0.005190588	0.010845849	0.031151637578387695	0.060404242
TG 18:1_23:1_18:2	0.15738243610644076	0.17174732108886898	0.05934536	0.073521937	0.11363132555024368	0.085378199	0.13132875781643621	0.12286573105988499	0.11711411545492953	0.014435330564194339	0.067341876	0.031127253
TG 18:1_24:1_18:2	2.911276334	3.681937610784804	1.1683191054689743	1.550299466490945	2.236986222106337	1.6532120152396999	2.572552827	2.3575451080799827	2.3692650787045695	0.1438856186557334	0.611215483	0.3567394631044808
TG 18:1_24:1_22:4	0.14205821035561747	0.15398286377244624	0.041458539	0.075914008	0.10288660462330843	0.077484788	0.11733613571474069	0.11043751098319673	0.10180634175707691	0.032343832922682496	0.083898791	0.073930676
TG 18:1_24:1_24:2	0.16919424866462743	0.1855451352001467	0.051219648	0.088001687	0.12065484888225682	0.088901228	0.1508105905006888	0.13127202390158468	0.12978755676871606	0.004240055	0.012679038178918295	0.006563122
TG 18:1_24:1_26:1	0.13302987804004526	0.1426262944501188	0.058480847241930145	0.067299301	0.081135978	0.062789603	0.13608363390810946	0.11432713957788186	0.1028880207385935	0.001050759	0.00397466	9.348120175245828e-4
TG 18:1_24:1_26:2	0.078372013	0.08261467	0.03196101	0.042397919	0.053503756	0.039660081998081916	0.080317602	0.060847472	0.061887961	5.717887580725916e-4	0.001848427	0.001006025
TG 18:1_24:3_22:4	0.00983276	0.012667935	0.002521831	0.005549024	0.005495248	0.005242828	0.014710945755891722	0.023273659479723787	0.013157762574004082	0.027540105859344834	0.085230769	0.10429440470230165
TG 18:1_25:1_18:2	0.1713934265302109	0.18622612846167202	0.053748948	0.089000874	0.12367624963209321	0.088593536	0.13975677185399613	0.13072703067549274	0.10957556718017461	0.004751917	0.030398663090530294	0.010974222404946023
TG 18:1_26:1_18:2	2.7607379199127817	3.1234481739345314	1.020947501538653	1.3538619621708836	2.2503911525499842	1.5570177394717666	2.388765555287023	2.109752034872221	1.9145992276388957	0.06333139	0.25497477590486517	0.1359943231449476
TG 18:1_26:1_22:3	0.081062675	0.091847111	0.026813608	0.045572753183887205	0.064698498	0.048591424	0.077624344	0.070766767	0.061744969766965335	0.00531146	0.014587759557718379	0.00610624
TG 18:1_26:1_22:4	0.043282882555304394	0.045097466781379006	0.011441187026475926	0.020998325504713415	0.029164387836892774	0.021334094165058905	0.039710340119316755	0.036780695	0.030384924414729255	0.007573245	0.020093171820074487	0.014347715976132113
TG 18:1_26:1_26:1	0.049295247	0.053601168433972744	0.026581169	0.025102306707561733	0.032620689	0.021082050907507546	0.052706743	0.038882591971743256	0.035556294	5.061376584336908e-5	4.715425188493546e-4	5.648169510942972e-5
