#METABOLOMICS WORKBENCH juliehaines_20240501_131926 DATATRACK_ID:4808 STUDY_ID:ST003184 ANALYSIS_ID:AN005228 PROJECT_ID:PR001983
VERSION             	1
CREATED_ON             	May 2, 2024, 6:17 pm
#PROJECT
PR:PROJECT_TITLE                 	A multimodal drug-diet-immunotherapy combination restrains melanoma progression
PR:PROJECT_TITLE                 	and metastasis
PR:PROJECT_SUMMARY               	The genetic landscape of cancer cells can lead to specific metabolic
PR:PROJECT_SUMMARY               	dependencies for tumor growth. Dietary interventions represent an attractive
PR:PROJECT_SUMMARY               	strategy to restrict the availability of key nutrients to tumors. In this study,
PR:PROJECT_SUMMARY               	we identified that growth of a subset of melanoma was severely restricted by a
PR:PROJECT_SUMMARY               	rationally designed combination therapy of a stearoyl-CoA desaturase (SCD)
PR:PROJECT_SUMMARY               	inhibitor with an isocaloric low-oleic acid diet. Despite its importance in
PR:PROJECT_SUMMARY               	oncogenesis, SCD underwent monoallelic co-deletion along with PTEN on chromosome
PR:PROJECT_SUMMARY               	10q in about 47.5% of melanoma, and the other SCD allele was methylated,
PR:PROJECT_SUMMARY               	resulting in very low SCD expression. While this SCD deficient subset was
PR:PROJECT_SUMMARY               	refractory to SCD inhibitors, the subset of PTEN wildtype melanoma that retained
PR:PROJECT_SUMMARY               	SCD was sensitive. As dietary oleic acid could potentially blunt the effect of
PR:PROJECT_SUMMARY               	SCD inhibitors, a low-oleic acid custom diet was combined with SCD inhibitor.
PR:PROJECT_SUMMARY               	The combination reduced monounsaturated fatty acids and increased saturated
PR:PROJECT_SUMMARY               	fatty acids, inducing robust apoptosis and growth suppression and inhibiting
PR:PROJECT_SUMMARY               	lung metastasis with minimal toxicity in preclinical mouse models of PTEN
PR:PROJECT_SUMMARY               	wildtype melanoma. When combined with anti-PD1 immunotherapy, the SCD inhibitor
PR:PROJECT_SUMMARY               	improved T cell functionality and further constrained melanoma growth in mice.
PR:PROJECT_SUMMARY               	Collectively, these results suggest that optimizing SCD inhibitors with diets
PR:PROJECT_SUMMARY               	low in oleic acid may offer a viable and efficacious therapeutic approach for
PR:PROJECT_SUMMARY               	improving melanoma treatment.
PR:INSTITUTE                     	University of Colorado Anschutz Medical Campus
PR:LABORATORY                    	Lab of Angelo D'Alessandro in collaboration with lab of Biplab Dasgupta
PR:LAST_NAME                     	Haines
PR:FIRST_NAME                    	Julie
PR:ADDRESS                       	12801 E 17th Ave, Room 1303, Aurora, Colorado, 80045, USA
PR:EMAIL                         	julie.haines@cuanschutz.edu
PR:PHONE                         	3037243339
#STUDY
ST:STUDY_TITLE                   	A multimodal drug-diet-immunotherapy combination restrains melanoma progression
ST:STUDY_TITLE                   	and metastasis - tumor lipidomics
ST:STUDY_SUMMARY                 	Lipidomics profiling of immunocompetent B16F10 model of melanoma to examine
ST:STUDY_SUMMARY                 	lipid levels in tumors following reduced oleic acid content in diet combined
ST:STUDY_SUMMARY                 	with the stearyl CoA desaturase inhibitor CAY10566.
