#METABOLOMICS WORKBENCH zuo_MUSC_20230803_094635 DATATRACK_ID:4200 STUDY_ID:ST002809 ANALYSIS_ID:AN004567 PROJECT_ID:PR001756
VERSION             	1
CREATED_ON             	August 7, 2023, 1:13 pm
#PROJECT
PR:PROJECT_TITLE                 	Role of cilia in mitochondrial function
PR:PROJECT_SUMMARY               	Autosomal dominant polycystic kidney disease (ADPKD), the most common
PR:PROJECT_SUMMARY               	potentially lethal genetic disease in humans and the fourth leading cause of
PR:PROJECT_SUMMARY               	kidney disease, exhibits features of both a ciliary and metabolic disorder. Our
PR:PROJECT_SUMMARY               	previous research revealed that cells overexpressing Exoc5 with elongated cilia
PR:PROJECT_SUMMARY               	demonstrate enhanced recovery from oxidative stress. To investigate the
PR:PROJECT_SUMMARY               	connection between primary cilia and metabolism, we conducted an unbiased
PR:PROJECT_SUMMARY               	metabolomics screen. Global metabolic profiling was performed on canine MDCK
PR:PROJECT_SUMMARY               	cells (Control, Exoc5 ciliary targeting sequence mutation (CTS-mut), Exoc5
PR:PROJECT_SUMMARY               	knockdown (KD), Exoc5 overexpression (OE)) and murine cells (Ift88 knockout
PR:PROJECT_SUMMARY               	(KO), Ift88 rescue). Knockdown (KD) or ciliary targeting sequence mutation
PR:PROJECT_SUMMARY               	(CTS-mut) in Exoc5, a central exocyst component, resulted in cilia loss.
PR:PROJECT_SUMMARY               	Similarly, Ift88 knockout (KO) resulted in cilia loss. For each experimental
PR:PROJECT_SUMMARY               	group, we cultivated six independent replicates of Exoc5 OE, KD, CTS-mut, and
PR:PROJECT_SUMMARY               	control MDCK cells, as well as six independent replicates of murine Ift88 KO and
PR:PROJECT_SUMMARY               	rescue cells. Cell pellets were obtained from the cultures, and we analyzed the
PR:PROJECT_SUMMARY               	global metabolic profiles for all 36 cell pellets. The most significant findings
PR:PROJECT_SUMMARY               	from the metabolomics screen indicated defects in tryptophan metabolism. This
PR:PROJECT_SUMMARY               	discovery suggests a potential link between primary cilia function and
PR:PROJECT_SUMMARY               	tryptophan-related metabolic pathways. Further exploration of these findings may
PR:PROJECT_SUMMARY               	shed light on the underlying mechanisms and implications for ADPKD pathogenesis
PR:PROJECT_SUMMARY               	and metabolic disturbances.
PR:INSTITUTE                     	Medical University of South Carolina
PR:DEPARTMENT                    	Medicine
PR:LAST_NAME                     	Lipschutz
PR:FIRST_NAME                    	Josh
PR:ADDRESS                       	96 Jonathan Lucas St, Charleston, SC 29425
PR:EMAIL                         	lipschut@musc.edu
PR:PHONE                         	843-792-7659
#STUDY
ST:STUDY_TITLE                   	Role of cilia in mitochondrial function
ST:STUDY_TYPE                    	cultured cells
ST:STUDY_SUMMARY                 	Autosomal dominant polycystic kidney disease (ADPKD), the most common
ST:STUDY_SUMMARY                 	potentially lethal genetic disease in humans and the fourth leading cause of
ST:STUDY_SUMMARY                 	kidney disease, exhibits features of both a ciliary and metabolic disorder. Our
ST:STUDY_SUMMARY                 	previous research revealed that cells overexpressing Exoc5 with elongated cilia
ST:STUDY_SUMMARY                 	demonstrate enhanced recovery from oxidative stress. To investigate the
ST:STUDY_SUMMARY                 	connection between primary cilia and metabolism, we conducted an unbiased
ST:STUDY_SUMMARY                 	metabolomics screen. Global metabolic profiling was performed on canine MDCK
ST:STUDY_SUMMARY                 	cells (Control, Exoc5 ciliary targeting sequence mutation (CTS-mut), Exoc5
ST:STUDY_SUMMARY                 	knockdown (KD), Exoc5 overexpression (OE)) and murine cells (Ift88 knockout
ST:STUDY_SUMMARY                 	(KO), Ift88 rescue). Knockdown (KD) or ciliary targeting sequence mutation
ST:STUDY_SUMMARY                 	(CTS-mut) in Exoc5, a central exocyst component, resulted in cilia loss.
ST:STUDY_SUMMARY                 	Similarly, Ift88 knockout (KO) resulted in cilia loss. For each experimental
ST:STUDY_SUMMARY                 	group, we cultivated six independent replicates of Exoc5 OE, KD, CTS-mut, and
ST:STUDY_SUMMARY                 	control MDCK cells, as well as six independent replicates of murine Ift88 KO and
ST:STUDY_SUMMARY                 	rescue cells. Cell pellets were obtained from the cultures, and we analyzed the
ST:STUDY_SUMMARY                 	global metabolic profiles for all 36 cell pellets. The most significant findings
ST:STUDY_SUMMARY                 	from the metabolomics screen indicated defects in tryptophan metabolism. This
ST:STUDY_SUMMARY                 	discovery suggests a potential link between primary cilia function and
ST:STUDY_SUMMARY                 	tryptophan-related metabolic pathways. Further exploration of these findings may
ST:STUDY_SUMMARY                 	shed light on the underlying mechanisms and implications for ADPKD pathogenesis
ST:STUDY_SUMMARY                 	and metabolic disturbances.
ST:INSTITUTE                     	Medical University of South Carolina
ST:DEPARTMENT                    	Medicine
ST:LAST_NAME                     	Lipschutz
ST:FIRST_NAME                    	Josh
ST:ADDRESS                       	96 Jonathan Lucas St, Charleston, SC 29425
ST:EMAIL                         	lipschut@musc.edu
ST:PHONE                         	8437927659
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Mouse/canine
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           	-	MUSC-00277	Genotype:EXOC5_KO	Description=Exoc5 ciliary targeting sequence point mutant MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00278	Genotype:EXOC5_KO	Description=Exoc5 ciliary targeting sequence point mutant MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00279	Genotype:EXOC5_KO	Description=Exoc5 ciliary targeting sequence point mutant MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00280	Genotype:EXOC5_KO	Description=Exoc5 ciliary targeting sequence point mutant MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00281	Genotype:EXOC5_KO	Description=Exoc5 ciliary targeting sequence point mutant MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00282	Genotype:EXOC5_KO	Description=Exoc5 ciliary targeting sequence point mutant MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00283	Genotype:EXOC5_KD	Description=Exoc5 knockdown MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00284	Genotype:EXOC5_KD	Description=Exoc5 knockdown MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00285	Genotype:EXOC5_KD	Description=Exoc5 knockdown MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00286	Genotype:EXOC5_KD	Description=Exoc5 knockdown MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00287	Genotype:EXOC5_KD	Description=Exoc5 knockdown MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00288	Genotype:EXOC5_KD	Description=Exoc5 knockdown MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00289	Genotype:EXOC5_OE	Description=Exoc5 overexpressing MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00290	Genotype:EXOC5_OE	Description=Exoc5 overexpressing MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00291	Genotype:EXOC5_OE	Description=Exoc5 overexpressing MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00292	Genotype:EXOC5_OE	Description=Exoc5 overexpressing MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00293	Genotype:EXOC5_OE	Description=Exoc5 overexpressing MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00294	Genotype:EXOC5_OE	Description=Exoc5 overexpressing MDCK cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00295	Genotype:WT	Description=MDCK wild-type control cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00296	Genotype:WT	Description=MDCK wild-type control cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00297	Genotype:WT	Description=MDCK wild-type control cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00298	Genotype:WT	Description=MDCK wild-type control cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00299	Genotype:WT	Description=MDCK wild-type control cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00300	Genotype:WT	Description=MDCK wild-type control cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00301	Genotype:IFT88_KO	Description=Intraflagellar transport protein 88 (Ift88) null mouse cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00302	Genotype:IFT88_KO	Description=Intraflagellar transport protein 88 (Ift88) null mouse cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00303	Genotype:IFT88_KO	Description=Intraflagellar transport protein 88 (Ift88) null mouse cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00304	Genotype:IFT88_KO	Description=Intraflagellar transport protein 88 (Ift88) null mouse cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00305	Genotype:IFT88_KO	Description=Intraflagellar transport protein 88 (Ift88) null mouse cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00306	Genotype:IFT88_KO	Description=Intraflagellar transport protein 88 (Ift88) null mouse cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00307	Genotype:IFT88_KO_WT	Description=Ift88 rescue mouse cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00308	Genotype:IFT88_KO_WT	Description=Ift88 rescue mouse cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00309	Genotype:IFT88_KO_WT	Description=Ift88 rescue mouse cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00310	Genotype:IFT88_KO_WT	Description=Ift88 rescue mouse cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00311	Genotype:IFT88_KO_WT	Description=Ift88 rescue mouse cells
SUBJECT_SAMPLE_FACTORS           	-	MUSC-00312	Genotype:IFT88_KO_WT	Description=Ift88 rescue mouse cells
#COLLECTION
CO:COLLECTION_SUMMARY            	Six independent replicates of Exoc5 OE, KD, CTS-mut, and control MDCK cells were
CO:COLLECTION_SUMMARY            	grown in cell culture in 15 cm dishes. The cells were then washed in PBS,
CO:COLLECTION_SUMMARY            	scraped, and centrifuged to a pellet and snap frozen in liquid nitrogen.
CO:COLLECTION_SUMMARY            	Similarly six independent replicates of murine Ift88 KO and rescue cells were
CO:COLLECTION_SUMMARY            	grown in cell culture, washed with PBS, scraped, centrifuged to a pellet and
CO:COLLECTION_SUMMARY            	snap frozen in liquid nitrogen.
CO:SAMPLE_TYPE                   	Cultured kidney cells
#TREATMENT
TR:TREATMENT_SUMMARY             	No treatment
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Samples were thawed on ice prior to extraction. Samples were prepared using the
SP:SAMPLEPREP_SUMMARY            	automated MicroLab STAR® system from Hamilton Company. Several recovery
SP:SAMPLEPREP_SUMMARY            	standards were added prior to the first step in the extraction process for QC
SP:SAMPLEPREP_SUMMARY            	purposes. In order to dissociate small molecules bound to or trapped in
SP:SAMPLEPREP_SUMMARY            	proteins, lysate was precipitated with methanol under vigorous shaking for 2 min
SP:SAMPLEPREP_SUMMARY            	(Glen Mills GenoGrinder 2000) followed by centrifugation. The resulting extract
SP:SAMPLEPREP_SUMMARY            	was divided into multiple fractions: two for analysis by two separate reverse
SP:SAMPLEPREP_SUMMARY            	phase (RP)/UPLC-MS/MS methods with positive ion mode electrospray ionization
SP:SAMPLEPREP_SUMMARY            	(ESI), one for analysis by RP/UPLC-MS/MS with negative ion mode ESI, one for
SP:SAMPLEPREP_SUMMARY            	analysis by HILIC/UPLC-MS/MS with negative ion mode ESI, and remaining fractions
SP:SAMPLEPREP_SUMMARY            	reserved for backup. Samples were dried under warm nitrogen to remove the
SP:SAMPLEPREP_SUMMARY            	organic solvent. The sample extracts were stored sealed at -80oC if not analyzed
SP:SAMPLEPREP_SUMMARY            	immediately.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	Low pH Lipophilic
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
CH:INSTRUMENT_NAME               	Waters Acquity
CH:COLUMN_NAME                   	Waters Acquity BEH C18 (100 x 2mm, 1.7um)
CH:SOLVENT_A                     	0.1% formic acid and 0.05% PFPA in water, pH ~2.5
CH:SOLVENT_B                     	0.1% formic acid and 0.05% PFPA in 50% methanol/ 50% acetonitrile, pH ~2.5
CH:FLOW_GRADIENT                 	Linear gradient from 40 % B to 99.5% B over 1.0 minute, hold 99.5% B for 2.4
CH:FLOW_GRADIENT                 	minutes
CH:FLOW_RATE                     	0.60 mL/min
CH:COLUMN_TEMPERATURE            	65
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Thermo Q Exactive Orbitrap
MS:INSTRUMENT_TYPE               	Orbitrap
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	POSITIVE
MS:MS_COMMENTS                   	Proprietary analytical software for integration and peak picking (Metabolon). Normalized raw
MS:MS_COMMENTS                   	area counts for each sample are normalized by Bradford protein concentration.