TG 18:1_26:1_26:2	0.04593782	0.042924252	0.022584878419137644	0.022714912570663826	0.031927051	0.023195696269178345	0.042438852	0.033958778186988794	0.032820657565083775	5.170753964419256e-5	5.511388407147441e-4	1.0896704386677718e-4
TG 18:1_27:1_18:2	0.075851591	0.091259623	0.026690850838103738	0.042887591	0.057776411	0.045769684	0.073242031	0.060422742610419876	0.057136908537632154	0.001653975	0.006120382	0.002439114
TG 18:2_18:2_18:2	0.5146461624748688	0.6955713161430704	0.7522221800768237	0.3823912789163502	0.3793699569569964	0.397094599	0.30943505139266636	0.3061375763318445	0.30224314380390105	0.036997303838114934	0.085179281	0.094682331
TG 18:2_18:2_18:3	0.10111920848995104	0.12019178947776629	0.10041515048529613	0.070773728	0.076453352	0.067357003	0.083940619	0.075172307	0.067082953	0.027209919809272554	0.066655257	0.071643051
TG 18:2_18:2_20:4	0.038211018	0.043514405	0.033078746819012926	0.024610902549919246	0.022114581055298944	0.025284163943602694	0.034042230008262134	0.024839278836788097	0.0285723	0.006224404	0.019663847553850186	0.021605902422708153
TG 18:2_18:2_22:5	0.061880081474894745	0.06748068	0.031847398	0.026733873654211274	0.028640313447868725	0.025769492	0.049780828	0.048748892	0.038385889	0.015024989776922492	0.047562585559950535	0.067009559
TG 18:2_18:2_26:2	0.24263554389850298	0.27429854876532195	0.09176471	0.13154253781071293	0.18167609728204687	0.14234324928413683	0.1846163422315785	0.2005101516820013	0.1811883361625532	0.082704727	0.2430662850428684	0.23454472373059096
TG 18:2_20:2_22:4	0.1061467666200595	0.12191669189694318	0.033719182858851116	0.048209142	0.056201617	0.040132013	0.1474987441381919	0.1668830645078475	0.12023955085353906	0.076914009	0.24266986414573488	0.36134197749143937
TG 19:0_18:1_20:1	1.9032508043868503	1.9930369621438786	0.6656371030187994	0.8087302583816331	1.0672810948498797	0.8189294553778849	1.5403894767731714	1.5961237052330188	1.3450248154600786	0.13806257664865987	0.42185979467594464	0.3041582353375697
TG 19:1_18:2_20:2	0.11155182050026588	0.15750370602367417	0.05497605	0.070408457	0.09952011	0.066491368	0.1304563658115993	0.13078049789061844	0.10930716787757787	0.030706926414981687	0.10764733796752819	0.095046659
TG 20:3_20:3_20:4	0.006996697	0.009527073	9.580651977338602e-4	0.002486682	0.001967176	0.002794491	0.009508985	0.010668793869944267	0.007463136	0.008651356	0.023877474138377264	0.043043836188045866
TG 24:0_18:1_26:1	0.037502541	0.054976012	0.018885544	0.024687808351143935	0.027942454869723854	0.018266386	0.048567085740137926	0.035879173	0.025703650572401163	4.046346273309558e-4	7.573108970530924e-4	1.0347206763266401e-4
TG 26:0_18:1_20:1	0.1720802451382087	0.2286620666349152	0.063746499	0.12372233079763377	0.14407138171226086	0.10555609607608607	0.23086747208660754	0.18459676771975062	0.13064106113423699	0.003339168	0.009890826	0.003403222