ST:INSTITUTE                     	University of Colorado Anschutz Medical Campus
ST:LAST_NAME                     	Haines
ST:FIRST_NAME                    	Julie
ST:ADDRESS                       	12801 E 17th Ave, Room 1303, Aurora, Colorado, 80045, USA
ST:EMAIL                         	julie.haines@cuanschutz.edu
ST:PHONE                         	3037243339
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Mus musculus
SU:GENDER                        	Not applicable
#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           	-	DS2-039-001	factor:Vehicle+ low oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-001
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-002	factor:Vehicle+ low oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-002
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-003	factor:Vehicle+ low oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-003
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-004	factor:Vehicle+ low oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-004
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-005	factor:Vehicle+ low oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-005
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-006	factor:SCD inhibitor + low oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-006
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-007	factor:SCD inhibitor + low oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-007
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-008	factor:SCD inhibitor + low oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-008
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-009	factor:SCD inhibitor + low oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-009
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-010	factor:SCD inhibitor + low oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-010
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-011	factor:Vehicle + high oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-011
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-012	factor:Vehicle + high oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-012
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-013	factor:Vehicle + high oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-013
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-014	factor:Vehicle + high oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-014
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-015	factor:Vehicle + high oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-015
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-016	factor:SCD inhibitor + high oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-016
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-017	factor:SCD inhibitor + high oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-017
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-018	factor:SCD inhibitor + high oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-018
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-019	factor:SCD inhibitor + high oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-019
SUBJECT_SAMPLE_FACTORS           	-	DS2-039-020	factor:SCD inhibitor + high oleic acid diet | Sample source:tumor	RAW_FILE_NAME(raw file name)=DS2-039-020
#COLLECTION
CO:COLLECTION_SUMMARY            	For immune checkpoint inhibitor (ICI) studies, 1x10^6 B16F10 cells were mixed
CO:COLLECTION_SUMMARY            	with matrigel 1:1 and implanted subcutaneously in each flank into C57BL/6 mice.
CO:COLLECTION_SUMMARY            	Mice were randomized into groups with combinations of sunflower or coconut oil
CO:COLLECTION_SUMMARY            	diet, vehicle or CAY10566, and IgG or anti-PD1 treatments. CAY10566 was prepared
CO:COLLECTION_SUMMARY            	and administered as previously described. IgG and anti-PD1 were diluted in PBS
CO:COLLECTION_SUMMARY            	to a concentration of 1ug/uL. 100uL of IgG or anti-PD1 were administered
CO:COLLECTION_SUMMARY            	intraperitoneally twice weekly, every 3-4 days. Mice were euthanized and tumors
CO:COLLECTION_SUMMARY            	were harvested 17 days after tumor implantation/14 days after the start of
CO:COLLECTION_SUMMARY            	treatment. Tumor tissues were processed for flow cytometry analysis. For lung
CO:COLLECTION_SUMMARY            	metastasis studies, ZsGreen expressing B16F10 cells were established by
CO:COLLECTION_SUMMARY            	transducing them with concentrated ZsGreen virus produced by the Viral Vector
CO:COLLECTION_SUMMARY            	Core at CCHMC. Cells were then FACS sorted to obtain a pure population of
CO:COLLECTION_SUMMARY            	B16F10-ZsGreen cells prior to injection. 2x10^5 B16F10-ZsGreen cells were
CO:COLLECTION_SUMMARY            	injected via tail vein into C57BL/6 mice by trained veterinary staff of CCHMC.
CO:COLLECTION_SUMMARY            	Mice were randomized into groups with combinations of sunflower or coconut oil
CO:COLLECTION_SUMMARY            	diet, and vehicle or CAY10566. CAY10566 was prepared and administered as
CO:COLLECTION_SUMMARY            	previously described. Mice were euthanized and lungs were harvested 17 days
CO:COLLECTION_SUMMARY            	after tumor cell injection/14 days after the start of treatment. B16F10-ZsGreen
CO:COLLECTION_SUMMARY            	metastatic tumor nodes were detected by fluorescence microscopy, and
CO:COLLECTION_SUMMARY            	quantification was performed using Image J.
CO:SAMPLE_TYPE                   	Tumor cells
#TREATMENT
TR:TREATMENT_SUMMARY             	All animal procedures were carried out in accordance with the IACUC-approved
TR:TREATMENT_SUMMARY             	protocol of Cincinnati Children’s Hospital Medical Center. Animals were
TR:TREATMENT_SUMMARY             	monitored daily by Veterinary Services. For subcutaneous tumor implantation,
TR:TREATMENT_SUMMARY             	1x10^6 B16F10 cells were mixed with matrigel 1:1 and implanted subcutaneously
TR:TREATMENT_SUMMARY             	into NOD-SCID IL2Rgnull or C57BL/6 mice, respectively. CAY10566 was suspended in
TR:TREATMENT_SUMMARY             	0.5% Methyl Cellulose in water with 0.2% Tween 80 at 9 parts per 1 part DMSO
TR:TREATMENT_SUMMARY             	stock. CAY10566 was administered at 30mg/kg via oral gavage, twice daily, with a
TR:TREATMENT_SUMMARY             	drug holiday during the weekends.