MS:MS_COMMENTS                   	Each metabolite is then rescaled to set the median equal to 1. Lastly, missing
MS:MS_COMMENTS                   	values are imputed with the minimum.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	Normalized/scaled raw area counts
MS_METABOLITE_DATA_START
Samples	MUSC-00277	MUSC-00278	MUSC-00279	MUSC-00280	MUSC-00281	MUSC-00282	MUSC-00283	MUSC-00284	MUSC-00285	MUSC-00286	MUSC-00287	MUSC-00288	MUSC-00289	MUSC-00290	MUSC-00291	MUSC-00292	MUSC-00293	MUSC-00294	MUSC-00295	MUSC-00296	MUSC-00297	MUSC-00298	MUSC-00299	MUSC-00300	MUSC-00301	MUSC-00302	MUSC-00303	MUSC-00304	MUSC-00305	MUSC-00306	MUSC-00307	MUSC-00308	MUSC-00309	MUSC-00310	MUSC-00311	MUSC-00312
Factors	Genotype:EXOC5_KO	Genotype:EXOC5_KO	Genotype:EXOC5_KO	Genotype:EXOC5_KO	Genotype:EXOC5_KO	Genotype:EXOC5_KO	Genotype:EXOC5_KD	Genotype:EXOC5_KD	Genotype:EXOC5_KD	Genotype:EXOC5_KD	Genotype:EXOC5_KD	Genotype:EXOC5_KD	Genotype:EXOC5_OE	Genotype:EXOC5_OE	Genotype:EXOC5_OE	Genotype:EXOC5_OE	Genotype:EXOC5_OE	Genotype:EXOC5_OE	Genotype:WT	Genotype:WT	Genotype:WT	Genotype:WT	Genotype:WT	Genotype:WT	Genotype:IFT88_KO	Genotype:IFT88_KO	Genotype:IFT88_KO	Genotype:IFT88_KO	Genotype:IFT88_KO	Genotype:IFT88_KO	Genotype:IFT88_KO_WT	Genotype:IFT88_KO_WT	Genotype:IFT88_KO_WT	Genotype:IFT88_KO_WT	Genotype:IFT88_KO_WT	Genotype:IFT88_KO_WT
1-(1-enyl-oleoyl)-GPE (P-18:1)*	0.78	0.7073	0.6834	0.6788	0.6932	0.8482	0.6449	0.7657	0.6122	0.5815	1.0638	0.7066	1.02	1.1411	0.98	1.068	1.2038	1.1738	1.2659	2.1119	2.7457	2.4261	1.5506	1.3069	1.2146	0.9202	0.9871	1.1111	1.0129	1.4694	0.8889	0.7369	0.8621	0.615	1.2404	1.2346
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20:4)*																									0.9134	0.8442	0.841	0.9552	0.8225	0.8864	1.1773	1.0448	1.1544	1.1338	1.1955	1.2077
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20:4)*	0.8817	0.8927	0.9293	0.7815	0.7804	0.9704	1.1871	1.1265	0.9373	1.0534	1.4295	1.1703	1.5912	1.2655	1.2252	1.1164	1.0578	1.5201	0.9569	0.9703	1.0296	0.9061	0.858	0.969	0.7746	0.7053	0.7284	0.8068	0.716	0.8066	1.4505	1.1932	1.393	1.3269	1.4712	1.4144
1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2)*																									0.971	1.2554	0.7988	1.1137	0.9469	1.0466	1.1303	0.9261	1.0634	0.8836	1.029	0.6332
1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)*	1.1509	1.0938	0.7703	0.9645	1.0071	1.1884	1.0605	0.9729	1.054	1.2209	1.3735	1.0483	0.8498	0.8558	0.6493	0.7706	0.7622	0.7312	0.8692	1.1655	1.2002	0.9929	1.0807	0.9581	1.0864	0.7625	0.9294	1.0301	0.9699	1.1321	0.8866	1.2486	0.854	0.9028	1.6146	1.3065
1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1)*	1.0492	0.9014	0.9063	0.7719	0.7489	1.0543	0.8424	0.8182	0.8322	0.7308	1.1677	0.9129	1.971	1.7663	1.6608	1.585	1.4046	1.9731	0.963	1.0173	1.1074	1.0465	0.9532	0.9827	1.1374	0.9923	1.0077	1.0284	0.9874	1.1474	0.9853	0.91	0.9591	0.9468	1.179	1.246
1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1)*	0.8557	0.8044	0.7381	0.7432	0.7448	0.8704	0.9507	1.0191	0.9421	0.9303	1.2469	1.0656	1.2334	1.0439	0.9993	1.0081	0.9711	1.2005	1.0007	1.0538	1.1441	1.0958	0.9333	1.0144	0.943	0.7626	0.7948	0.8178	0.7941	0.9815	1.2392	1.0185	1.0398	1.0542	1.3713	1.4513
1-(1-enyl-palmitoyl)-2-palmitoleoyl-GPC (P-16:0/16:1)*	0.6855	0.6167	0.6054	0.4911	0.5191	0.71	0.958	0.9848	0.9261	0.8023	1.2377	1.0152	2.2706	1.8163	1.8356	1.6686	1.6492	1.9785	1.0251	1.0229	1.0645	1.051	0.9529	0.9819	0.9265	0.8684	0.8336	0.8853	0.8217	0.995	1.189	1.0411	1.1339	1.005	1.2603	1.3835
1-(1-enyl-palmitoyl)-2-palmitoyl-GPC (P-16:0/16:0)*																									0.8957	0.7423	0.8156	0.8144	0.7506	0.8849	1.2628	1.1043	1.1781	1.1469	1.412	1.4693
1-(1-enyl-palmitoyl)-GPC (P-16:0)*	0.5356	0.4148	0.3609	0.3609	0.3609	0.6403	0.3609	0.3609	0.3609	0.3609	0.3609	0.3609	1.0874	1.2101	0.9992	1.0008	1.1499	1.3881	0.8058	1.3211	1.639	1.5806	0.8899	0.8239	1.2844	0.9341	1.0659	0.8749	0.9293	1.1407	0.8526	0.7922	1.1102	0.7948	1.3511	1.2115
1-(1-enyl-palmitoyl)-GPE (P-16:0)*	0.508	0.4905	0.4354	0.4299	0.4412	0.5859	0.6536	0.8088	0.6319	0.6518	1.1211	0.7223	1.2115	1.3606	1.2707	1.3652	1.5291	1.4202	1.0109	1.7082	2.255	1.9101	1.1527	0.9891	0.9605	0.7778	0.8254	0.8261	0.671	1.0587	1.2482	1.0395	1.1226	0.9504	1.5434	1.5735
1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:4)*	0.9448	0.772	0.8826	0.795	0.7153	0.924	1.1155	1.0349	0.877	0.905	1.2527	1.0877	2.5392	2.0079	1.8482	1.9111	1.7205	2.3724	0.9791	0.9329	0.9231	1.0209	0.9621	1.0404	0.9511	0.8644	0.8319	0.9399	0.8842	0.9885	1.2017	1.0115	1.1683	1.1125	1.29	1.3891
1-(1-enyl-stearoyl)-2-linoleoyl-GPE (P-18:0/18:2)*	0.9828	0.9264	0.8927	0.8294	0.8417	0.9822	1.0041	1.0224	0.9323	0.9455	1.2657	1.0426	1.2701	1.0306	0.9959	0.958	0.9365	1.14	1.0048	1.0299	1.1243	1.1042	0.9338	1.0278												
1-(1-enyl-stearoyl)-2-oleoyl-GPE (P-18:0/18:1)	1.2094	1.0182	0.4328	0.967	0.9818	1.2138	0.6423	0.6094	1.1076	1.1325	0.8249	0.6466	1.1673	1.6066	0.9236	1.3927	1.3131	1.15	0.6347	1.282	1.6004	0.727	0.6406	0.7264	1.2726	0.8887	1.2043	0.9933	0.8668	1.4755	0.8988	1.0067	0.8814	0.8061	1.1855	1.3478
1-(1-enyl-stearoyl)-GPE (P-18:0)*	0.6242	0.519	0.563	0.4473	0.4868	0.5971	0.5943	0.7144	0.6069	0.6337	0.9456	0.6839	1.8823	1.7955	1.7096	1.7552	2.0177	1.8615	1.0544	1.5219	2.1562	1.6656	1.2642	1.2448	1.1482	0.9774	1.0547	0.9898	0.8551	1.3604	0.9633	0.9149	1.0102	0.8746	1.2966	1.314
1,2-dioleoyl-GPC (18:1/18:1)																									1.0087	0.9654	0.9048	1.0294	0.9687	1.0831	0.9971	0.8439	1.0029	0.9933	1.109	1.1585
1,2-dioleoyl-GPE (18:1/18:1)	0.8842	0.84	0.8398	0.7582	0.7554	0.9072	1.0368	1.029	0.8355	0.9246	1.2583	1.1147	1.3016	1.0487	0.9614	0.9902	0.8592	1.225	1.0098	1.0157	1.0501	1.0677	0.9353	1.0512	1.0025	0.8612	0.8199	0.9069	0.8754	1.038	1.0934	0.8878	1.013	0.9975	1.1501	1.316
1,2-dioleoyl-GPS (18:1/18:1)																									0.9827	0.7363	0.8887	0.824	0.6759	1.0403	1.0337	1.0747	1.0111	0.9889	1.2595	1.5152
1,2-dipalmitoyl-GPC (16:0/16:0)	0.3687	0.3799	0.469	0.3386	0.3691	0.4272	1.5431	1.3538	1.0752	1.287	1.57	1.2658	2.1609	1.8301	1.7288	1.7725	1.6433	2.0567	0.7755	0.7006	0.8182	0.9248	0.7643	0.7576	0.8488	0.781	0.8176	0.8984	0.7777	0.8383	1.3787	1.1016	1.383	1.2747	1.2974	1.4337
1,2-dipalmitoyl-GPE (16:0/16:0)*	0.4881	0.4528	0.6032	0.5158	0.3921	0.4977	0.9966	1.065	0.8211	1.0547	1.3774	1.0174	1.5175	1.2141	1.3158	1.3458	1.5325	1.702	0.8925	0.8493	1.0242	0.9951	1.0034	0.9038	0.8722	0.7274	0.7957	0.7595	0.6875	0.8889	1.383	1.1111	1.3699	1.3861	1.4932	1.6599
1,2-distearoyl-GPC (18:0/18:0)																									1.9821	0.9888	0.6862	1.3083	1.075	2.0302	0.9339	0.7952	0.6862	0.6862	0.837	1.0112
1-arachidonoyl-GPI* (20:4)*	0.9231	0.6222	0.9782	0.4944	0.6207	1.1616	1.8954	1.5274	0.795	1.0143	2.6007	2.1294	1.0731	1.0358	1.3771	1.0511	0.9593	1.2285	1.0395	0.8628	0.9123	0.9857	0.9596	0.9742	1.9556	0.8993	0.5394	0.7238	0.5598	0.9885	0.3346	1.6149	3.1282	1.0594	1.9975	1.0115
1-cerotoyl-GPC (26:0)*	0.5897	0.5468	0.5249	0.3518	0.3731	0.6143	0.7036	0.7533	0.6732	0.6513	0.9343	0.7534	2.7931	2.2933	2.0938	2.0286	1.8503	2.4054	1.2332	1.4696	1.3642	1.4267	1.0657	1.1143												
1-lignoceroyl-GPC (24:0)	0.5158	0.4493	0.3833	0.322	0.389	0.5577	0.8563	0.7565	0.6411	0.7489	1.0122	0.9878	1.9843	2.1741	1.6584	1.6586	1.6701	1.9232	1.0919	1.3607	1.3196	1.3054	0.9144	1.0816	1.3293	1.0188	1.2267	1.1455	0.9248	1.4838	0.8364	0.7184	0.7032	0.6974	1.0778	0.9812
1-linoleoyl-GPC (18:2)	1.1288	0.775	0.7684	0.5802	0.6283	0.9677	0.8404	0.9643	0.724	0.7717	1.1125	0.9834	1.6166	1.3668	1.1573	0.5802	1.2604	0.5802	1.0166	1.2464	1.7597	1.5766	0.9789	1.2127	1.0709	0.7928	0.9891	1.0326	0.7447	1.3697	0.7762	0.7876	1.0109	0.8771	1.4486	1.3425
1-linoleoyl-GPE (18:2)*	1.0296	0.8765	0.7584	0.6944	0.7794	1.0169	0.7983	0.8306	0.7069	0.7506	1.0689	0.9831	1.1975	1.1821	1.0263	1.0894	1.0349	1.1157	0.9479	1.1216	1.246	1.0927	0.8832	0.9622	2.6788	1.0647	0.2925	0.7107	0.4675	1	0.2925	0.488	1.3402	0.2925	1.3625	0.2925
1-myristoyl-2-arachidonoyl-GPC (14:0/20:4)*	1.1041	0.9512	1.0949	0.8549	0.9703	0.8076	1.1262	1.2322	0.8569	1.1883	1.1314	1.3379	1.2408	0.9397	0.9285	0.9033	0.5653	1.1642	1.017	0.9818	1.1151	0.983	0.8309	1.0308	0.8577	0.6725	0.7337	0.7927	0.7032	0.9039	1.3721	1.1248	1.1655	1.0961	1.4652	1.4501
1-myristoyl-2-palmitoyl-GPC (14:0/16:0)	0.3102	0.2741	0.3646	0.279	0.2611	0.341	1.3443	1.3764	1.1497	1.31	1.5618	1.5994	1.8962	1.5456	1.3983	1.2937	1.2393	1.7023	0.7241	0.7833	0.8503	0.7918	0.7304	0.7209	0.877	0.8089	0.8707	0.9248	0.832	0.9073	1.2497	1.0752	1.1533	1.1584	1.2198	1.2488
1-oleoyl-2-arachidonoyl-GPE (18:1/20:4)*	1.1248	1.0354	1.1347	0.8759	0.8902	1.123	1.1134	1.0861	0.8862	0.9646	1.2694	1.1717	1.1316	0.751	0.7902	0.7112	0.7342	0.9225	1.0649	0.8368	1.0621	0.9349	0.8259	1.0718	0.8333	0.735	0.7689	0.8179	0.6948	0.8876	1.4003	1.1704	1.3702	1.1124	1.545	1.7223
1-oleoyl-2-arachidonoyl-GPI (18:1/20:4)*																									0.8678	0.8713	0.7947	1.0198	0.8142	0.9643	1.3635	0.9802	1.2957	1.1931	1.4052	1.4601
1-oleoyl-2-docosahexaenoyl-GPC (18:1/22:6)*	1.1162	0.8788	1.0356	0.7943	0.7592	1.1876	0.7774	0.9452	0.7759	0.7987	1.0612	0.9793	1.8188	1.6102	1.3159	1.3043	1.1962	1.5936	0.9006	1.0665	1.0158	0.9842	0.7687	0.8925	1.1934	0.9098	1.1506	1.2122	0.9983	1.2942	0.9208	0.7967	0.8884	0.8369	1.0017	1.0582
1-oleoyl-2-docosahexaenoyl-GPE (18:1/22:6)*																									0.9297	0.8462	0.9135	0.9529	0.9612	1.0388	1.1523	0.9353	1.0489	1.1025	1.0981	1.2265
1-oleoyl-2-linoleoyl-GPE (18:1/18:2)*																									0.8596	0.7579	0.7552	0.983	0.7447	0.878	1.2635	1.017	1.0605	1.1717	1.2369	1.2585
1-oleoyl-GPG (18:1)*	0.9769	0.9218	0.854	0.72	0.8664	1.2626	0.9421	1.0052	0.7709	0.8975	1.3002	1.2984	1.9399	1.3046	1.0969	0.6392	0.9399	1.273	1.0826	1.1035	1.3223	0.9778	0.9948	1.3756	2.5275	1	0.5451	0.3463	0.4403	0.8987	0.3463	1.8823	1.8957	0.7746	2.2388	1.0296
1-oleoyl-GPS (18:1)	0.5402	0.5082	0.6184	0.4643	0.4647	0.5269	0.7026	0.839	0.5344	0.6144	1.1864	0.9557	1.0677	1.0552	1.0372	0.9628	1.1201	1.448	1.1935	1.2767	1.6357	1.5887	1.097	1.1992	2.032	1.1061	0.5153	0.7758	0.5264	1.0142	0.3322	1.1362	1.4061	0.7548	1.6077	0.9858
1-palmitoleoyl-2-oleoyl-GPC (16:1/18:1)*																									0.8576	0.7916	0.8095	0.8575	0.8165	0.9453	1.2439	1.0547	1.14	1.1755	1.301	1.3484
1-palmitoleoyl-2-oleoyl-GPE (16:1/18:1)*																									0.7075	0.617	0.6399	0.718	0.6482	0.7414	1.4557	1.2586	1.3885	1.3891	1.5446	1.508
1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6)	1.048	0.8195	0.9537	0.7786	0.8079	1.1475	1.1092	1.2305	0.8281	1.0824	1.5007	1.2428	1.6125	1.243	1.1062	0.9449	0.8734	1.3135	1.0463	0.8056	0.9249	0.8625	0.8658	0.9473	0.9148	0.7589	0.9056	0.8429	0.7373	0.9199	1.3258	1.1012	1.1787	1.0801	1.4451	1.4992
1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4)*	1.1587	1.1376	1.1204	0.9855	0.9736	1.2656	1.3974	1.2832	0.9861	1.2256	1.6729	1.5532	0.936	0.6188	0.6699	0.5518	0.6851	0.8076	1.049	0.9695	0.9497	1.0139	0.8746	1.0998	0.6335	0.6112	0.6742	0.6479	0.5526	0.7694	1.5944	1.346	1.3956	1.2306	1.6094	1.8293