TG 8:0_10:0_10:0	0	0	0	0	0	0.009793072	0	0	0	0	0	0
TG 8:0_12:0_18:1	0.034140795	0.013947641997094204	0.040732242456150945	0.021008391478924922	0	0.009943751	0.023780995714243188	0.027700240306250297	0.017420366	0.003921068	0	0
TG 8:0_8:0_10:0	0	0	0	0	0	0.7535138882867873	0	0	0	0	0	0
TG 8:0_8:0_8:0	0	0	0	0	0	0.6521521199278048	0	0	0	0	0	0
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	Average Rt(min)	Average Mz
CE 18:1	21.977	668.63403
CE 18:2	21.41	666.61768
CE 20:1	22.416	696.66571
CE 20:2	22.01	694.65051
CE 20:3	21.532	692.63239
CE 20:4	21.022	690.61804
CE 22:2	22.434	722.68274
CE 22:6	20.518	714.61975
CE 24:1	23.04	752.72906
CE 26:1	23.274	780.75836
CE 26:2	23.036	778.74469
CE 26:5	22.16	772.69556
CE 28:5	22.545	800.72858
Cer 16:1;2O/23:0	14.845	608.59705
Cer 16:1;2O/24:1	14.17	620.59814
Cer 17:1;2O/24:1	14.775	634.6145
Cer 18:0;2O/16:0	12.128	540.5351
Cer 18:0;2O/18:0	13.373	568.5647
Cer 18:0;2O/22:0	15.886	624.62695
Cer 18:0;2O/24:0	17.206	652.65839
Cer 18:1;2O/14:0	10.314	510.48929
Cer 18:1;2O/16:0	9.147	538.51794
Cer 18:1;2O/18:0	12.956	566.55219
Cer 18:1;2O/20:0	14.187	594.58228
Cer 18:1;2O/22:0	15.444	622.61176
Cer 18:1;2O/23:0	16.094	636.62878
Cer 18:1;2O/24:0	16.753	650.6438
Cer 18:1;2O/24:1	15.388	648.62921
Cer 18:1;2O/24:2	14.324	646.61249
Cer 18:1;2O/25:0	17.413	664.65961
Cer 18:1;2O/25:1	16.021	662.64423
Cer 18:1;2O/26:0	18.078	678.67438
Cer 18:1;2O/26:1	16.656	676.66223
Cer 18:1;2O/26:2	15.54	674.64349
Cer 18:2;2O/18:0	11.874	564.53363
Cer 18:2;2O/23:0	14.988	634.61456
Cer 18:2;2O/26:1	15.551	674.64313
DG 16:0_16:0	13.874	586.53888
DG 16:0_16:1	12.786	584.52295
DG 16:0_18:0	15.112	614.57104
DG 16:0_18:1	13.96	612.55756
DG 16:0_18:2	13.017	610.53888
DG 16:0_22:1	16.374	668.61768
DG 16:0_24:1	17.642	696.64838
DG 16:0_26:1	18.919	724.68158
DG 16:1_18:1	12.904	610.53882
DG 18:0_18:0	16.368	642.60443
DG 18:0_18:1	15.184	640.58899
DG 18:0_20:4	13.981	662.57074
DG 18:0_22:4	14.853	690.60211
DG 18:1_18:1	14.054	638.57166
DG 18:1_18:2	13.129	636.55615
DG 18:1_19:1	14.626	652.58771
DG 18:1_20:1	14.947	666.60199
DG 18:1_20:2	14.234	664.58569
DG 18:1_22:1	16.47	694.63409
DG 18:1_24:1	17.735	722.66425
DG 18:1_26:1	19.013	750.69623
DG 18:1_26:2	17.872	748.68091
DG 18:2_18:2	12.199	634.53925
DG 18:2_20:2	13.336	662.57111
DG 24:1_18:2	16.658	720.65051
LPC 16:0/0:0	2.504	496.33932
LPC 18:0/0:0	3.762	524.37256
LPC 18:1	2.627	522.35675
LPC 18:2	1.992	520.34119
LPE 18:0	3.917	482.32468
SM 30:1;2O	7.348	647.51117
SM 32:1;2O	8.649	675.54199
SM 33:1;2O	9.323	689.55768
SM 34:0;2O	10.512	705.58875
SM 34:1;2O	9.997	703.5758
SM 34:2;2O	8.875	701.55688
SM 36:1;2O	11.387	731.60486
SM 36:2;2O	10.235	729.59064
SM 38:1;2O	12.73	759.63641