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	For tumor analysis, tissue was weighed and placed into 1.5mL Eppendorf Safe-Lock
SP:SAMPLEPREP_SUMMARY            	tubes that were pre-filled with 1.0mm glass grinder beads (Biospec Products
SP:SAMPLEPREP_SUMMARY            	Inc). Cold methanol was then added to each tube so that all final tissue
SP:SAMPLEPREP_SUMMARY            	concentrations were 20 mg/mL. Samples were then homogenized via a “Next
SP:SAMPLEPREP_SUMMARY            	Advance” Bullet Blender for 5 minutes and subsequently vortexed for 30
SP:SAMPLEPREP_SUMMARY            	minutes. Following vortex, insoluble material was pelleted by centrifugation
SP:SAMPLEPREP_SUMMARY            	(18000g, 10 min) and supernatants were isolated for analysis by UHPLC-MS.
SP:PROCESSING_STORAGE_CONDITIONS 	4℃
SP:EXTRACT_STORAGE               	-80℃
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	Negative C18 global lipidomics
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
CH:INSTRUMENT_NAME               	Thermo Vanquish
CH:COLUMN_NAME                   	Phenomenex Kinetex C18 (30 x 2.1mm,1.7um)
CH:SOLVENT_A                     	75% water/25% acetonitrile; 5 mM ammonium acetate
CH:SOLVENT_B                     	90% isopropanol/10% acetonitrile; 5 mM ammonium acetate
CH:FLOW_GRADIENT                 	0-3 min 10-95% B at 0.3 mL/min, 3-4.2 min hold at 95% B at 0.3 mL/min, 4.2-4.3
CH:FLOW_GRADIENT                 	min drop to 10% B at 0.45 mL/min, 4.3-4.9 min hold at 10%B while lowering flow
CH:FLOW_GRADIENT                 	rate to 0.4 mL/min, 4.9-5 min hold at 10%B while lowering flow rate to 0.3
CH:FLOW_GRADIENT                 	mL/min.
CH:FLOW_RATE                     	0.3-0.4 ml/min
CH:COLUMN_TEMPERATURE            	45
CH:SAMPLE_INJECTION              	10 uL
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Thermo Q Exactive Orbitrap
MS:INSTRUMENT_TYPE               	Orbitrap
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	NEGATIVE
MS:MS_COMMENTS                   	The Q Exactive was run independently in positive and negative ion mode, scanning
MS:MS_COMMENTS                   	using full MS from 125-1500 m/z at 70,000 resolution and top 10 data-dependent
MS:MS_COMMENTS                   	MS2 at 17,500 resolution. Electrospray ionization was achieved with 45 Arb
MS:MS_COMMENTS                   	sheath gas, 25 Arb auxiliary gas, and 4 kV spray voltage. Calibration was
MS:MS_COMMENTS                   	performed prior to the run using the PierceTM Positive and Negative Ion
MS:MS_COMMENTS                   	Calibration Solutions (Thermo Fisher Scientific). Run order of samples was
MS:MS_COMMENTS                   	randomized and technical replicates were injected after every 4 samples to
MS:MS_COMMENTS                   	assess quality control.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	peak area
MS_METABOLITE_DATA_START
Samples	DS2-039-001	DS2-039-002	DS2-039-003	DS2-039-004	DS2-039-005	DS2-039-006	DS2-039-007	DS2-039-008	DS2-039-009	DS2-039-010	DS2-039-011	DS2-039-012	DS2-039-013	DS2-039-014	DS2-039-015	DS2-039-016	DS2-039-017	DS2-039-018	DS2-039-019	DS2-039-020