1-palmitoyl-2-arachidonoyl-GPI (16:0/20:4)*	0.5414	0.5271	0.7752	0.5763	0.3851	0.8378	2.2396	1.7272	1.2513	1.3676	2.2001	2.167	1.8287	1.1799	1.3147	1.0211	0.9874	1.6451	1.0126	0.5842	0.7835	0.9011	0.9117	0.8797	0.7267	0.5877	0.6855	0.6878	0.5906	0.6766	1.282	1.2847	1.2775	1.2733	1.4722	1.7311
1-palmitoyl-2-docosahexaenoyl-GPC (16:0/22:6)	1.0696	0.9064	1.1366	0.7875	0.7356	1.1717	0.8823	1.0954	0.7563	0.9368	1.2185	1.1673	1.7031	1.4576	1.2241	1.2023	1.0399	1.4491	0.8369	0.9601	0.8591	0.9333	0.7059	0.7286	1.0367	0.7731	0.9915	1.0085	0.8138	1.0131	1.0218	0.8904	0.977	0.8999	1.0945	1.2029
1-palmitoyl-2-docosahexaenoyl-GPE (16:0/22:6)*	0.7549	0.86	0.8977	0.5456	0.7696	0.8431	1.1361	1.3574	1	1.3043	1.6084	1.4749	1.3155	1.0197	1.1356	0.7812	0.7841	0.5456	0.992	0.9211	1.0905	1.1078	0.9003	1.118	0.684	0.6545	0.6662	0.8439	0.7949	0.8114	1.4113	1.1561	1.3499	1.3027	1.3518	1.5359
1-palmitoyl-2-gamma-linolenoyl-GPC (16:0/18:3n6)*																									0.8215	0.6661	0.8127	0.7791	0.6504	0.8394	1.3493	1.1606	1.2235	1.2538	1.6056	1.5954
1-palmitoyl-2-linoleoyl-GPC (16:0/18:2)	0.8155	0.7431	0.8002	0.6844	0.6626	0.866	1.0532	1.094	0.9161	0.9902	1.3693	1.2058	1.4214	1.1293	1.0509	0.9774	0.9212	1.3288	0.9897	1.0098	1.0768	1.0434	0.9248	1.0361												
1-palmitoyl-2-oleoyl-GPC (16:0/18:1)	0.7347	0.712	0.7778	0.6534	0.6407	0.8264	1.1042	1.0395	0.86	0.977	1.3157	1.0721	1.5851	1.2761	1.2366	1.2296	1.1233	1.5366	0.9406	0.9279	1.0357	1.0008	0.8987	0.9992	0.9356	0.8849	0.8673	0.9643	0.8927	0.9749	1.2548	1.0251	1.2867	1.2302	1.3286	1.4421
1-palmitoyl-2-oleoyl-GPE (16:0/18:1)	0.7661	0.7088	0.7332	0.6547	0.6364	0.7903	1.1511	1.1051	0.8771	1.0061	1.3603	1.2095	1.4026	1.1745	1.0604	1.1226	0.9939	1.3509	0.9539	0.9775	1.0158	1.0651	0.9043	0.9939	0.7648	0.6466	0.66	0.691	0.6452	0.7445	1.5064	1.2352	1.33	1.2997	1.4387	1.6499
1-palmitoyl-2-oleoyl-GPI (16:0/18:1)*	0.6164	0.5565	0.6428	0.5168	0.5775	0.7682	1.2437	1.243	1.0022	1.1401	1.421	1.2955	1.7463	1.5682	1.4229	1.3276	1.2406	1.639	0.9005	0.9694	0.9978	0.952	0.838	0.9525	0.6799	0.5935	0.609	0.58	0.6147	0.7649	1.2577	1.2351	1.2882	1.2886	1.6109	1.8777
1-palmitoyl-2-oleoyl-GPS (16:0/18:1)																									0.7796	0.6833	0.7542	0.4673	0.4209	0.5134	1.4604	1.2712	1.2845	1.2204	1.4182	1.5181
1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1)*	0.6584	0.6125	0.6667	0.5717	0.5558	0.7086	1.1228	1.1604	1.0111	1.0805	1.4463	1.3938	1.4865	1.2798	1.1151	1.0899	0.9889	1.4693	0.9022	0.9838	1.0583	0.9532	0.8577	0.9717	0.7936	0.713	0.7657	0.7908	0.7344	0.8517	1.3971	1.1483	1.2926	1.3095	1.4041	1.5157
1-palmitoyl-2-stearoyl-GPC (16:0/18:0)	0.6354	0.5281	0.7069	0.5134	0.5325	0.6441	1.1599	1.1172	0.9124	0.9945	1.3645	1.1279	3.0466	2.3719	2.5133	2.0686	2.0724	2.8463	0.851	0.8632	1.0055	1.0098	0.8651	0.8876	1.0774	1.0193	0.9905	1.0844	0.9809	1.0095	1.0986	0.8923	0.9394	0.9044	0.9861	1.1157
1-palmitoyl-2-stearoyl-GPE (16:0/18:0)*																									0.901	0.8573	0.8135	1.0344	0.8615	1.0529	1.026	0.8448	1.002	0.998	1.059	1.1499
1-palmitoyl-GPC (16:0)	0.8815	0.6081	0.6597	0.4762	0.5248	0.9627	0.8573	0.937	0.6129	0.8138	0.999	1.001	1.1681	1.1986	1.0494	0.9482	1.014	1.1758	1.0592	1.5376	1.8635	1.7653	1.0431	1.0041	1.0759	0.7483	0.9491	0.8212	0.7184	1.1016	1.158	0.8925	1.0509	0.8692	1.5537	1.5666
1-palmitoyl-GPE (16:0)	0.998	0.8621	0.8013	0.7587	0.8762	1.0918	1.002	1.1645	0.8976	1.0037	1.4528	1.2438	0.8395	0.8261	0.6843	0.717	0.6827	0.8951	1.2127	1.5344	1.8534	1.5537	1.1264	1.3058	0.8917	0.5943	0.8149	0.6665	0.5883	0.9319	1.3313	1.0857	1.224	1.0681	1.6415	1.8534
1-stearoyl-2-arachidonoyl-GPC (18:0/20:4)	0.8266	0.7974	0.8236	0.6844	0.7294	0.9053	1.0206	0.9914	0.7818	0.9749	1.2037	0.9553	1.9036	1.4932	1.2961	1.3224	1.1581	1.752	1.084	1.0086	1.1564	0.8833	0.9379	1.0351	1.0284	0.9287	1.0533	1.086	1.0428	0.9568	1.0595	0.8091	1.0008	0.9992	0.9455	0.9187
1-stearoyl-2-arachidonoyl-GPE (18:0/20:4)	1.0412	1.0264	0.916	0.8785	0.9066	1.0721	1.0692	0.973	1.0255	0.9847	1.3442	1.1472	1.3362	1.0532	0.9809	1.0423	0.9777	1.1936	0.8761	0.972	1.0153	0.936	0.8054	0.8925	0.966	0.86	0.8958	0.9449	0.8295	0.9822	1.2349	1.0178	1.1134	1.0565	1.2748	1.3391
1-stearoyl-2-arachidonoyl-GPI (18:0/20:4)	1.1721	1.0323	1.0023	0.9977	0.9408	1.4277	1.0286	1.1349	1.0534	1.1796	1.1766	1.1326	1.1433	0.9705	0.7828	1.004	0.8909	0.9092	0.7678	0.8947	0.9301	0.5492	0.561	0.8257	0.9864	0.8255	0.8498	0.9563	0.8943	1.1094	1.1714	1.0136	1.0912	0.9494	1.2337	1.2538
1-stearoyl-2-arachidonoyl-GPS (18:0/20:4)																									0.9254	0.6283	1.0936	1.0522	0.6759	1.1617	0.9848	1.0373	0.8363	0.9511	1.0152	1.2466
1-stearoyl-2-docosahexaenoyl-GPC (18:0/22:6)	0.8909	0.73	0.7622	0.6234	0.6043	0.8656	0.9073	1.0399	0.8311	0.7763	1.1126	0.9966	1.9974	1.4726	1.502	1.3088	1.2546	1.6338	1.0872	1.0678	1.0505	1.0034	0.9094	0.9617	1.3018	1.086	1.1232	1.1979	1.0876	1.2642	0.8104	0.6025	0.7627	0.6096	0.7602	0.914
1-stearoyl-2-docosahexaenoyl-GPE (18:0/22:6)*	0.9241	0.9765	0.9559	0.8171	0.795	0.8716	1.1604	0.8962	1.0359	0.8065	1.0801	1.032	1.5155	1.287	1.1922	1.1713	1.2301	1.3476	1.0394	0.949	1.0235	0.857	0.9023	0.9477	0.9575	0.8631	0.8488	0.9332	0.8794	0.9978	1.1035	1.0067	1.141	1.0022	1.1434	1.368
1-stearoyl-2-linoleoyl-GPI (18:0/18:2)	0.8984	0.9071	0.6646	0.7954	0.7839	0.8698	1.1531	1.0033	0.8874	1.0554	1.5788	1.5059	1.6129	1.0318	0.9821	0.6846	1.0074	1.3042	0.9475	1.1181	1.1298	0.9967	0.7239	1.0425												
1-stearoyl-2-linoleoyl-GPS (18:0/18:2)																									0.9952	1.0567	0.9689	1.1188	1.0048	1.1445	1.1739	0.8287	0.9865	0.8289	1.0244	0.8644
1-stearoyl-2-oleoyl-GPC (18:0/18:1)	0.7791	0.677	0.71	0.607	0.6296	0.7951	0.9466	1.0022	0.8431	0.881	1.1905	0.9922	1.919	1.5211	1.4833	1.3307	1.2541	1.7869	0.9978	1.0498	1.1251	1.0759	0.9211	1.0526	1.0827	0.9924	0.9169	1.0061	0.9957	1.1248	1.0043	0.8082	0.8689	0.8496	1.0138	1.105
1-stearoyl-2-oleoyl-GPE (18:0/18:1)	0.7422	0.7437	0.7537	0.6836	0.6656	0.7081	0.9973	0.9562	0.82	0.8327	1.2059	0.9718	1.6558	1.2445	1.3057	1.2221	1.178	1.6231	1.0288	0.9542	1.0353	1.0543	1.0027	1.0186	1.016	0.9123	0.8031	1.0509	0.9111	1.1153	1.1157	0.92	0.984	0.9141	1.0769	1.1592
1-stearoyl-2-oleoyl-GPI (18:0/18:1)*	0.8575	0.7361	0.7686	0.6878	0.693	0.8377	0.9712	0.9843	0.8684	0.9191	1.1876	1.0421	2.0474	1.8379	1.683	1.5349	1.5423	1.7981	0.9932	1.1979	1.2215	1.0816	0.9691	1.0068	0.8789	0.7256	0.7535	0.6625	0.7554	0.9281	1.0719	1.1178	1.1459	1.1572	1.4931	1.703
1-stearoyl-2-oleoyl-GPS (18:0/18:1)	0.7662	0.6803	0.6865	0.6543	0.6265	0.8158	1.0129	0.9167	0.817	0.879	1.2337	1.0441	1.5711	1.2314	1.1931	1.1382	1.0901	1.4641	0.9871	0.9746	1.0966	1.0808	0.9332	1.028	1.1192	0.942	1.0241	1.0188	0.9577	1.1389	0.9812	0.889	0.9498	0.9074	1.0556	1.104
1-stearoyl-GPC (18:0)	0.6732	0.4931	0.4727	0.3123	0.4245	0.7001	0.6709	0.7598	0.5844	0.5863	0.9196	0.8745	1.6159	1.4795	1.2747	1.17	1.4194	1.4397	1.2692	1.7924	2.2028	1.9219	1.242	1.0804	1.4087	0.8944	1.0859	1.0472	0.9528	1.3939	0.7563	0.5942	0.6889	0.6283	1.2184	1.1693
1-stearoyl-GPE (18:0)	0.9108	0.7364	0.6326	0.6198	0.6594	0.8536	0.7627	0.8891	0.7688	0.8159	1.1018	0.9089	1.1721	1.125	0.9739	1.0261	1.138	1.0705	1.0923	1.4293	1.7764	1.5885	1.1043	1.2858	1.3473	0.9297	1.1349	1.0112	0.9888	1.4289	0.9761	0.8154	0.8313	0.7318	1.0858	1.2082
1-stearoyl-GPI (18:0)	0.5671	0.3087	0.4732	0.2432	0.3232	0.591	0.6433	0.9051	0.3154	0.5043	0.8254	0.8323	1.3676	1.481	1.4669	1.1988	1.2823	1.58	1.0949	1.3215	1.6801	1.7867	1.457	1.1434	2.1311	1.3093	0.546	0.9388	0.5696	1.2466	0.2357	1.0612	1.4631	0.6902	1.2578	0.6162
1-stearoyl-GPS (18:0)*	0.4112	0.4089	0.5574	0.4137	0.4488	0.4084	0.9022	1.0562	0.6227	0.7551	1.4389	1.2528	1.4853	0.9842	1.0158	0.9437	0.9277	1.2393	1.4474	1.7196	1.9617	1.6888	1.4829	1.5531	3.5537	2.0101	0.9063	1.6399	1.0235	1.7574	0.1899	0.6764	1.1746	0.5804	0.9765	0.4846
3-hydroxydecanoylcarnitine																									0.5162	0.6263	0.7095	0.5162	1	1.1112	1.337	1.3231	0.7304	0.9461	1.5969	1.34
4-cholesten-3-one																									1.4087	1.3401	1.2119	0.9114	0.9605	1.7822	0.8986	0.8579	0.6458	0.6458	1.1464	1
6-keto prostaglandin F1alpha	0.007	0.007	0.007	0.007	0.007	0.007	0.0958	0.137	0.2346	0.1888	0.3529	0.399	0.8515	1.155	1	0.9415	1.2743	1.7307	1.0182	2.7342	2.4452	2.4219	1.003	2.1388	1.4163	1	1.3741	0.8557	1.3919	1.9002	1.0327	0.8593	0.5724	0.5045	0.5045	0.8302
alpha-tocopherol	1.108	0.9789	0.8249	0.9242	0.8731	1.0812	1.0143	0.9857	1.1137	1.0717	1.1528	0.9512	1.5838	1.507	1.2676	1.5622	1.4403	1.6327	0.7589	0.8209	0.979	0.8222	0.7441	0.8111	0.8353	0.9992	0.8746	1.0379	1.0008	0.8466	1.2885	0.8834	1.2278	1.0737	0.9336	1.1471
arachidonate (20:4n6)	0.4715	0.2342	0.2907	0.2342	0.3067	0.5489	0.666	0.6475	0.4482	0.6961	1	0.6792	1.6753	2.8745	1.8489	2.2168	2.7133	2.6717	0.645	2.0563	2.7926	2.7241	1.2317	1.0936	3.3305	0.9944	0.4381	1.0056	0.5299	0.966	0.4063	2.8775	2.7914	0.8623	1.7406	1.0996
arachidoylcarnitine (C20)*	0.5987	0.5304	0.6038	0.7862	0.6548	0.7168	0.7114	0.7343	0.4313	0.9999	1.0001	0.8732	3.3665	3.3961	2.6132	2.1985	2.2393	2.1214	1.2548	1.5282	1.8025	1.442	1.128	0.9023	0.6894	0.5241	0.7115	0.6807	0.6355	0.775	1.3323	1.232	1.4517	1.225	2.1202	2.0343
behenoyl dihydrosphingomyelin (d18:0/22:0)*	0.7647	0.8142	0.5149	0.6098	0.7082	0.8481	1.264	1.1936	1.3438	1.4819	1.699	1.6194	1.0656	1.2639	0.8431	0.9111	1.1227	1.0486	0.9273	1.3365	1.3428	0.8941	0.7838	0.9514	1.2014	0.8497	1.058	1.1497	0.942	1.2709	0.9212	0.7956	0.9067	0.774	1.3044	1.1677
behenoyl sphingomyelin (d18:1/22:0)*	0.9249	0.8654	0.8906	0.7861	0.7255	0.9929	1.3456	1.2797	0.9482	1.0388	1.6622	1.4114	1.2965	0.8974	1.0061	0.818	0.813	1.303	0.9939	1.074	1.0825	1.1035	0.9619	1.094	1.4242	0.5421	1.3349	0.6	0.5458	1.5939	0.7156	1.2844	0.6105	0.568	1.631	1.6483
behenoylcarnitine (C22)*	0.247	0.247	0.247	0.247	0.247	0.247	0.3426	0.4532	0.247	0.4638	0.5733	0.5665	2.0305	2.5927	1.7914	1.6343	1.4949	1.6353	0.8705	1.1311	1.1295	1.1748	0.8262	0.7494	0.522	0.4239	0.5413	0.6988	0.512	0.5224	1.4139	1.5276	1.7785	1.3012	2.1686	2.3829
bilirubin	1.1444	1.2338	0.9368	0.9933	1.2517	1.8894	0.3058	0.4729	0.2643	0.4154	0.3949	0.2789	1.3555	1.981	1.0067	1.4054	1.2887	1.5222	0.5764	1.0902	1.2678	0.7305	0.6149	0.7094	1.7153	1	1.0001	0.8547	1.1114	1.7444	0.7757	0.7663	0.7663	0.7663	0.7663	0.8591
carotene diol (1)	1.2492	0.9898	0.8274	1.0102	1.0969	1.4145	0.5484	0.5484	0.7056	0.5484	0.5484	0.8478	0.5484	1.3784	0.5484	1.3468	1.1142	0.5484	0.5484	0.8859	0.9204	0.5484	0.5484	0.5484												
ceramide (d16:1/24:1, d18:1/22:1)*	1.4021	1.3501	1.1819	1.1977	1.2206	1.6621	0.6812	0.9125	0.773	1.0076	0.9717	0.9924	0.9893	1.0159	0.7642	0.7803	0.7338	0.9418	1.1528	1.3537	1.292	1.0869	0.9056	0.9797	1.0403	0.9597	0.9147	1.0625	0.8838	1.439	1.0637	1.1794	0.9375	0.809	0.8431	1.2078
ceramide (d18:1/14:0, d16:1/16:0)*	1.3308	1.1129	0.9276	1.0126	0.9125	1.0982	1.014	0.8986	0.9692	1.0529	1.0857	0.7728	1.1147	1.1095	0.8666	1.0301	0.9416	1.0521	0.9229	0.9699	1.1522	0.9874	0.9029	0.8427	0.9062	0.5888	0.7562	0.5994	0.6054	0.9689	1.4069	1.3964	1.0614	1.0311	1.2395	1.4689
ceramide (d18:1/17:0, d17:1/18:0)*	1.5128	1.2364	1.1566	1.012	0.9956	1.2818	0.6192	0.6645	0.6314	0.5599	0.7963	0.6229	1.9297	1.6777	1.5913	1.5451	1.371	1.8502	0.9953	0.8698	1.0044	0.8937	0.8789	0.9192	0.9652	0.967	0.7298	1.095	0.926	1.0253	1.3665	1.1588	1.1976	0.9431	0.9747	1.1122