SM 40:2;2O	12.718	785.6546
SM 41:1;2O	14.594	801.68622
SM 41:2;2O	13.333	799.67065
SM 42:1;2O	15.269	815.6978
SM 42:2;2O	13.882	813.6815
SM 42:3;2O	12.885	811.6654
SM 44:2;2O	15.175	841.71564
SM 44:3;2O	14.077	839.69794
TG 12:0_14:0_16:0	19.257	740.67767
TG 12:0_14:0_16:1	18.044	738.6601
TG 12:0_14:0_18:1	19.312	766.69006
TG 12:0_14:0_18:2	18.188	764.67542
TG 12:0_16:0_18:2	19.436	792.70862
TG 12:0_16:1_18:2	18.364	790.69092
TG 12:0_18:2_18:2	18.546	816.70557
TG 14:0_14:0_16:0	20.51	768.7077
TG 14:0_15:0_16:0	20.83	782.72223
TG 14:0_15:0_16:1	19.957	780.70667
TG 14:0_16:0_16:0	21.312	796.74054
TG 14:0_16:0_16:1	20.503	794.724
TG 14:0_16:0_17:0	21.579	810.75562
TG 14:0_16:0_17:1	20.973	808.73883
TG 14:0_16:0_18:0	21.836	824.76776
TG 14:0_16:0_18:1	21.325	822.75452
TG 14:0_16:1_17:1	20.087	806.72534
TG 14:0_16:1_18:1	20.592	820.7384
TG 14:0_16:1_18:2	19.581	818.72302
TG 14:0_17:1_18:1	21.025	834.7511
TG 14:0_18:1_18:2	20.726	846.75287
TG 14:0_18:1_20:4	19.99	870.75403
TG 14:0_18:2_18:2	19.752	844.74017
TG 14:0_18:2_18:3	18.793	842.72351
TG 15:0_16:0_18:0	22.013	838.78632
TG 15:0_16:0_18:1	21.613	836.76868
TG 16:0_16:0_18:0	22.229	852.80188
TG 16:0_16:0_18:1	21.845	850.78625
TG 16:0_16:1_17:1	21.1	834.75732
TG 16:0_16:1_18:1	21.367	848.77203
TG 16:0_16:2_18:2	19.76	844.74072
TG 16:0_17:0_18:0	22.372	866.81866
TG 16:0_17:0_18:1	22.037	864.80286
TG 16:0_17:1_18:1	21.622	862.78619
TG 16:0_18:0_18:0	22.542	880.83252
TG 16:0_18:0_18:1	22.228	878.81598
TG 16:0_18:0_19:0	22.655	894.85077
TG 16:0_18:0_20:0	22.797	908.86279
TG 16:0_18:0_20:1	22.536	906.84674
TG 16:0_18:0_22:0	23.013	936.89136
TG 16:0_18:0_24:0	23.199	964.92926
TG 16:0_18:0_26:0	23.366	992.95844
TG 16:0_18:1_18:1	21.855	876.79938
TG 16:0_18:1_18:2	21.43	874.78412
TG 16:0_18:1_19:1	22.051	890.81628
TG 16:0_18:1_20:1	22.233	904.83032
TG 16:0_18:1_22:6	20.861	922.78839
TG 16:0_18:1_24:1	22.772	960.89148
TG 16:0_18:1_25:1	22.229	974.91016
TG 16:0_18:1_26:1	22.986	988.92877
TG 16:0_18:2_20:4	20.448	896.77167
TG 16:0_18:2_22:6	19.963	920.77136
TG 16:0_22:4_22:5	21.043	974.81268
TG 16:0_24:0_18:1	22.996	962.90771
TG 16:0_24:0_26:1	23.659	1075.03357
TG 16:0_24:1_26:1	23.499	1073.02246
TG 16:0_25:0_18:1	23.097	976.91327
TG 16:0_26:0_18:1	23.188	990.94476
TG 16:1_16:1_17:1	20.187	832.7373
TG 16:1_17:1_18:1	21.115	860.76978
TG 16:1_17:1_18:2	20.329	858.7561
TG 16:1_18:1_18:1	23.801	874.78339
TG 16:1_18:1_18:2	20.835	872.76849
TG 16:1_18:2_18:2	19.986	870.75482
TG 16:1_18:2_18:3	19.009	868.74097
TG 17:0_18:0_18:1	22.371	892.83057
TG 17:0_18:1_18:2	21.657	888.80194
TG 17:0_18:1_26:1	23.088	1002.93744
TG 17:1_18:1_18:2	21.188	886.78821
TG 17:1_18:2_18:2	20.442	884.7699
TG 18:0_18:1_19:1	22.376	918.84692
TG 18:0_18:1_20:1	22.531	932.86041