Factors	factor:Vehicle+ low oleic acid diet | Sample source:tumor	factor:Vehicle+ low oleic acid diet | Sample source:tumor	factor:Vehicle+ low oleic acid diet | Sample source:tumor	factor:Vehicle+ low oleic acid diet | Sample source:tumor	factor:Vehicle+ low oleic acid diet | Sample source:tumor	factor:SCD inhibitor + low oleic acid diet | Sample source:tumor	factor:SCD inhibitor + low oleic acid diet | Sample source:tumor	factor:SCD inhibitor + low oleic acid diet | Sample source:tumor	factor:SCD inhibitor + low oleic acid diet | Sample source:tumor	factor:SCD inhibitor + low oleic acid diet | Sample source:tumor	factor:Vehicle + high oleic acid diet | Sample source:tumor	factor:Vehicle + high oleic acid diet | Sample source:tumor	factor:Vehicle + high oleic acid diet | Sample source:tumor	factor:Vehicle + high oleic acid diet | Sample source:tumor	factor:Vehicle + high oleic acid diet | Sample source:tumor	factor:SCD inhibitor + high oleic acid diet | Sample source:tumor	factor:SCD inhibitor + high oleic acid diet | Sample source:tumor	factor:SCD inhibitor + high oleic acid diet | Sample source:tumor	factor:SCD inhibitor + high oleic acid diet | Sample source:tumor	factor:SCD inhibitor + high oleic acid diet | Sample source:tumor
Cer(d19:0_16:0)	216238	295140	701603	284235	229564	156097	124289	115269	363045	158059	240634	877155	399223	398570	258675	361699	177431	133184	400764	171308
CL(16:0_16:0_18:1_18:1)	71411	47860	43224	61617	60649	19526	20268	15596	15459	14130	43084	18239	22428	38126	33311	18912	26501	17113	15862	15748
CL(16:0_16:1_18:1_18:1)	48854	49036	47575	55942	55051	29739	26667	19562	21935	18470	43638	15801	19055	163	31143	22730	35232	18895	13155	13334
CL(16:0_16:1_18:1_18:2)	60225	73763	77206	107260	65456	19826	24740	22856	25276	22399	55651	26349	25110	70393	44601	18701	30562	17967	13891	13190
CL(16:0_18:0_18:1_18:2)	89926	88332	409	93297	59043	27673	31736	27719	24381	20164	143	31363	50231	64767	27858	28725	42986	25824	19931	20403
CL(16:0_18:0_18:2_18:2)	157554	155553	139113	170926	133266	48370	57152	41649	49348	45539	132484	62812	71002	120994	93942	43012	63440	43866	29744	31779
CL(16:0_18:2_18:2_18:2)	133868	225309	151292	208677	180791	51334	48771	47749	52323	56176	160593	95247	92878	190165	123976	41804	231	39688	37825	32619
CL(16:1_16:1_18:1_18:2)	55361	71641	83879	71918	46121	16448	17658	20313	13543	14474	39764	27858	25574	62929	68827	20586	26809	12307	10898	10288
CL(16:1_18:1_18:1_18:2)	167591	228812	207473	222069	170748	59377	64328	46612	57958	54094	180995	81569	84602	188940	143909	54426	82916	52862	39607	37540
CL(16:1_18:2_18:2_18:2)	59774	58729	51101	54171	42786	21668	17106	24719	23005	25813	35735	50452	42307	57765	58193	17850	22880	15517	18878	14096
CL(18:0_18:1_18:2_18:2)-2H	11963	24030	9984	14718	9807	4791	5280	3405	3592	2792	19960	11534	14744	11129	15813	3857	5812	6102	4266	4917
CL(18:0_18:2_18:2_20:2)	47957	59415	32828	45471	29826	31410	45078	39058	29756	28609	36275	38294	48055	64394	38542	45642	34180	42111	24316	28667
CL(18:1_18:1_18:2_18:2)	312874	381850	292779	295965	232539	180091	1924	154261	170737	112339	247748	270921	252611	311546	288097	211982	270956	122148	167623	116112
CL(18:1_18:1_18:2_18:2)-2H	41672	31160	21153	24867	19485	12089	10213	10932	10260	8349	19279	20157	18535	21786	26710	14138	20595	10087	10164	11096
CL(18:1_18:1_18:2_20:3)	88775	97785	90096	87539	70853	92841	93279	102822	77500	79279	77369	90415	87152	115502	94290	90245	107164	71477	73852	76490
CL(18:1_18:1_18:2_20:4)	122164	126929	94857	120898	86426	171998	143327	185761	168609	106459	92317	117638	122134	128951	116312	178489	209252	137799	120066	120250