ceramide (d18:1/20:0, d16:1/22:0, d20:1/18:0)*	1.1258	0.9814	0.6597	0.879	0.9259	0.9385	0.8746	0.8749	1.0186	1.085	1.1224	0.3518	1.5056	1.8014	1.3934	1.4826	1.5955	1.4425	0.8794	1.1767	1.2483	0.9554	0.8698	0.8863	0.7885	0.6183	0.6999	0.7051	0.5854	0.8478	1.5827	1.5146	1.369	1.1522	1.8105	1.7769
ceramide (d18:2/24:1, d18:1/24:2)*	1.219	0.9752	0.9506	0.8598	0.8728	1.2262	0.6924	0.7373	0.6831	0.6639	0.8328	0.794	1.5004	1.6287	1.1871	1.2652	1.2128	1.5297	1.1235	1.2209	1.2335	1.0248	0.9199	0.9626												
cerotoylcarnitine (C26)*	1.081	1.3225	0.8558	0.8727	0.8447	0.9962	0.6225	0.6411	0.6869	0.6225	0.8321	0.6225	1.3093	1.7062	1.0958	1.8093	1.5714	1.4948	0.9611	1.0787	1.1826	0.8199	0.7473	1.0038	1.0723	1.0894	0.9114	1.1367	1	1.1435	0.6795	0.8265	0.6795	0.6795	0.6795	0.8555
cholesterol	1.1183	0.8297	0.9837	0.8439	0.8505	1.2382	0.7519	0.9992	0.8677	0.9556	1.2228	1.0008	1.3955	1.2832	1.0212	0.931	0.9051	1.1924	0.9072	1.0808	1.2518	1.0495	0.9308	1.0013	1.0776	0.9292	1.0022	0.9264	0.9504	1.126	1.0635	0.9677	0.9978	0.9077	1.134	1.2545
cis-3,4-methyleneheptanoylcarnitine	1.2975	1.0663	1.3601	1.2217	1.4114	1.823	0.8458	0.7343	0.6179	0.8457	0.5719	0.5556	1.232	1.1391	0.6041	0.6322	0.6419	1.1142	1.0637	1.0402	0.9598	1.0629	0.9285	0.7888												
desmosterol																									0.4657	1	1.4032	1.0222	0.4657	1.2493	0.4657	0.4657	0.4657	0.4657	0.6478	0.8397
docosahexaenoylcholine	0.5751	0.6846	0.472	0.6793	0.472	0.6925	1.0987	1.1867	0.8153	1.0016	1	1.1467	2.4529	1.8657	1.7703	1.6945	1.8171	2.1146	0.9011	0.9176	1.1625	0.9804	0.747	0.7852												
eicosanoylsphingosine (d20:1)*	0.47	0.4318	0.4187	0.4087	0.3505	0.4131	0.8945	1.0563	0.8097	1.1571	1.2815	1.2898	1.1866	1.1299	0.8986	0.9694	1.0033	1.3386	0.9967	1.185	1.2713	1.0461	0.8904	1.1384												
eicosenoylcarnitine (C20:1)*	1.056	1.1308	0.944	1.067	1.3501	1.2557	0.3525	0.3326	0.2727	0.4639	0.4177	0.3671	3.3998	2.9145	1.4591	1.3554	1.0766	1.9188	1.7607	0.6882	0.9402	0.8313	0.883	0.3851	0.9236	0.7507	0.9268	0.8934	0.8742	0.8537	1.2299	1.0732	1.0867	1.0895	2.1521	1.8615
erucoylcarnitine (C22:1)*	0.6084	0.5814	0.7886	1.0724	1	1.1497	0.5098	0.5098	0.5098	0.5098	0.5098	0.5098	1.8784	2.1802	1.3682	0.5098	1.224	0.9684	0.8021	0.7851	1.2907	1.0613	0.5098	0.5882												
glycosyl ceramide (d16:1/24:1, d18:1/22:1)*																									0.6787	0.7243	1.0563	0.6787	0.807	1.4566	1.0979	1	0.9494	0.9083	1.4676	1.2946
glycosyl ceramide (d18:1/20:0, d16:1/22:0)*	1.0267	0.9342	0.8846	0.8083	0.8719	1.1403	0.9152	0.8462	0.7074	0.9381	0.9953	1.0618	1.0454	1.0375	0.7893	0.8196	0.8201	1.0047	1.4385	1.6332	1.6391	1.5013	1.1436	1.4441	0.7248	0.5578	0.6725	0.6378	0.5864	0.8387	1.2826	1.2355	1.1613	1.2702	1.6317	1.6264
glycosyl ceramide (d18:1/23:1, d17:1/24:1)*																									1.1514	0.921	1.0982	1.0189	0.9707	1.1008	0.8774	1.0148	0.8211	0.8276	0.9852	1.3992
glycosyl ceramide (d18:2/24:1, d18:1/24:2)*	1.2749	1.0408	0.8854	0.8743	0.9337	1.3843	0.6998	0.923	0.8798	0.9374	0.998	1.0529	1.002	1.0564	0.7955	0.8211	0.8411	0.9517	1.7417	2.1267	3.6868	1.7605	1.45	1.7362	0.8692	0.8022	0.9263	0.8618	0.6155	1.1362	1.2253	1.1384	1.0737	0.7553	1.3527	1.3362
glycosyl-N-(2-hydroxynervonoyl)-sphingosine (d18:1/24:1(2OH))*	0.829	0.8639	0.6762	0.6941	0.8218	0.9977	0.397	0.394	0.4415	0.409	0.4766	0.4625	1.8485	2.1293	1.5293	1.6827	1.7201	1.7409	1.2093	1.4987	1.4998	1.1715	1.0023	1.2164												
glycosyl-N-behenoyl-sphingadienine (d18:2/22:0)*																									0.3198	0.3826	0.4875	0.3788	0.3198	0.492	1.2231	1.4055	1	1.2747	1.3878	1.6772
glycosyl-N-palmitoyl-sphingosine (d18:1/16:0)	1.2033	1.1501	1.1113	1.0042	0.9445	1.4024	0.6088	0.5676	0.4997	0.6271	0.7198	0.6334	1.0367	0.8793	0.8173	0.8585	0.8083	0.9958	1.0972	1.2205	1.492	1.3673	1.0356	1.2347	0.7447	0.7041	0.7173	0.7099	0.6593	0.8247	1.4452	1.1753	1.3254	1.1902	1.5386	1.5547
glycosyl-N-stearoyl-sphinganine (d18:0/18:0)*																									0.8799	0.4078	0.762	0.6657	0.5262	0.9824	1.0564	1.0457	1.22	1.0176	1.3363	1.5663
glycosyl-N-stearoyl-sphingosine (d18:1/18:0)	1.4924	1.3042	1.1587	1.0197	1.0655	1.5608	0.7085	0.7016	0.6781	0.8026	0.8782	0.8626	0.9883	1.0117	0.7501	0.7794	0.8028	0.9655	1.2076	1.5031	1.5706	1.3379	0.9729	1.3341	0.9956	0.769	0.8965	0.9041	0.7932	0.9319	1.2289	1.1611	1.1061	1.0044	1.4902	1.5341
heme	0.2303	0.2303	0.2377	0.2303	0.3119	0.3044	0.8061	0.77	0.7996	0.8339	1.7129	1.632	2.2434	1.0291	1.7982	1.1891	0.6159	1.5934	0.9709	0.8693	1.2814	1.3114	1.1638	1.0956	1.4219	0.8958	1.1042	0.8374	1.1092	1.2021	0.7525	0.5509	0.693	0.8256	1.5675	1.2511
heptadecasphingosine (d17:1)	0.8912	0.8166	0.7657	0.7332	0.7293	0.9018	0.8671	1.1142	0.9744	1.1582	1.4859	1.3801	1.0256	1.0429	0.7966	0.8878	0.873	1.1236	1.1669	1.2508	1.4664	1.1174	0.9648	1.1768	1.0326	0.6661	0.8425	0.8427	0.7866	1.3533	0.9674	0.9385	1.0809	1.0602	1.5923	1.6992
hexadecasphinganine (d16:0)*	0.7132	0.7172	0.4299	0.549	0.6616	0.7935	1.3101	1.4245	1.5891	2.2313	1.6142	1.8914	0.9218	1.2813	0.6284	0.8937	1.0375	0.8624	0.9625	1.7683	1.888	1.0795	0.8092	1.1516												
hexadecasphingosine (d16:1)*	0.6472	0.5774	0.5544	0.5181	0.5326	0.6296	1.0224	1.2398	0.9776	1.3017	1.5421	1.4436	1.0263	1.0268	0.8178	0.9027	0.8991	1.0967	0.8847	1.0839	1.3382	1.1159	0.8549	1.1405	0.9296	0.7463	0.8716	0.8411	0.8101	1.0458	1.035	0.965	1.1467	1.077	1.477	1.5943
lactosyl-N-behenoyl-sphingosine (d18:1/22:0)*	1.1073	1.3406	0.9938	1.0742	1.2898	1.2608	0.5812	0.5498	0.5995	0.5151	0.7108	0.631	1.0062	1.0356	0.8794	0.9544	0.9166	0.9556	1.1409	1.3096	1.2781	1.0221	0.9807	1.0562	0.6655	0.5535	0.6265	0.6242	0.5248	0.7889	1.4536	1.3589	1.336	1.2111	1.7016	1.8223
lactosyl-N-nervonoyl-sphingosine (d18:1/24:1)*	1.0081	1.0659	0.9468	0.7811	1.0712	1.2229	0.4775	0.5019	0.4718	0.4459	0.5995	0.5817	1.1569	0.9618	0.9919	0.8423	0.8211	1.0625	1.23	1.3088	1.3892	1.2203	1.0975	1.2251	0.8042	0.6879	0.7841	0.7558	0.6881	0.9294	1.2578	1.1286	1.0706	1.0743	1.2757	1.3531
lactosyl-N-palmitoyl-sphingosine (d18:1/16:0)	1.4085	1.4521	1.1515	1.1806	1.2545	1.5551	0.4492	0.4879	0.5649	0.4007	0.5644	0.4551	1.0564	0.9325	0.9162	0.9649	0.8344	1.0565	1.0247	1.0288	1.1738	1.0586	0.9753	0.9556	0.5277	0.4415	0.4679	0.4397	0.4304	0.5503	1.9171	1.5862	1.4497	1.5537	1.98	2.0894
lactosyl-N-stearoyl-sphingosine (d18:1/18:0)*	1.229	1.5211	1.4539	1.0242	1.2496	1.5153	0.5172	0.4264	0.5338	0.3377	0.5743	0.6377	1.0767	0.9597	0.9981	0.8135	0.7277	1.0724	0.9872	1.0019	1.0235	1.0983	0.916	1.1789												
laurylcarnitine (C12)	1.2773	0.704	1	1.3256	1.0854	1.648	0.3872	0.3872	0.3872	0.3872	0.3872	0.3872	0.3872	0.9204	0.3872	0.3872	0.3872	0.3872	0.3872	0.4705	0.3872	0.3872	0.3872	0.3872												
lignoceroyl sphingomyelin (d18:1/24:0)	0.957	0.9425	0.7979	0.8974	0.8462	0.9997	0.9491	1.0352	0.9551	1.0003	1.2085	1.0643	1.2588	1.1919	1.0641	1.0304	1.0457	1.193	0.9554	1.1286	1.1836	0.9477	0.8468	0.9756	1.2988	0.9713	1.1366	1.1401	0.9814	1.3976	0.8108	0.8153	0.662	0.6364	1.0787	1.0186
lignoceroylcarnitine (C24)*	0.0575	0.0575	0.0575	0.0575	0.0575	0.0575	0.5343	0.59	0.377	0.5518	0.8051	0.7386	2.3077	2.6357	1.6133	1.8562	1.8973	2.2215	0.9759	1.3106	1.5464	1.2394	1	0.9426	0.5877	0.4947	0.4703	0.653	0.4703	0.6637	1.0606	1	1.0384	1.1715	1.3708	1.1456
linoleoyl-arachidonoyl-glycerol (18:2/20:4) [1]*																									1.1385	0.3242	0.9344	0.3242	0.3242	1.0656	0.6174	1.1523	0.7861	0.5399	1.2382	1.1054
linoleoylcarnitine (C18:2)*	0.3404	0.3404	1	0.9173	1.222	0.9511	0.3404	0.3404	0.3404	0.3404	0.3404	0.3404	1.6559	1.6145	1.4638	0.9862	0.6629	1.5269	0.3404	0.3404	0.3404	0.3404	0.3404	0.3404												
linoleoylcholine*	0.5895	0.5895	0.5895	0.5895	0.5895	0.5895	1.2729	1.0581	0.8217	0.7185	0.6019	0.5963	3.4201	2.2262	1.1458	1	0.6685	1.305	0.5895	0.5895	0.5895	0.5895	0.5895	0.5895												
margaroyl ethanolamide*	1.2741	0.9775	1.2487	0.8959	1.0459	0.9428	0.4819	0.6277	0.4819	0.4819	0.4819	0.5854	0.4819	0.9213	0.4819	0.8154	0.8441	0.4819	1.1649	1.254	1.3857	1.2351	1.0225	1.0654												
margaroylcarnitine (C17)*	1.1218	1.4475	1.1339	1.564	1.459	1.8624	0.7479	0.6433	0.3923	0.7005	0.7509	0.5992	3.1238	2.4487	1.7576	1.3921	1.2471	2.2949	0.825	0.8782	0.8227	0.6005	0.5651	0.4591	0.975	0.6519	0.665	0.5478	0.6553	0.6916	1.1996	1.0961	1.025	1.0795	1.6202	1.4774
myristoleoylcarnitine (C14:1)*	1.9688	1.745	1.3348	1.4938	1.0936	2.7087	0.3739	0.5187	0.9064	0.3739	0.3739	0.3739	0.3739	1.7517	0.6351	0.3739	0.3739	0.5627	0.8715	0.3739	0.3739	0.3739	0.3739	0.3767	0.6607	0.6433	0.5302	0.5843	0.4798	0.9303	1.2187	1.2704	1.0697	1.3672	1.9432	1.8342
myristoyl dihydrosphingomyelin (d18:0/14:0)*	0.6626	0.6357	0.6276	0.5317	0.5801	0.7588	1.2236	1.3941	1.0831	1.1263	1.6668	1.5352	1.3079	1.1755	0.9537	1.0047	0.9953	1.1253	0.8777	1.0495	1.1521	0.9402	0.8276	0.8943	1.2588	1.0153	1.0413	1.1965	0.9089	1.2678	0.7129	0.6957	0.708	0.6698	1.0005	0.9995
myristoylcarnitine (C14)	1.0931	0.7419	1	1.0373	1.0194	1.8093	0.3434	0.3434	0.3434	0.3434	0.3434	0.3536	1.1879	0.8835	0.4998	0.3434	0.3434	0.3434	0.3434	0.3434	0.3434	0.3434	0.3434	0.3434	0.7133	0.4882	0.573	0.4801	0.5514	0.6079	1.9243	1.567	1.5661	1.2867	2.8599	2.2924
N-behenoyl-sphingadienine (d18:2/22:0)*	1.3759	0.7438	0.5874	0.749	0.7552	0.6548	0.8411	0.9336	1.1376	0.9394	1.1557	0.9522	2.0562	3.408	2.0794	2.643	2.9297	1.6591	0.7661	1.061	1.309	1.0478	0.8195	0.8868	0.8479	0.4125	0.7818	0.5348	0.4329	0.9454	1.3008	1.7683	1.0546	1.1756	1.9852	1.9127
nervonoyl ethanolamide (24:1)*	0.5517	1.2091	1.2481	1.8283	1.2287	0.7909	0.5517	0.5517	0.5517	0.5517	0.5517	0.5517	0.5517	0.5517	0.5517	0.5517	0.5517	0.5517	0.5517	0.5517	0.5517	0.5896	0.5873	0.5517												
nervonoylcarnitine (C24:1)*	0.0836	0.0836	0.0836	0.0836	0.0836	0.0836	0.2822	0.3957	0.2683	0.3489	0.596	0.5236	1.3203	1.4165	1.0532	0.947	1.0248	1.031	0.9578	1.2432	1.4812	1.3743	1	1.007												
N-nervonoyl-sphingadiene (d18:2/24:1)*																									1.1491	0.8596	0.9871	1.0139	0.8435	1.3576	1.0437	1.0129	0.8935	0.7643	0.9572	1.0483
N-palmitoyl-phytosphingosine (t18:0/16:0)	1.9484	1.6039	2.3817	1.6422	1.3509	1.8667	1.0453	1.1711	0.5434	0.8377	1.1055	0.9173	1.5305	0.9547	1.1568	0.7339	0.8517	1.4937	0.7159	0.3331	0.5226	0.6762	0.6152	0.5489												
N-palmitoyl-sphingadienine (d18:2/16:0)*	1.2787	1.0045	0.9688	0.9415	0.8852	1.1159	0.9421	0.7531	0.8168	0.8331	0.9208	0.6812	1.6546	1.7159	1.2474	1.6541	1.4277	1.4479	1.009	0.9687	1.1545	1.0415	0.9955	0.8845	0.796	0.5569	0.6815	0.5986	0.5576	0.8674	1.4666	1.4401	1.1716	1.1326	1.3056	1.4601
N-palmitoyl-sphinganine (d18:0/16:0)	1.0216	0.9201	1.1436	0.7519	0.8214	0.9943	0.9998	0.9173	0.7261	0.6438	1.0051	0.9212	2.3578	1.8996	1.99	1.5806	1.2525	2.0932	1.0992	0.7447	0.9256	1.0389	1.0002	0.9635	0.8689	0.7354	0.6939	0.9344	0.7842	1.0336	1.4133	1.1588	1.1317	0.9664	1.3882	1.2496
N-palmitoyl-sphingosine (d18:1/16:0)	1.3131	1.1178	1.2024	1.0155	0.9579	1.2453	0.6989	0.6861	0.5263	0.5554	0.819	0.6504	2.0177	1.6438	1.596	1.4595	1.2662	1.7789	0.9777	0.8231	0.9845	1.0598	0.9151	0.9479	0.806	0.7076	0.6887	0.7735	0.7039	0.8519	1.3965	1.2816	1.2314	1.1481	1.3221	1.3158