TG 18:0_18:1_26:1	23.176	1016.95654
TG 18:0_19:0_18:1	22.65	920.86334
TG 18:0_20:0_18:1	22.788	934.88196
TG 18:0_22:4_22:4	21.787	1004.86279
TG 18:0_26:0_18:1	23.356	1018.97388
TG 18:0_28:0_18:1	23.502	1047.00269
TG 18:1_18:1_18:1	21.878	902.81403
TG 18:1_18:1_18:2	21.476	900.80316
TG 18:1_18:1_19:1	22.063	916.82928
TG 18:1_18:1_20:1	22.232	930.84406
TG 18:1_18:1_20:4	21.16	924.79956
TG 18:1_18:1_22:4	21.669	952.83417
TG 18:1_18:1_22:5	21.456	950.81598
TG 18:1_18:1_22:6	20.958	948.80273
TG 18:1_18:1_24:1	22.772	986.91119
TG 18:1_18:1_25:1	22.884	1000.92383
TG 18:1_18:1_26:1	22.985	1014.94409
TG 18:1_18:1_26:5	22.12	1006.88177
TG 18:1_18:1_28:5	22.446	1034.90833
TG 18:1_18:2_18:2	20.902	898.78717
TG 18:1_18:2_19:2	21.29	912.80188
TG 18:1_18:2_20:2	21.536	926.81702
TG 18:1_18:2_20:4	20.692	922.78284
TG 18:1_18:2_21:3	21.441	938.81366
TG 18:1_18:2_22:2	21.998	954.84674
TG 18:1_18:2_22:4	21.196	950.81598
TG 18:1_18:2_22:6	20.223	946.78253
TG 18:1_18:2_24:2	22.307	982.8819
TG 18:1_18:2_24:4	21.751	978.84576
TG 18:1_18:2_26:2	22.57	1010.90985
TG 18:1_19:1_18:2	21.702	914.81732
TG 18:1_19:1_20:1	22.357	944.86554
TG 18:1_19:1_20:2	22.102	942.85071
TG 18:1_19:1_22:1	22.653	972.89642
TG 18:1_19:1_22:3	22.143	968.86554
TG 18:1_19:1_22:4	21.893	966.84503
TG 18:1_19:1_26:1	23.08	1028.95508
TG 18:1_20:1_18:2	21.933	928.83392
TG 18:1_20:1_20:1	22.533	958.88208
TG 18:1_20:1_20:2	22.275	956.86505
TG 18:1_20:1_22:4	22.075	980.86023
TG 18:1_20:1_26:1	23.164	1042.97437
TG 18:1_20:1_26:2	22.988	1040.95703
TG 18:1_20:2_26:2	22.814	1038.93799
TG 18:1_20:3_26:5	22.031	1030.87854
TG 18:1_22:1_26:1	23.336	1071.00281
TG 18:1_22:4_22:4	21.506	1002.84918
TG 18:1_22:4_22:5	21.187	1000.83417
TG 18:1_23:1_18:2	22.421	970.87805
TG 18:1_24:1_18:2	22.551	984.89325
TG 18:1_24:1_22:4	22.637	1036.92371
TG 18:1_24:1_24:2	23.17	1068.98425
TG 18:1_24:1_26:1	23.475	1099.0332
TG 18:1_24:1_26:2	23.325	1097.02222
TG 18:1_24:3_22:4	22.157	1032.89038
TG 18:1_25:1_18:2	22.676	998.9068
TG 18:1_26:1_18:2	22.793	1012.92432
TG 18:1_26:1_22:3	23.025	1066.97424
TG 18:1_26:1_22:4	22.858	1064.96057
TG 18:1_26:1_26:1	23.625	1127.06519
TG 18:1_26:1_26:2	23.472	1125.04993
TG 18:1_27:1_18:2	22.883	1026.94043
TG 18:2_18:2_18:2	20.084	896.77173
TG 18:2_18:2_18:3	19.477	894.75757
TG 18:2_18:2_20:4	19.666	920.77124
TG 18:2_18:2_22:5	20.207	946.78363
TG 18:2_18:2_26:2	22.381	1008.89209
TG 18:2_20:2_22:4	21.337	976.83032
TG 19:0_18:1_20:1	21.852	946.88068
TG 19:1_18:2_20:2	21.775	940.82916
TG 20:3_20:3_20:4	20.364	972.80365
TG 24:0_18:1_26:1	23.641	1101.04785
TG 26:0_18:1_20:1	23.341	1044.99036
TG 8:0_10:0_10:0	10.519	544.45715
TG 8:0_12:0_18:1	16.544	682.59955
TG 8:0_8:0_10:0	9.231	516.42596
TG 8:0_8:0_8:0	7.996	488.39487
METABOLITES_END
#END