N-stearoyl-sphingadienine (d18:2/18:0)*	0.9043	0.7807	0.8091	0.7589	0.6593	0.7494	0.7036	0.7718	0.576	0.6537	1.0024	0.8406	1.7303	1.2838	1.2845	1.2355	1.1644	1.4587	1.131	0.9976	1.2866	1.3726	1.2646	1.2544												
N-stearoyl-sphinganine (d18:0/18:0)*	0.6635	0.6368	0.551	0.5815	0.6513	0.6585	1.2319	1.2909	1.2563	1.4126	1.7853	1.3861	1.0997	1.1376	0.9358	0.9754	1.017	1.115	0.9032	1.0472	1.1963	0.9434	0.848	0.983	0.8041	0.6054	0.7013	1.0533	0.7948	0.9985	1.3226	1.0015	1.3181	0.9681	1.5514	1.2594
N-stearoyl-sphingosine (d18:1/18:0)*	1.4454	1.2161	0.9468	1.0582	1.0399	1.3425	0.7587	0.8078	0.7638	0.8715	0.9268	0.8118	1.5442	1.6974	1.2817	1.3742	1.3472	1.5484	0.8242	0.9601	1.1074	0.8824	0.7912	0.835	0.986	0.7732	0.759	0.9072	0.7264	1.074	1.1936	1.1158	1.014	0.8778	1.1544	1.1558
octanoylcarnitine (C8)	1.0389	1.0748	0.9348	0.9378	1.0334	1.5527	0.4972	0.4522	0.4522	0.4522	0.4522	0.4522	0.4522	1.1745	0.9867	1.0133	0.4522	0.9265	0.4522	0.4522	0.4522	0.4522	0.4522	0.4522												
oleoyl ethanolamide	1.2712	1.0486	1.084	1.1077	1.0958	1.346	0.5887	0.8403	0.6351	0.7282	0.8647	0.7766	0.9611	0.8781	0.6972	0.8203	0.7318	0.773	1.0389	1.2122	1.6118	1.325	1.1436	1.2957	1.2694	1.1576	0.9764	1.2031	1.0543	1.6256	1.0236	0.7875	0.9407	0.7953	0.8074	0.8293
oleoyl-arachidonoyl-glycerol (18:1/20:4) [2]*	0.9045	0.6008	0.67	0.4649	0.5643	0.8337	1.0499	1.0506	0.9764	0.8676	1.2299	1.1396	2.1282	1.7283	1.5708	1.6829	1.4758	1.9991	0.8723	0.8764	1.0236	0.9328	0.8724	1.0713	1.0435	0.9478	0.999	1.0034	0.8862	1.102	1.0522	0.9166	0.9682	0.8582	1.001	1.0672
oleoylcarnitine (C18:1)	1.246	1.3959	1.7146	1.7873	1.8278	2.0369	0.5793	0.6325	0.3599	0.6654	0.5297	0.4989	2.1364	2.1033	1.428	1.183	1.0725	1.4274	0.9275	0.6819	0.9253	0.7482	0.6632	0.6363	0.8762	0.8456	0.7864	0.8209	0.6972	0.692	1.4445	1.1238	1.164	1.3963	2.023	1.5813
oleoylcholine	0.2585	0.3475	0.3222	0.1977	0.2973	0.3656	1.9134	1.5575	1.0036	1.5119	1.2861	0.9964	7.6971	5.3609	3.4893	2.8963	2.2347	2.9635	1.0496	0.6594	0.7741	0.6118	0.6189	0.6356	1.6508	1.3965	0.893	1.0891	1.289	1.2415	0.7498	0.6299	1.0408	0.9592	0.9229	0.9238
oleoyl-linoleoyl-glycerol (18:1/18:2) [1]	1.1825	0.9439	0.6609	0.5977	0.6787	1.0726	0.819	1.0669	0.9548	0.8798	0.9675	0.9008	1.6798	1.9232	1.2847	1.9188	1.6399	1.5786	0.8611	1.0325	1.2352	0.9024	0.875	1.0449												
oleoyl-linoleoyl-glycerol (18:1/18:2) [2]	0.442	0.442	1.0195	0.442	0.6909	0.8836	1.2371	1.3788	0.8559	0.6888	1.3791	1.5617	2.2501	1.2639	2.1509	0.7585	0.7631	2.0754	0.9802	0.6785	0.9235	1.0643	0.9805	1.0897	1.228	0.9592	1.1301	1.0408	0.8843	1.3403	0.9439	1.1009	0.7748	0.7985	0.9561	1.0845
oleoyl-oleoyl-glycerol (18:1/18:1) [1]*	0.7432	0.3207	0.5769	0.4098	0.5252	1.1766	0.5239	0.5339	0.3207	0.3207	0.5512	0.5218	2.2426	2.0948	1.7491	1.9191	1.7426	2.1342	1.3116	1.5022	1.3302	0.6414	0.8796	1.1204	0.536	0.6829	1.0492	1.5817	0.6633	1.6653	1.2863	0.9508	1.315	0.624	0.3953	1.6462
oleoyl-oleoyl-glycerol (18:1/18:1) [2]*	0.9403	0.6762	0.7244	0.6136	0.7891	1.1556	0.7447	0.9051	0.9186	0.9347	0.954	0.8889	1.9273	1.8709	1.5154	1.6232	1.7283	1.6764	1.0518	1.1902	1.3744	1.0112	0.9888	1.1511	1.1022	0.9415	1.2439	1.3146	0.9648	1.3751	1.0352	0.9498	0.8713	0.6405	0.9624	1.0729
palmitoleoyl ethanolamide*	1.2815	0.89	1	1.0222	1.0323	1.0956	0.9453	0.8196	0.4658	0.5343	0.6074	0.4658	1.1292	0.7383	0.7488	0.9146	0.4658	0.4658	0.9048	1.4358	1.6737	1.1128	1.0127	1.3846	1.0933	1.1423	0.833	1.0769	0.8883	1.2413	1.0487	1.0669	0.897	0.7943	0.9513	0.9033
palmitoleoylcarnitine (C16:1)*	1.6973	1.3788	1.934	1.6879	1.5919	2.5059	0.5638	0.7991	0.5897	0.6321	0.8004	0.71	1.5989	1.7003	1.2045	1.2779	0.989	1.4207	0.9458	0.8888	0.9806	1.011	0.6368	0.8295	0.592	0.5913	0.6547	0.6953	0.5615	0.5971	1.8466	1.4631	1.5678	1.3047	1.8101	1.882
palmitoleoyl-oleoyl-glycerol (16:1/18:1) [2]*																									0.9254	0.5934	0.7712	0.6888	0.6223	1.033	1.1964	1.2053	1.0154	0.9846	1.5018	1.4918
palmitoloelycholine	0.1895	0.1895	0.1965	0.1895	0.2326	0.2199	2.1552	1.7231	0.8882	1.7472	1.4408	1.0771	6.7957	4.2791	2.4478	2.2872	1.8935	2.2879	0.9229	0.5674	0.6002	0.4716	0.4695	0.3392												
palmitoyl dihydrosphingomyelin (d18:0/16:0)*	0.8398	0.7699	0.7942	0.6283	0.6649	0.8799	1.1253	1.1374	1.0064	0.8794	1.409	1.1217	1.7174	1.3268	1.4134	1.1954	1.3041	1.7507	0.9834	0.9052	1.0452	0.9808	0.9493	0.9936	1.0202	0.919	0.9304	1.1332	0.9803	1.0744	0.9978	0.8152	1.0022	0.9597	1.2801	1.1964
palmitoyl ethanolamide	1.2368	1.0056	1.0583	1.043	0.9944	1.2608	0.6228	0.8579	0.5686	0.7225	0.6951	0.7327	1.116	0.7896	0.6753	0.7728	0.871	0.9696	1.0322	1.0343	1.5095	1.2085	1.1359	1.2047	1.1792	0.8569	0.9946	0.9375	0.8348	1.2964	1.2018	1.0274	1.0152	0.8856	0.972	1.0054
palmitoyl sphingomyelin (d18:1/16:0)	1.0296	0.9485	1.0145	0.8464	0.8439	1.1273	0.7986	0.8712	0.7728	0.7031	1.0012	0.8913	1.6219	1.3083	1.1791	1.133	1.0949	1.5052	0.9811	0.9988	1.0673	0.9788	0.9186	1.008	0.9504	0.9155	0.8924	0.99	0.9396	1.0335	1.1039	0.9284	1.01	1.0534	1.1922	1.204
palmitoyl-arachidonoyl-glycerol (16:0/20:4) [1]*																									1.0634	0.7724	0.4123	0.7648	0.824	0.8123	1.3136	1.1033	0.9955	1.1871	1.0045	1.6505
palmitoyl-arachidonoyl-glycerol (16:0/20:4) [2]*	0.6741	0.3205	0.5748	0.2713	0.2713	0.4927	1.3591	1.1775	0.2713	0.7888	1.2717	1.398	2.1445	1.5313	1.6041	1.2096	1.0691	2.6585	0.97	0.385	0.5252	0.6282	0.8577	1.03	0.9687	0.9471	0.904	1.0042	0.8641	0.9958	1.2551	1.2191	1.116	0.9763	1.1036	1.3328
palmitoylcarnitine (C16)	1.4905	1.2586	1.1906	1.3119	1.3934	2.0592	0.9387	0.7531	0.4946	0.8483	0.6673	0.7264	2.6815	2.6303	1.5779	1.3338	1.0613	1.4944	0.7559	0.4682	0.5926	0.5492	0.4373	0.4339	0.9178	0.8171	0.9533	0.6222	0.6247	0.5999	1.6969	1.0467	1.2501	1.2804	2.315	1.7185
palmitoylcholine	0.4402	0.4163	0.296	0.3669	0.3676	0.4252	1.0972	1.3709	1.0288	1.2207	1.5944	1.4609	1.0498	0.9942	0.6712	0.8762	0.8133	1.0058	1.0917	1.2567	1.1552	0.9295	0.8591	1.0064	1	0.7218	0.7027	0.9445	1.0245	0.7027	0.7027	0.8125	1.1747	0.7027	1.221	1.2198
palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]*	0.5102	0.3929	0.6565	0.4502	0.4631	0.8103	1.037	1.196	0.963	0.7393	1.328	1.1448	1.7732	2.9859	1.3931	1.493	1.3581	1.9266	0.9336	1.697	0.8251	0.9605	0.8309	1.0463	0.9628	0.9244	0.8381	0.7927	0.6904	1.0466	1.2068	0.9832	1.0572	1.0168	1.2028	1.1788
palmitoyl-oleoyl-glycerol (16:0/18:1) [1]*	0.6218	0.5545	1	0.5545	0.6216	0.5545	0.9517	0.5545	0.5545	0.5545	0.5545	0.5545	2.6093	1.9432	1.8898	1.7822	0.5545	1.8907	0.665	0.5545	0.5545	0.5545	0.5545	0.5545												
palmitoyl-oleoyl-glycerol (16:0/18:1) [2]*	0.8392	0.6776	0.6853	0.5761	0.7257	0.9899	0.9639	1.0402	0.9031	1.0445	0.9849	1.0729	2.2176	2.2118	1.8015	1.8129	1.657	1.9567	0.9901	1.0467	1.2323	0.8884	0.8103	1.0099	0.8575	0.7558	0.7934	0.7873	0.7132	0.8533	1.4345	1.2877	1.2413	1.1425	1.4971	1.5638
palmitoyl-palmitoyl-glycerol (16:0/16:0) [2]*																									0.821	0.469	0.7012	0.707	0.469	0.5654	1.6895	1.179	1.1954	1.0013	1	1.3247
palmitoyl-sphingosine-phosphoethanolamine (d18:1/16:0)	1.2381	1.1602	1.0292	0.9309	1.0177	1.1436	0.7153	0.8851	0.7853	0.7342	0.9794	0.7133	1.2329	1.0236	0.9236	0.8786	0.8805	1.0786	1.0528	1.0797	1.1062	1.048	0.9213	0.9823	0.9848	1.0152	0.8927	1.1518	0.9115	1.1672	1.3316	0.8054	1.2364	0.708	0.7633	1.6528
pentadecanoylcarnitine (C15)*	1.5942	1.0923	1.1733	1.1439	1.3671	2.8189	0.4905	0.7254	0.4557	0.6107	0.8099	0.794	0.4557	1.8061	1.6704	1.0978	0.9779	1.7909	0.8177	0.9154	0.8434	1.0221	0.6586	0.4557												
phytosphingosine	1.4018	1.2129	1.3159	1.1078	1.1307	1.4365	0.9155	1.0653	0.6879	1.0837	1.3385	1.2066	1.121	0.9347	0.8218	0.9031	0.9055	1.1727	0.8053	0.8102	0.8932	0.8387	0.7174	0.8558	0.9052	0.8167	0.8008	0.986	0.9918	1.1113	1.3704	0.9706	1.1552	1.0082	1.206	1.4043
retinol (Vitamin A)	0.4886	0.7911	1.0943	1.0435	1.1599	0.8291	0.3939	0.6394	0.2356	0.6896	0.7923	0.5926	3.1768	2.8662	2.3127	2.366	1.2876	2.3107	0.7404	1.3411	1.2075	0.9185	1.0294	0.9706	0.9044	0.6848	0.8371	0.7793	0.7383	0.9879	1.0934	1.0431	1.1941	1.0121	1.2304	1.2167
sphingadienine																									0.8039	0.6372	0.7338	0.7284	0.7431	1.1089	1.0151	0.9849	1.0915	1.0621	1.6488	1.6933
sphinganine	0.7318	0.6485	0.6194	0.5899	0.6106	0.7528	0.9972	1.077	0.8765	1.0986	1.3301	1.2795	1.0615	1.0028	0.848	0.8662	0.8293	1.0532	1.0086	1.1449	1.3061	1.1511	0.9417	1.1789	0.9985	0.8266	0.8062	0.9847	0.8675	1.2563	1.0015	0.8643	1.0789	1.0419	1.3954	1.3898
sphingomyelin (d17:1/14:0, d16:1/15:0)*	0.9148	0.9229	0.758	0.6864	0.8252	1.0939	1.1174	1.2821	1.0081	1.0669	1.6684	1.4405	1.0122	1.0781	0.7478	0.8084	0.8442	0.9328	0.9919	1.1105	1.1581	1.0588	0.8282	0.9409	1.0082	0.9918	1.0332	0.9606	0.8735	1.3586	1.031	0.8465	0.8774	0.7777	1.3218	1.2579
sphingomyelin (d17:1/16:0, d18:1/15:0, d16:1/17:0)*	0.9415	0.8907	0.9343	0.7616	0.7722	1.1469	0.9502	1.0838	0.8783	0.8705	1.3156	1.1234	1.4927	1.2553	1.1259	1.0497	1.0713	1.2185	0.9048	0.9948	1.1115	1.0052	0.8571	0.8695	1.0686	0.8604	1.033	1.0188	0.8367	1.0883	0.9812	0.9381	0.939	0.9218	1.2381	1.2256
sphingomyelin (d17:2/16:0, d18:2/15:0)*	0.9964	0.8762	0.7698	0.6837	0.9671	1.2839	0.7358	1.0743	0.7701	0.6111	1.2925	1.0155	1.1932	1.5011	1.0036	1.1114	1.0687	1.333	0.9658	1.0765	1.1635	0.9958	0.8241	0.9412	0.9266	0.7876	1.1264	0.9366	0.9873	1.2559	1.4502	0.9983	0.8437	1.0017	1.4801	1.4392
sphingomyelin (d18:0/18:0, d19:0/17:0)*	0.7624	0.7099	0.6568	0.5876	0.6598	0.7715	1.4185	1.4953	1.1587	1.3459	1.8309	1.67	1.4078	1.1176	1.0163	1.0128	0.8178	1.4084	0.9606	0.9872	1.0798	0.9771	0.8921	0.9526	1.285	0.9662	1.0338	1.2569	0.9636	1.3128	0.9264	0.7507	0.8749	0.8042	1.3134	1.3305
sphingomyelin (d18:0/20:0, d16:0/22:0)*	0.64	0.6458	0.5164	0.5156	0.5926	0.7177	1.4797	1.5687	1.3721	1.5506	2	1.9495	1.2489	1.1247	0.9498	0.8833	0.9763	1.2611	1.0029	1.131	1.1159	0.9447	0.9056	0.9971	1.0558	0.8541	0.8644	1.166	0.8548	1.2026	1.0924	0.7967	0.9442	0.8698	1.3376	1.1451
sphingomyelin (d18:1/14:0, d16:1/16:0)*	1.0321	0.8712	0.976	0.8455	0.8465	1.2201	0.9224	0.9713	0.7531	0.7974	1.2858	1.1319	1.3099	1.1547	1.0295	0.8944	0.9821	1.3186	1.0116	1.0561	1.0662	0.9884	0.9132	1.0922	1.1612	0.9486	0.9976	1.0882	0.9079	1.269	1.0024	0.8884	0.9008	0.9644	1.1532	1.1405
sphingomyelin (d18:1/17:0, d17:1/18:0, d19:1/16:0)	1.2649	1.1532	1.0824	0.9419	0.9442	1.3307	0.8394	0.8533	0.7124	0.7097	0.9849	0.8694	1.4136	1.0864	1.0815	1.0494	1.1288	1.4511	0.904	0.9941	1.1428	0.9405	0.8506	1.0059	1.0897	1.054	0.97	1.1221	1.0058	1.0748	0.7694	0.6348	0.8326	0.7212	0.9942	1.0163
sphingomyelin (d18:1/18:1, d18:2/18:0)	0.9173	0.8663	0.9054	0.786	0.7569	1.02	0.9961	1.0784	1.0287	0.8587	1.2896	1.1312	1.7259	1.4557	1.3423	1.3547	1.2102	1.6616	0.9207	0.9935	1.0039	0.92	0.894	0.9366	1.0952	1.0026	1.0292	0.8847	0.9974	1.1379	0.9786	0.8482	0.7401	0.9185	1.0388	1.1046
sphingomyelin (d18:1/19:0, d19:1/18:0)*	0.8971	0.9278	0.8237	0.7585	0.7183	1.033	1.5352	1.8193	1.4341	1.4374	1.6141	1.9698	1.0879	0.8664	0.7857	0.775	0.7986	0.9782	0.9346	1.0445	1.1581	0.8036	1.0218	1.1011												
sphingomyelin (d18:1/20:0, d16:1/22:0)*	0.8447	0.7805	0.8961	0.6568	0.6042	0.8432	1.5855	1.6655	1.236	1.1801	1.9804	1.6684	1.2612	0.9186	0.974	0.8098	0.8148	1.2379	1.0958	0.9857	1.0143	1.1946	0.9612	1.0248	0.784	0.7697	0.6712	0.856	0.7732	0.8483	1.5599	1.144	1.2491	1.3425	1.582	1.6513
sphingomyelin (d18:1/20:1, d18:2/20:0)*	0.6832	0.6047	0.5359	0.5423	0.4885	0.7676	1.3826	1.2325	1.2	1.0363	1.7181	1.2997	1.2114	1.0485	0.7538	0.881	0.7994	1.1557	0.9817	0.9103	1.0185	0.9881	1.0151	1.0119	0.774	0.7237	0.7063	0.4894	0.707	0.8891	1.3585	1.2165	1.248	1.1109	1.3868	1.8884
sphingomyelin (d18:1/21:0, d17:1/22:0, d16:1/23:0)*	0.8304	0.8621	0.821	0.683	0.7355	1.0575	1.3764	1.4923	1.0408	1.2915	1.8544	1.7828	1.0137	0.8634	0.7977	0.7037	0.7376	1.0445	0.9574	1.0199	1.0971	0.9905	0.8635	1.0095	1.0003	0.743	1.0126	0.9997	0.745	1.2476	1.0994	0.9951	0.9012	0.7557	1.3842	1.3588
sphingomyelin (d18:1/22:1, d18:2/22:0, d16:1/24:1)*	1.0506	0.9325	0.7998	0.797	0.8066	1.1264	1.1121	1.1824	1.0884	0.966	1.3971	1.229	0.8567	0.7752	0.6351	0.6763	0.6388	0.8238	1.034	1.128	1.2241	1.0738	0.9509	1.0377	0.8076	0.6858	0.703	0.6845	0.6776	0.8533	1.3631	1.1467	1.2891	1.2867	1.4481	1.5662
sphingomyelin (d18:1/22:2, d18:2/22:1, d16:1/24:2)*	0.8006	0.8581	0.7525	0.406	0.7987	0.9836	1.0956	1.4364	1.1864	1.2714	1.7395	1.0164	0.406	0.406	0.406	0.406	0.406	0.406	1.1005	1.4286	1.5166	0.8611	0.7814	0.8493	1.1639	0.8334	0.8169	0.9043	0.839	1.1027	1.0203	1.2902	0.9797	0.8235	1.3354	1.3534
sphingomyelin (d18:1/24:1, d18:2/24:0)*	0.6778	0.6528	1.1591	0.6078	0.5826	0.799	1.2213	1.1455	0.5973	0.6145	1.4818	1.3057	1.4096	0.8872	1.1084	0.7484	0.7429	1.3937	1.2829	0.7591	0.8916	1.373	1.2193	1.4064	1.0374	1.2414	0.9626	1.3353	1.2281	1.1394	1.0573	0.6802	0.896	0.8093	0.8528	0.89
sphingomyelin (d18:1/25:0, d19:0/24:1, d20:1/23:0, d19:1/24:0)*	0.8766	1.0026	0.9974	0.8573	0.8403	1.3049	1.2361	1.4405	0.9762	0.9875	1.5129	1.7638	0.9271	1.0396	0.761	0.6583	0.7841	0.9019	1.2621	1.4918	1.2951	1.1763	0.94	1.2252	2.0082	0.8958	1.8277	1.0002	0.8606	2.5555	0.5702	0.9998	0.5717	0.5069	1.1742	1.2521
sphingomyelin (d18:2/14:0, d18:1/14:1)*	0.8188	0.6836	0.7131	0.5836	0.6964	1.006	0.8628	1.0234	0.7904	0.6539	1.1998	1.1833	1.1653	1.3091	0.9512	0.8507	1.0479	1.1545	1.0145	1.3003	1.4098	0.994	0.8642	1.0326	1.0257	0.7963	0.8824	0.884	0.8762	1.1438	1.172	0.9346	1.0476	0.9743	1.4596	1.431
sphingomyelin (d18:2/16:0, d18:1/16:1)*	0.9037	0.7301	0.8529	0.7505	0.744	1.0892	0.8248	0.8786	0.7066	0.698	1.1603	0.9914	1.8642	1.747	1.5114	1.3033	1.4756	1.8754	1.0086	1.1024	1.0544	0.9643	0.9106	1.0735	0.9368	0.7972	0.8659	0.9016	0.7643	1.0769	1.1066	1.0022	0.9978	1.0521	1.3076	1.2976
sphingomyelin (d18:2/21:0, d16:2/23:0)*	0.599	0.6435	0.2983	0.4076	0.5472	0.7044	1.4776	1.6154	1.3336	1.1589	1.9899	1.8077	0.5038	0.4052	0.2983	0.2983	0.4932	0.48	1.0456	0.9544	1.1216	1.1369	1.1159	1.0714												
sphingomyelin (d18:2/23:0, d18:1/23:1, d17:1/24:1)*	1.0423	1.0437	0.9758	0.8398	0.8862	1.2602	1.0333	1.0847	0.9315	0.8885	1.3644	1.2587	0.7809	0.7044	0.586	0.5836	0.6074	0.7843	1.0242	1.1693	1.23	1.1202	0.9306	1.0368	1.4502	1.0351	1.3571	1.2036	0.9405	1.6732	0.8068	0.763	0.6389	0.5444	1.0454	0.9649
sphingomyelin (d18:2/23:1)*	0.8042	0.7065	0.5781	0.6811	0.7325	0.7166	1.152	1.1118	1.0667	0.695	1.4126	1.3678	0.699	0.5781	0.5781	0.5781	0.5781	0.5781	1.1187	1.0898	1	1.4272	0.9823	1.1924	1.1337	0.863	1.0708	1.0005	0.8069	1.11	0.9995	0.9981	0.8204	0.7713	1.164	1.2365
sphingomyelin (d18:2/24:1, d18:1/24:2)*	1.0148	0.8728	0.8097	0.8371	0.8175	1.0905	0.9852	1.0687	1.1055	0.8974	1.2755	1.1141	0.9683	0.9603	0.7247	0.839	0.8163	0.9597	1.2772	1.4699	1.5197	1.3177	1.1948	1.2644	1.0618	0.9924	0.9327	0.9991	1	1.0904	1.0974	1	0.9322	0.9035	1.2189	1.2384
sphingomyelin (d18:2/24:2)*	1.1348	0.6414	0.6414	0.6414	0.6414	0.6414	0.6414	1.1558	0.6414	0.6414	0.6414	0.6414	0.6414	0.6414	0.6414	0.6414	0.6414	0.9072	0.9437	1.7324	1.8372	0.9485	0.9859	1.0141	1.919	0.5937	1.3179	0.953	1.0739	1.0287	1	0.7935	0.6725	1.1186	0.5937	0.6179
sphingosine	1.0668	1.0383	0.9117	0.8425	0.8424	0.9904	0.6431	0.833	0.6341	0.7339	1.0291	0.9845	1.2846	1.0814	0.9604	1.0096	0.9814	1.2958	1.0602	1.1386	1.2913	1.1172	0.9782	1.2171	0.9359	0.7755	0.811	0.8731	0.8707	1.1953	1.0501	0.9499	1.1416	1.0514	1.4371	1.6065
stearoyl ethanolamide	1.2836	0.9829	1.0171	0.9186	1.0412	1.2663	0.5027	0.6696	0.4761	0.5858	0.7475	0.7042	1.0738	1.1577	0.779	0.8661	0.8276	0.9558	1.3638	1.4733	1.7308	1.2576	1.1753	1.2833	1.3728	1.0589	1.1776	1.2333	1.207	1.3607	0.9243	0.9116	0.8427	0.7867	0.9411	0.8965
stearoyl sphingomyelin (d18:1/18:0)	0.9044	0.9114	1.0135	0.6336	0.7819	1.0015	1.3168	1.1342	1.0685	1.039	1.575	1.2091	1.1333	1.0367	0.8616	0.9796	0.9985	1.1312	0.9702	0.9106	0.9894	1.0081	0.9644	0.9707	0.984	0.9969	0.8576	1.0675	1.0031	0.9736	1.0432	0.7317	1.073	0.9897	1.0111	1.1306
stearoyl-arachidonoyl-glycerol (18:0/20:4) [1]*	1.0294	0.5297	0.6457	0.527	0.7599	0.9237	0.8194	0.8379	0.9362	1.0643	1.0913	1.0761	1.4708	2.1255	1.4012	1.7956	1.4899	1.5458	0.9706	1.0525	1.0853	0.7574	0.7408	0.8215	1.1619	0.8861	1.1262	1.1434	1.0652	1.3441	0.7815	0.8889	0.6215	0.7657	1.0667	0.9348
stearoyl-arachidonoyl-glycerol (18:0/20:4) [2]*	1.1201	0.6115	0.6321	0.3514	0.4802	1.1079	1.0228	1.0688	0.9286	0.9772	1.1745	1.4219	1.6136	1.4215	1.383	1.2873	1.3274	1.7766	0.8752	0.8858	0.9314	0.7968	0.7301	0.9243	1.2288	1.012	1.2323	1.3834	1.0912	1.2819	0.8814	0.777	0.7703	0.7869	0.9173	0.988
stearoylcarnitine (C18)	1.3014	1.2204	1.0321	1.4875	1.4743	1.8782	0.4627	0.4628	0.3064	0.5463	0.4878	0.4349	2.9582	2.9026	1.5468	1.5824	1.2459	1.5908	0.9679	0.6608	0.8014	0.6176	0.6503	0.4024	0.818	0.8131	0.9668	0.8857	0.7544	0.8331	1.4123	1.0332	1.1285	1.3064	2.3053	1.8549
stearoyl-docosahexaenoyl-glycerol (18:0/22:6) [2]*																									1.5668	1.4433	1.4576	1.4418	1.1908	1.4484	0.8092	0.6479	0.6471	0.6032	0.6005	0.7551
stearoyl-linoleoyl-glycerol (18:0/18:2) [2]*	0.8527	0.654	0.7819	0.5196	0.6131	0.7112	0.9875	1.103	0.7908	0.7551	1.021	1.1069	2.0025	1.8298	1.6299	1.4056	0.7786	1.9465	0.9845	1.032	1.2679	1.0125	0.8645	1.1106												
tricosanoyl sphingomyelin (d18:1/23:0)*	0.9891	0.8764	0.7305	0.8409	0.8889	1.0221	1.0531	1.0217	1.0872	1.1607	1.3553	1.2496	1.1251	1.1572	0.8408	0.9755	0.9999	0.991	0.9114	1.2115	1.2748	0.9333	0.8123	1.0001	1.8548	0.8709	1.6366	1.0798	0.8941	1.9755	0.735	0.9202	0.608	0.5989	1.3109	1.2548
X - 23641	0.7946	0.9128	1	1.2658	1.065	1.1907	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461	0.1461												
X - 23782	1.228	0.9359	1.046	0.8311	0.928	1.1098	0.4677	0.597	0.6255	0.4941	0.6487	0.5152	1.8819	1.7288	1.4729	1.8677	1.9932	1.8579	0.773	0.9736	1.1017	1.0812	1.0264	0.8693	0.7808	0.7641	0.7678	0.7983	0.7195	1.0143	1.6986	1.5254	1.121	0.9857	1.1205	1.1026
X - 24035																									1.0059	0.9197	0.8683	1.1361	0.8484	0.9474	1.0358	1.0201	0.9941	0.9393	1.1765	1.2487
X - 26108																									0.416	0.3944	0.606	0.5669	0.3944	0.4454	1.1732	1	1.0799	1.0817	1.4205	1.2087
ximenoylcarnitine (C26:1)*	0.4085	0.4085	0.4085	0.4085	0.4085	0.4085	0.4085	0.4085	0.4085	0.4085	0.5025	0.4437	1.2108	1.0896	0.641	0.9689	1.0011	1.1497	1	1.3487	1.5172	1.0946	0.8738	0.7243												
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	SUPER PATHWAY	SUB PATHWAY	COMP ID	PLATFORM	CHEMICAL ID	RI	MASS	PUBCHEM	CAS	KEGG	HMDB
1-(1-enyl-oleoyl)-GPE (P-18:1)*	Lipid	Lysoplasmalogen	44621	LC/MS Pos Late	100005372	1566	464.3136
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20:4)*	Lipid	Plasmalogen	52689	LC/MS Pos Late	100009014	2200	766.5745				HMDB0011220
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20:4)*	Lipid	Plasmalogen	52673	LC/MS Pos Late	100009002	2300	724.5276	52925126			HMDB0011352
1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2)*	Lipid	Plasmalogen	52682	LC/MS Pos Late	100009009	2300	742.5745	24779386			HMDB0011211
1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)*	Lipid	Plasmalogen	52677	LC/MS Pos Late	100009069	2400	700.5276	52925127			HMDB0011343
1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1)*	Lipid	Plasmalogen	52478	LC/MS Pos Late	100009007	2550	744.5902	34779384			HMDB0007996
1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1)*	Lipid	Plasmalogen	52477	LC/MS Pos Late	100009005	2750	702.5432	52925128			HMDB0011342
1-(1-enyl-palmitoyl)-2-palmitoleoyl-GPC (P-16:0/16:1)*	Lipid	Plasmalogen	52713	LC/MS Pos Late	100009160	2218	716.5589	52923882			HMDB0011207
1-(1-enyl-palmitoyl)-2-palmitoyl-GPC (P-16:0/16:0)*	Lipid	Plasmalogen	52716	LC/MS Pos Late	100009162	2550	718.5745	11146967			HMDB0011206
1-(1-enyl-palmitoyl)-GPC (P-16:0)*	Lipid	Lysoplasmalogen	52474	LC/MS Pos Late	100002875	1547	480.3449	10917802			HMDB0010407
1-(1-enyl-palmitoyl)-GPE (P-16:0)*	Lipid	Lysoplasmalogen	39270	LC/MS Pos Late	100003000	1558	438.2979				HMDB0011152
1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:4)*	Lipid	Plasmalogen	52475	LC/MS Pos Late	100008999	2550	752.5589	9547058			HMDB0005779
1-(1-enyl-stearoyl)-2-linoleoyl-GPE (P-18:0/18:2)*	Lipid	Plasmalogen	52748	LC/MS Pos Late	100009225	2750	728.5589				HMDB0011376
1-(1-enyl-stearoyl)-2-oleoyl-GPE (P-18:0/18:1)	Lipid	Plasmalogen	52614	LC/MS Pos Late	100008919	3100	730.5745	42607457	144371-68-6		HMDB0011375
1-(1-enyl-stearoyl)-GPE (P-18:0)*	Lipid	Lysoplasmalogen	39271	LC/MS Pos Late	100003001	1649	466.3292
1,2-dioleoyl-GPC (18:1/18:1)	Lipid	Phosphatidylcholine (PC)	52457	LC/MS Pos Late	100008905	2420	786.6007	10350317	4235-95-4		HMDB0000593
1,2-dioleoyl-GPE (18:1/18:1)	Lipid	Phosphatidylethanolamine (PE)	52609	LC/MS Pos Late	100008906	2535	744.5538	9546757	768593		HMDB0009059
1,2-dioleoyl-GPS (18:1/18:1)	Lipid	Phosphatidylserine (PS)	19191	LC/MS Pos Late	1533	2800	788.5436	6438639	6811-55-8		HMDB12390
1,2-dipalmitoyl-GPC (16:0/16:0)	Lipid	Phosphatidylcholine (PC)	19130	LC/MS Pos Late	100000657	2450	734.5694	452110	63-89-8	D03585	HMDB0000564
1,2-dipalmitoyl-GPE (16:0/16:0)*	Lipid	Phosphatidylethanolamine (PE)	57341	LC/MS Pos Late	100009204	2498	692.5225	445468			HMDB0008923
1,2-distearoyl-GPC (18:0/18:0)	Lipid	Phosphatidylcholine (PC)	19132	LC/MS Pos Late	100000660	2950	790.632	94190	816-94-4		HMDB0008036
1-arachidonoyl-GPI* (20:4)*	Lipid	Lysophospholipid	34214	LC/MS Pos Late	100001654	1500	621.3034	121596217			HMDB0061690
1-cerotoyl-GPC (26:0)*	Lipid	Lysophospholipid	61505	LC/MS Pos Late	100015772	1990	636.4963				HMDB29205
1-lignoceroyl-GPC (24:0)	Lipid	Lysophospholipid	49617	LC/MS Pos Late	100002873	1907	608.465	24779481	325171-59-3		HMDB0010405
1-linoleoyl-GPC (18:2)	Lipid	Lysophospholipid	34419	LC/MS Pos Late	100001395	1465	520.3398	11988421		C04100	HMDB0010386
1-linoleoyl-GPE (18:2)*	Lipid	Lysophospholipid	36600	LC/MS Pos Late	100001570	1482	478.2928	52925130			HMDB0011507
1-myristoyl-2-arachidonoyl-GPC (14:0/20:4)*	Lipid	Phosphatidylcholine (PC)	53195	LC/MS Pos Late	100009139	1950	754.5381	24778634			HMDB0007883
1-myristoyl-2-palmitoyl-GPC (14:0/16:0)	Lipid	Phosphatidylcholine (PC)	19258	LC/MS Pos Late	100000672	2250	706.5381	129657	69525-80-0		HMDB0007869
1-oleoyl-2-arachidonoyl-GPE (18:1/20:4)*	Lipid	Phosphatidylethanolamine (PE)	55041	LC/MS Pos Late	100009219	2200	766.5381	348281223			HMDB0009069
1-oleoyl-2-arachidonoyl-GPI (18:1/20:4)*	Lipid	Phosphatidylinositol (PI)	54994	LC/MS Pos Late	100010951	2568	902.5753
1-oleoyl-2-docosahexaenoyl-GPC (18:1/22:6)*	Lipid	Phosphatidylcholine (PC)	52697	LC/MS Pos Late	100009130	2100	832.5851	24778955			HMDB0008123
1-oleoyl-2-docosahexaenoyl-GPE (18:1/22:6)*	Lipid	Phosphatidylethanolamine (PE)	53209	LC/MS Pos Late	100009220	2119	790.5381	52922113			HMDB0009078
1-oleoyl-2-linoleoyl-GPE (18:1/18:2)*	Lipid	Phosphatidylethanolamine (PE)	52687	LC/MS Pos Late	100009078	2270	742.5381	9546753			HMDB0005349
1-oleoyl-GPG (18:1)*	Lipid	Lysophospholipid	45968	LC/MS Pos Late	100005716	1628	511.3029
1-oleoyl-GPS (18:1)	Lipid	Lysophospholipid	19260	LC/MS Pos Late	100000630	1555	524.2983	85036846	326589-90-6		HMDB0061694
1-palmitoleoyl-2-oleoyl-GPC (16:1/18:1)*	Lipid	Phosphatidylcholine (PC)	52458	LC/MS Pos Late	100008983	2155	758.5694
1-palmitoleoyl-2-oleoyl-GPE (16:1/18:1)*	Lipid	Phosphatidylethanolamine (PE)	52469	LC/MS Pos Late	100008995	2325	716.5225	52924899			HMDB0009056
1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6)	Lipid	Phosphatidylcholine (PC)	52462	LC/MS Pos Late	100008914	2200	782.5694	10747814	35418-58-7	C05208	HMDB0007982
1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4)*	Lipid	Phosphatidylethanolamine (PE)	52464	LC/MS Pos Late	100008990	2250	740.5225	9546800		C05210	HMDB0005323
1-palmitoyl-2-arachidonoyl-GPI (16:0/20:4)*	Lipid	Phosphatidylinositol (PI)	52467	LC/MS Pos Late	100008993	2567	876.5597				HMDB0009789
1-palmitoyl-2-docosahexaenoyl-GPC (16:0/22:6)	Lipid	Phosphatidylcholine (PC)	52610	LC/MS Pos Late	100008915	2055	806.5694	6441886	59403-54-2		HMDB0007991
1-palmitoyl-2-docosahexaenoyl-GPE (16:0/22:6)*	Lipid	Phosphatidylethanolamine (PE)	52465	LC/MS Pos Late	100008991	2160	764.5225	9546799			HMDB0008946
1-palmitoyl-2-gamma-linolenoyl-GPC (16:0/18:3n6)*	Lipid	Phosphatidylcholine (PC)	54812	LC/MS Pos Late	100009154	2110	756.5538	24778699			HMDB0007974
1-palmitoyl-2-linoleoyl-GPC (16:0/18:2)	Lipid	Phosphatidylcholine (PC)	42446	LC/MS Pos Late	1537	2160	758.5694	5287971	40811-94-7		HMDB0007973
1-palmitoyl-2-oleoyl-GPC (16:0/18:1)	Lipid	Phosphatidylcholine (PC)	52461	LC/MS Pos Late	1539	2450	760.5851	6436017	26853-31-6;26853-31-6	C13875	HMDB0007972
1-palmitoyl-2-oleoyl-GPE (16:0/18:1)	Lipid	Phosphatidylethanolamine (PE)	19263	LC/MS Pos Late	1526	2600	718.5381	5283496	26662-94-2		HMDB0005320
1-palmitoyl-2-oleoyl-GPI (16:0/18:1)*	Lipid	Phosphatidylinositol (PI)	52669	LC/MS Pos Late	100009066	3140	854.5753	71296232			HMDB0009783
1-palmitoyl-2-oleoyl-GPS (16:0/18:1)	Lipid	Phosphatidylserine (PS)	19261	LC/MS Pos Late	1531	2660	762.528	5283499	40290-44-6	C13880	HMDB0012357
1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1)*	Lipid	Phosphatidylcholine (PC)	52470	LC/MS Pos Late	100008984	2200	732.5538	6443788			HMDB0007969
1-palmitoyl-2-stearoyl-GPC (16:0/18:0)	Lipid	Phosphatidylcholine (PC)	52616	LC/MS Pos Late	100008921	2750	762.6007	24778686	59403-51-9	C03889	HMDB0007970
1-palmitoyl-2-stearoyl-GPE (16:0/18:0)*	Lipid	Phosphatidylethanolamine (PE)	57388	LC/MS Pos Late	100009205	2850	720.5538	5326793			HMDB08925
1-palmitoyl-GPC (16:0)	Lipid	Lysophospholipid	33955	LC/MS Pos Late	100001263	1525	496.3398	86554	17364-16-8	C04102	HMDB0010382
1-palmitoyl-GPE (16:0)	Lipid	Lysophospholipid	35631	LC/MS Pos Late	100001567	1544	454.2928	9547069	53862-35-4		HMDB0011503
1-stearoyl-2-arachidonoyl-GPC (18:0/20:4)	Lipid	Phosphatidylcholine (PC)	42450	LC/MS Pos Late	100001869	2400	810.6007	16219824	35418-59-8		HMDB0008048
1-stearoyl-2-arachidonoyl-GPE (18:0/20:4)	Lipid	Phosphatidylethanolamine (PE)	52447	LC/MS Pos Late	100008977	2475	768.5538	5289133		C05210	HMDB0009003
1-stearoyl-2-arachidonoyl-GPI (18:0/20:4)	Lipid	Phosphatidylinositol (PI)	52449	LC/MS Pos Late	100000616	3000	904.591		383907-33-3		HMDB0009815
1-stearoyl-2-arachidonoyl-GPS (18:0/20:4)	Lipid	Phosphatidylserine (PS)	52235	LC/MS Pos Late	100001872	2565	812.5436	24779545			HMDB0012383
1-stearoyl-2-docosahexaenoyl-GPC (18:0/22:6)	Lipid	Phosphatidylcholine (PC)	52611	LC/MS Pos Late	100008916	2300	834.6013	24778876	59403-52-0		HMDB0008057
1-stearoyl-2-docosahexaenoyl-GPE (18:0/22:6)*	Lipid	Phosphatidylethanolamine (PE)	52466	LC/MS Pos Late	100008992	2375	792.5538	9546798			HMDB0009012
1-stearoyl-2-linoleoyl-GPI (18:0/18:2)	Lipid	Phosphatidylinositol (PI)	52468	LC/MS Pos Late	100008994	3185	880.591				HMDB0009809
1-stearoyl-2-linoleoyl-GPS (18:0/18:2)	Lipid	Phosphatidylserine (PS)	53009	LC/MS Pos Late	100000642	2689	788.5436	9547091	322647-11-0
1-stearoyl-2-oleoyl-GPC (18:0/18:1)	Lipid	Phosphatidylcholine (PC)	52438	LC/MS Pos Late	100008904	2644	788.6164	24778825	56421-10-4		HMDB0008038
1-stearoyl-2-oleoyl-GPE (18:0/18:1)	Lipid	Phosphatidylethanolamine (PE)	42448	LC/MS Pos Late	100001856	2950	746.5694	9546742			HMDB0008993
1-stearoyl-2-oleoyl-GPI (18:0/18:1)*	Lipid	Phosphatidylinositol (PI)	52726	LC/MS Pos Late	100009181	3711	882.6066
1-stearoyl-2-oleoyl-GPS (18:0/18:1)	Lipid	Phosphatidylserine (PS)	19265	LC/MS Pos Late	100000639	3000	790.5593	9547087			HMDB0010163
1-stearoyl-GPC (18:0)	Lipid	Lysophospholipid	33961	LC/MS Pos Late	100001271	1606	524.3711	497300	19420-57-6		HMDB0010384
1-stearoyl-GPE (18:0)	Lipid	Lysophospholipid	42398	LC/MS Pos Late	100001461	1626	482.3241	9547068	69747-55-3		HMDB0011130
1-stearoyl-GPI (18:0)	Lipid	Lysophospholipid	19324	LC/MS Pos Late	100000656	1700	601.3347	71581135;42607495	796963-93-4		HMDB0240261
1-stearoyl-GPS (18:0)*	Lipid	Lysophospholipid	45966	LC/MS Pos Late	100004327	1634	526.314	74819135			HMDB0061698
3-hydroxydecanoylcarnitine	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Hydroxy)	63358	LC/MS Pos Late	100021141	961	332.2432	121454166			HMDB0061636
4-cholesten-3-one	Lipid	Sterol	38125	LC/MS Pos Late	100002227	2520	385.3465	91477	601-57-0	C00599	HMDB0000921
6-keto prostaglandin F1alpha	Lipid	Eicosanoid	20476	LC/MS Pos Late	100000571	926	353.2323	5280888	58961-34-8;58962-34-8	C05961	HMDB0002886
alpha-tocopherol	Cofactors and Vitamins	Tocopherol Metabolism	1561	LC/MS Pos Late	1105	2522	430.3782	86472	59-02-9;10191-41-0	C02477	HMDB0001893
arachidonate (20:4n6)	Lipid	Long Chain Polyunsaturated Fatty Acid (n3 and n6)	1110	LC/MS Pos Late	229	1640	305.2475	444899	506-32-1	C00219	HMDB0001043
arachidoylcarnitine (C20)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Long Chain Saturated)	57513	LC/MS Pos Late	100015833	1512	456.4047	53477833			HMDB0006460
behenoyl dihydrosphingomyelin (d18:0/22:0)*	Lipid	Dihydrosphingomyelins	57331	LC/MS Pos Late	100009026	3300	789.6844	44260132			HMDB0012091
behenoyl sphingomyelin (d18:1/22:0)*	Lipid	Sphingomyelins	48492	LC/MS Pos Late	100006294	3250	787.6688	44260125			HMDB0012103
behenoylcarnitine (C22)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Long Chain Saturated)	57514	LC/MS Pos Late	100015832	1561	484.436	71464577			HMDB0062468
bilirubin	Cofactors and Vitamins	Hemoglobin and Porphyrin Metabolism	43807	LC/MS Pos Late	1090	1840	585.2708	5280352	635-65-4	C00486	HMDB0000054
carotene diol (1)	Cofactors and Vitamins	Vitamin A Metabolism	57635	LC/MS Pos Late	100015966	1720	568.4276
ceramide (d16:1/24:1, d18:1/22:1)*	Lipid	Ceramides	57437	LC/MS Pos Late	100015727	3850	620.5976
ceramide (d18:1/14:0, d16:1/16:0)*	Lipid	Ceramides	57432	LC/MS Pos Late	100015735	2477	510.4881
ceramide (d18:1/17:0, d17:1/18:0)*	Lipid	Ceramides	57434	LC/MS Pos Late	100015737	3055	552.5351
ceramide (d18:1/20:0, d16:1/22:0, d20:1/18:0)*	Lipid	Ceramides	57440	LC/MS Pos Late	100015755	3920	594.582
ceramide (d18:2/24:1, d18:1/24:2)*	Lipid	Ceramides	57443	LC/MS Pos Late	100015744	3858	646.6133
cerotoylcarnitine (C26)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Long Chain Saturated)	57516	LC/MS Pos Late	100015835	1649	540.4986	53477828			HMDB0006347
cholesterol	Lipid	Sterol	63	LC/MS Pos Late	266	2707	369.3516	6432564;11025495;5997	57-88-5	C00187	HMDB0000067
cis-3,4-methyleneheptanoylcarnitine	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Medium Chain)	64389	LC/MS Pos Late	100021728	845	286.2013
desmosterol	Lipid	Sterol	6065	LC/MS Pos Late	306	2364	367.3359	439577	313-04-2	C01802	HMDB0002719
docosahexaenoylcholine	Lipid	Fatty Acid Metabolism (Acyl Choline)	53263	LC/MS Pos Late	100009333	1378	414.3367
eicosanoylsphingosine (d20:1)*	Lipid	Sphingosines	57597	LC/MS Pos Late	100015870	1443	328.321
eicosenoylcarnitine (C20:1)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Monounsaturated)	57519	LC/MS Pos Late	100015838	1484	454.3891
erucoylcarnitine (C22:1)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Monounsaturated)	57525	LC/MS Pos Late	100015841	1535	482.4204
glycosyl ceramide (d16:1/24:1, d18:1/22:1)*	Lipid	Hexosylceramides (HCER)	57457	LC/MS Pos Late	100015730	3373	782.6505
glycosyl ceramide (d18:1/20:0, d16:1/22:0)*	Lipid	Hexosylceramides (HCER)	57595	LC/MS Pos Late	100015882	3414	756.6348
glycosyl ceramide (d18:1/23:1, d17:1/24:1)*	Lipid	Hexosylceramides (HCER)	57448	LC/MS Pos Late	100015751	3667	796.6661
glycosyl ceramide (d18:2/24:1, d18:1/24:2)*	Lipid	Hexosylceramides (HCER)	57453	LC/MS Pos Late	100015745	3380	808.6661
glycosyl-N-(2-hydroxynervonoyl)-sphingosine (d18:1/24:1(2OH))*	Lipid	Hexosylceramides (HCER)	57444	LC/MS Pos Late	100015752	3839	826.6767
glycosyl-N-behenoyl-sphingadienine (d18:2/22:0)*	Lipid	Hexosylceramides (HCER)	57421	LC/MS Pos Late	100015625	3420	782.6505
glycosyl-N-palmitoyl-sphingosine (d18:1/16:0)	Lipid	Hexosylceramides (HCER)	53013	LC/MS Pos Late	100009272	2623	700.5722
glycosyl-N-stearoyl-sphinganine (d18:0/18:0)*	Lipid	Hexosylceramides (HCER)	57418	LC/MS Pos Late	100015694	3134	730.6192	6321364
glycosyl-N-stearoyl-sphingosine (d18:1/18:0)	Lipid	Hexosylceramides (HCER)	52234	LC/MS Pos Late	100001882	3053	728.6035
heme	Cofactors and Vitamins	Hemoglobin and Porphyrin Metabolism	41754	LC/MS Pos Late	100001386	1124	616.1767	26945	14875-96-8	C00032	HMDB0003178
heptadecasphingosine (d17:1)	Lipid	Sphingosines	57427	LC/MS Pos Late	100015724	1377	286.2741	5283557	6918-48-5
hexadecasphinganine (d16:0)*	Lipid	Sphingolipid Synthesis	57544	LC/MS Pos Late	100015865	1300	274.2741	656816		C13915
hexadecasphingosine (d16:1)*	Lipid	Sphingosines	57428	LC/MS Pos Late	100015723	1289	272.2584	14767871
lactosyl-N-behenoyl-sphingosine (d18:1/22:0)*	Lipid	Lactosylceramides (LCER)	57422	LC/MS Pos Late	100015623	3842	946.7189	44260143			HMDB0011594
lactosyl-N-nervonoyl-sphingosine (d18:1/24:1)*	Lipid	Lactosylceramides (LCER)	57370	LC/MS Pos Late	100015620	3778	972.7346
lactosyl-N-palmitoyl-sphingosine (d18:1/16:0)	Lipid	Lactosylceramides (LCER)	53010	LC/MS Pos Late	100009030	2527	862.625	53477895	4201-62-1
lactosyl-N-stearoyl-sphingosine (d18:1/18:0)*	Lipid	Lactosylceramides (LCER)	54980	LC/MS Pos Late	100010945	2906	890.6563	10260120			HMDB0011591
laurylcarnitine (C12)	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Medium Chain)	34534	LC/MS Pos Late	100001392	1235	344.2795	168381	25518-54-1		HMDB000225
lignoceroyl sphingomyelin (d18:1/24:0)	Lipid	Sphingomyelins	57330	LC/MS Pos Late	100006298	3437	815.7001		60037-60-7
lignoceroylcarnitine (C24)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Long Chain Saturated)	57515	LC/MS Pos Late	100015834	1603	512.4673
linoleoyl-arachidonoyl-glycerol (18:2/20:4) [1]*	Lipid	Diacylglycerol	54955	LC/MS Pos Late	100010922	2590	658.5405	9543796			HMDB0007257
linoleoylcarnitine (C18:2)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Polyunsaturated)	46223	LC/MS Pos Late	100003151	1430	424.3421	6450015	36816-10-1		HMDB0006469
linoleoylcholine*	Lipid	Fatty Acid Metabolism (Acyl Choline)	57463	LC/MS Pos Late	100015760	1388	366.3367	53481656			HMDB0013213
margaroyl ethanolamide*	Lipid	Endocannabinoid	57542	LC/MS Pos Late	100015863	1714	314.3054	14455158
margaroylcarnitine (C17)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Long Chain Saturated)	57512	LC/MS Pos Late	100004054	1424	414.3578	53477803	106182-29-0		HMDB0006210
myristoleoylcarnitine (C14:1)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Monounsaturated)	48182	LC/MS Pos Late	100006051	1316	370.2947	129691961	889848-55-9		HMDB0240588
myristoyl dihydrosphingomyelin (d18:0/14:0)*	Lipid	Dihydrosphingomyelins	57365	LC/MS Pos Late	100009038	2060	677.5592	44260138			HMDB0012085
myristoylcarnitine (C14)	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Long Chain Saturated)	33952	LC/MS Pos Late	100001270	1350	372.3108	6426854	18822-89-4		HMDB000506
N-behenoyl-sphingadienine (d18:2/22:0)*	Lipid	Ceramides	57372	LC/MS Pos Late	100015624	3911	620.5976
nervonoyl ethanolamide (24:1)*	Lipid	Endocannabinoid	57536	LC/MS Pos Late	100015857	2153	410.3993
nervonoylcarnitine (C24:1)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Monounsaturated)	57531	LC/MS Pos Late	100015846	1602	510.4517
N-nervonoyl-sphingadiene (d18:2/24:1)*	Lipid	Ceramides	57442	LC/MS Pos Late	100015699	3858	646.6132
N-palmitoyl-phytosphingosine (t18:0/16:0)	Lipid	Dihydroceramides	62881	LC/MS Pos Late	100019761	2632	556.5299	10506988			HMDB0010697
N-palmitoyl-sphingadienine (d18:2/16:0)*	Lipid	Ceramides	57416	LC/MS Pos Late	100015609	2490	536.5037
N-palmitoyl-sphinganine (d18:0/16:0)	Lipid	Dihydroceramides	52604	LC/MS Pos Late	100009028	3090	540.535	5283572	5966-29-0		HMDB11760
N-palmitoyl-sphingosine (d18:1/16:0)	Lipid	Ceramides	44877	LC/MS Pos Late	1518	2893	538.5194	5283564	24696-26-2		HMDB0004949
N-stearoyl-sphingadienine (d18:2/18:0)*	Lipid	Ceramides	57417	LC/MS Pos Late	100015632	2846	564.535	132282053
N-stearoyl-sphinganine (d18:0/18:0)*	Lipid	Dihydroceramides	1759	LC/MS Pos Late	922	3526	568.5663	5283573	2304-80-5
N-stearoyl-sphingosine (d18:1/18:0)*	Lipid	Ceramides	54979	LC/MS Pos Late	1547	3392	566.5507	5283565	104404-17-3		HMDB0004950
octanoylcarnitine (C8)	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Medium Chain)	33936	LC/MS Pos Late	100001247	950	288.2169	11953814;123701	3671-77-0	C02838	HMDB0000791
oleoyl ethanolamide	Lipid	Endocannabinoid	38102	LC/MS Pos Late	1137	1661	326.3054	5283454	11-58-0;111-58-0		HMDB0002088
oleoyl-arachidonoyl-glycerol (18:1/20:4) [2]*	Lipid	Diacylglycerol	54961	LC/MS Pos Late	100010937	2990	660.5562	9543786			HMDB0007228
oleoylcarnitine (C18:1)	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Monounsaturated)	35160	LC/MS Pos Late	100001501	1423	426.3578	6441392	38677-66-6		HMDB0005065
oleoylcholine	Lipid	Fatty Acid Metabolism (Acyl Choline)	53260	LC/MS Pos Late	100009331	1449	368.3523	59040790			HMDB0240596
oleoyl-linoleoyl-glycerol (18:1/18:2) [1]	Lipid	Diacylglycerol	46798	LC/MS Pos Late	100002989	3115	636.5562	14275396	106292-55-1		HMDB0007219
oleoyl-linoleoyl-glycerol (18:1/18:2) [2]	Lipid	Diacylglycerol	46799	LC/MS Pos Late	100002990	3223	636.5562	71433693	104346-53-4		HMDB0007219
oleoyl-oleoyl-glycerol (18:1/18:1) [1]*	Lipid	Diacylglycerol	54945	LC/MS Pos Late	100010918	3571	638.5718	9543716			HMDB0007218
oleoyl-oleoyl-glycerol (18:1/18:1) [2]*	Lipid	Diacylglycerol	54946	LC/MS Pos Late	100010919	3695	638.5718	9543716			HMDB0007218
palmitoleoyl ethanolamide*	Lipid	Endocannabinoid	57541	LC/MS Pos Late	100015862	1546	298.2741	9835868			HMDB0013648
palmitoleoylcarnitine (C16:1)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Monounsaturated)	53223	LC/MS Pos Late	100009406	1357	398.3265	71464547
palmitoleoyl-oleoyl-glycerol (16:1/18:1) [2]*	Lipid	Diacylglycerol	52631	LC/MS Pos Late	100009054	3154	610.5405	71768100
palmitoloelycholine	Lipid	Fatty Acid Metabolism (Acyl Choline)	53257	LC/MS Pos Late	100009334	1385	340.321
palmitoyl dihydrosphingomyelin (d18:0/16:0)*	Lipid	Dihydrosphingomyelins	52434	LC/MS Pos Late	100008954	2290	705.5905	9939965			HMDB0010168
palmitoyl ethanolamide	Lipid	Endocannabinoid	38165	LC/MS Pos Late	1489	1643	300.2897	4671	544-31-0	C16512	HMDB0002100
palmitoyl sphingomyelin (d18:1/16:0)	Lipid	Sphingomyelins	37506	LC/MS Pos Late	100002107	2168	703.5749	9939941	6254-89-3		HMDB0010169
palmitoyl-arachidonoyl-glycerol (16:0/20:4) [1]*	Lipid	Diacylglycerol	54957	LC/MS Pos Late	100010924	2916	634.5405	9543736			HMDB0007112
palmitoyl-arachidonoyl-glycerol (16:0/20:4) [2]*	Lipid	Diacylglycerol	54958	LC/MS Pos Late	100010925	3015	634.5405	9543736			HMDB0007112
palmitoylcarnitine (C16)	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Long Chain Saturated)	44681	LC/MS Pos Late	100000776	1425	400.3421	461	6865-14-1	C02990	HMDB0000222
palmitoylcholine	Lipid	Fatty Acid Metabolism (Acyl Choline)	52944	LC/MS Pos Late	100009233	1482	342.3367	151731			HMDB0240592
palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]*	Lipid	Diacylglycerol	52634	LC/MS Pos Late	100009055	3197	610.5405	131801744			HMDB0007103
palmitoyl-oleoyl-glycerol (16:0/18:1) [1]*	Lipid	Diacylglycerol	54943	LC/MS Pos Late	100010916	3562	612.5562	5282283		C13861	HMDB0007102
palmitoyl-oleoyl-glycerol (16:0/18:1) [2]*	Lipid	Diacylglycerol	54942	LC/MS Pos Late	100010917	3695	612.5562	5282283		C13861	HMDB0007102
palmitoyl-palmitoyl-glycerol (16:0/16:0) [2]*	Lipid	Diacylglycerol	54990	LC/MS Pos Late	100010948	3734	586.5405	644078			HMDB0007098
palmitoyl-sphingosine-phosphoethanolamine (d18:1/16:0)	Lipid	Ceramide PEs	62984	LC/MS Pos Late	100021162	2207	661.5279
pentadecanoylcarnitine (C15)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Long Chain Saturated)	57522	LC/MS Pos Late	100015842	1362	386.3265	123132011			HMDB0062517
phytosphingosine	Lipid	Sphingolipid Synthesis	1510	LC/MS Pos Late	469	1367	318.3003	122121	554-62-1	C12144	HMDB0004610
retinol (Vitamin A)	Cofactors and Vitamins	Vitamin A Metabolism	1806	LC/MS Pos Late	498	1636	269.2264	445354	68-26-8	C00473	HMDB0000305
sphingadienine	Lipid	Sphingolipid Synthesis	57426	LC/MS Pos Late	100015643	1350	298.2741	6449795	25696-03-1
sphinganine	Lipid	Sphingolipid Synthesis	17769	LC/MS Pos Late	313	1413	302.3054	3126	3102-56-5	C00836	HMDB0000269
sphingomyelin (d17:1/14:0, d16:1/15:0)*	Lipid	Sphingomyelins	62152	LC/MS Pos Late	100020276	1950	661.5279
sphingomyelin (d17:1/16:0, d18:1/15:0, d16:1/17:0)*	Lipid	Sphingomyelins	52433	LC/MS Pos Late	100006314	2082	689.5592		121999-58-4
sphingomyelin (d17:2/16:0, d18:2/15:0)*	Lipid	Sphingomyelins	57483	LC/MS Pos Late	100015793	1875	687.5436
sphingomyelin (d18:0/18:0, d19:0/17:0)*	Lipid	Dihydrosphingomyelins	57473	LC/MS Pos Late	100009027	2500	733.6218	44260130			HMDB0012087
sphingomyelin (d18:0/20:0, d16:0/22:0)*	Lipid	Dihydrosphingomyelins	57476	LC/MS Pos Late	100015786	2850	761.6531
sphingomyelin (d18:1/14:0, d16:1/16:0)*	Lipid	Sphingomyelins	42463	LC/MS Pos Late	100004328	1998	675.5436	11433862			HMDB0012097
sphingomyelin (d18:1/17:0, d17:1/18:0, d19:1/16:0)	Lipid	Sphingomyelins	52615	LC/MS Pos Late	100008920	2350	717.5905	46891763	121999-64-2
sphingomyelin (d18:1/18:1, d18:2/18:0)	Lipid	Sphingomyelins	37529	LC/MS Pos Late	100002106	2167	729.5905	6443882	108392-10-5		HMDB0012101
sphingomyelin (d18:1/19:0, d19:1/18:0)*	Lipid	Sphingomyelins	57475	LC/MS Pos Late	100015787	2550	745.6218
sphingomyelin (d18:1/20:0, d16:1/22:0)*	Lipid	Sphingomyelins	48490	LC/MS Pos Late	100006290	2800	759.6375	44260124			HMDB0012102
sphingomyelin (d18:1/20:1, d18:2/20:0)*	Lipid	Sphingomyelins	48491	LC/MS Pos Late	100006292	2450	757.6218		222403-67-0
sphingomyelin (d18:1/21:0, d17:1/22:0, d16:1/23:0)*	Lipid	Sphingomyelins	52495	LC/MS Pos Late	100009025	3000	773.6531
sphingomyelin (d18:1/22:1, d18:2/22:0, d16:1/24:1)*	Lipid	Sphingomyelins	48493	LC/MS Pos Late	100006295	2775	785.6531				HMDB0012104
sphingomyelin (d18:1/22:2, d18:2/22:1, d16:1/24:2)*	Lipid	Sphingomyelins	57477	LC/MS Pos Late	100006296	2350	783.6375
sphingomyelin (d18:1/24:1, d18:2/24:0)*	Lipid	Sphingomyelins	47153	LC/MS Pos Late	100005986	3200	813.6844	44260126	94359-13-4		HMDB0012107
sphingomyelin (d18:1/25:0, d19:0/24:1, d20:1/23:0, d19:1/24:0)*	Lipid	Sphingomyelins	57478	LC/MS Pos Late	100015792	3500	829.7157
sphingomyelin (d18:2/14:0, d18:1/14:1)*	Lipid	Sphingomyelins	47154	LC/MS Pos Late	100005985	1860	673.5279
sphingomyelin (d18:2/16:0, d18:1/16:1)*	Lipid	Sphingomyelins	42459	LC/MS Pos Late	100004329	2002	701.5592
sphingomyelin (d18:2/21:0, d16:2/23:0)*	Lipid	Sphingomyelins	57480	LC/MS Pos Late	100015790	2500	771.6375
sphingomyelin (d18:2/23:0, d18:1/23:1, d17:1/24:1)*	Lipid	Sphingomyelins	52435	LC/MS Pos Late	100008956	3000	799.6687	134757653
sphingomyelin (d18:2/23:1)*	Lipid	Sphingomyelins	57482	LC/MS Pos Late	100015791	2500	797.6531
sphingomyelin (d18:2/24:1, d18:1/24:2)*	Lipid	Sphingomyelins	52437	LC/MS Pos Late	100008957	2750	811.6687	85336023
sphingomyelin (d18:2/24:2)*	Lipid	Sphingomyelins	57479	LC/MS Pos Late	100015789	2400	809.6531
sphingosine	Lipid	Sphingosines	17747	LC/MS Pos Late	297	1393	300.2897	5280335	123-78-4	C00319	HMDB0000252
stearoyl ethanolamide	Lipid	Endocannabinoid	38625	LC/MS Pos Late	100002254	1787	328.321	27902	111-57-9		HMDB0013078
stearoyl sphingomyelin (d18:1/18:0)	Lipid	Sphingomyelins	19503	LC/MS Pos Late	1538	2450	731.6062	6453725	85187-10-6;85187-10-6	C00550	HMDB0001348
stearoyl-arachidonoyl-glycerol (18:0/20:4) [1]*	Lipid	Diacylglycerol	57450	LC/MS Pos Late	100010949	3404	662.5718	6438587		C00165	HMDB0007170
stearoyl-arachidonoyl-glycerol (18:0/20:4) [2]*	Lipid	Diacylglycerol	57449	LC/MS Pos Late	100010950	3522	662.5718	6438587			HMDB0007170
stearoylcarnitine (C18)	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Long Chain Saturated)	34409	LC/MS Pos Late	100001391	1485	428.3734	3006797	18822-91-8		HMDB0000848
stearoyl-docosahexaenoyl-glycerol (18:0/22:6) [2]*	Lipid	Diacylglycerol	57368	LC/MS Pos Late	100015617	3256	686.5718
stearoyl-linoleoyl-glycerol (18:0/18:2) [2]*	Lipid	Diacylglycerol	54947	LC/MS Pos Late	100010921	3762	638.5718
tricosanoyl sphingomyelin (d18:1/23:0)*	Lipid	Sphingomyelins	52436	LC/MS Pos Late	100008955	3350	801.6844				HMDB0012105
X - 23641			49517	LC/MS Pos Late
X - 23782			49681	LC/MS Pos Late
X - 24035			52064	LC/MS Pos Late
X - 26108			64397	LC/MS Pos Late
ximenoylcarnitine (C26:1)*	Lipid	Fatty Acid Metabolism (Acyl Carnitine, Monounsaturated)	57517	LC/MS Pos Late	100015836	1607	538.483
METABOLITES_END
#END