CL(18:1_18:2_18:2_18:2)-2H	16371	18619	12791	16732	13562	25695	18108	17882	19074	10833	13835	15930	16755	17908	17165	25975	30942	14806	14599	19729
CL(18:1_18:2_18:2_20:4)	84961	120780	72575	102146	114455	179806	190249	174209	197472	171753	90840	87794	84710	125258	111616	187544	216808	159519	129702	121445
CL(18:2_18:2_18:2_18:2)	105209	112131	79642	110535	110018	283022	285939	332339	293200	249689	82167	126201	95825	108378	113049	325263	298745	209841	202231	177303
CL(18:2_18:2_18:2_20:4)	28642	40893	30409	40148	29297	154652	154007	140985	215878	158973	28931	42276	38031	48287	47547	178745	164950	112165	88360	75803
CL(18:2_18:2_20:4_20:4)	7542	4317	2619	4126	4047	25270	26660	29991	32635	27003	5190	2403	8026	5693	10192	21201	24909	21715	14330	16263
CL(20:3_18:2_18:2_20:4)	12257	11245	6373	9035	8834	35363	34450	42649	36196	29358	9261	9238	11245	11740	15370	31797	31327	28603	18865	18094
CL(38:7_18:2_18:2)	5894	7351	4861	5048	4207	24555	21921	27372	40491	25359	3770	3679	5585	7175	6956	27235	34151	23124	21392	16591
FA(13:0)	221495	195849	234567	198934	230420	214443	222142	239117	245880	240782	250036	226188	223349	253827	226854	211308	258797	212871	245332	203776
FA(14:0)	982673	723917	976169	855205	832639	720742	743177	718261	1705753	678796	558875	1603049	843736	788866	774270	1047528	919735	482413	717116	538074
FA(14:1)	48270	44835	158996	78216	81889	20548	15846	21758	81770	33599	48034	170850	56934	74247	65113	63609	30936	23813	45543	25023
FA(15:0)	85698	97324	120319	111778	115607	90543	110427	132299	121243	117985	121433	196650	149849	122813	124617	86101	134242	82454	128908	112478
FA(17:0)	145951	121150	214445	118620	151731	112896	110811	166962	231865	114359	116837	577147	332574	134891	170248	144681	166991	88230	111885	118057
FA(17:1)	100329	67327	112198	70592	77423	32071	26147	37707	74543	27329	58996	212352	133202	58649	84185	41156	45935	18940	30891	30622
FA(19:0)	31962	26874	69321	28448	31350	21720	19819	31504	32394	18754	22695	124816	101338	26055	34543	22394	32999	16577	21187	22445
FA(19:1)	58655	52254	70210	43284	49299	32025	25474	32953	53219	21746	34778	213793	121910	39296	57134	31059	33544	20381	24743	27086
FA(19:2)	8503	11016	9875	11503	11442	7945	6049	10074	11038	6016	8108	25760	12763	7212	8267	6657	6746	3476	4704	4788
FA(20:0)	305538	383972	777642	319175	294398	410907	394733	535390	957648	330534	199498	1243234	614225	361752	362754	915920	638305	357860	408549	299497
FA(20:1)	882402	1144970	1635529	894428	784807	304395	238667	362204	729653	248472	573032	3454973	1535709	783092	975173	563745	531008	255355	324946	327401
FA(20:2)	631422	741932	955857	631923	748335	501388	461971	643934	734261	278475	362367	3171942	1122284	524145	675834	498694	506304	284196	413981	488751
FA(20:3)	967965	1496149	2885650	1443615	1288371	1183676	1456172	1545010	4555063	1085512	874193	4729129	1827539	1061948	1182192	2248272	1617869	1000389	1101110	843892
FA(20:4)	4135767	3181885	5683939	3811356	3760336	3680846	4064533	3270886	8124577	2834987	3127761	12673418	5310086	3336138	4689506	4099233	3204138	2528104	2995147	2641139
FA(20:5)	283301	278086	702392	288486	329635	368147	472996	607594	1941715	543919	194430	1064998	342168	247414	279861	935897	575577	374256	590014	355763
FA(21:0)	7365	7561	12921	5261	5479	6795	5037	7324	9079	6087	6168	15866	34079	7649	7155	5263	8877	5821	6593	6212
FA(21:5)	8911	4648	5580	3546	4994	3808	2656	8439	11966	3277	3990	24927	10476	5033	6710	4790	4733	3605	5288	4823
FA(22:0)	179334	231875	810447	202466	148165	140330	140158	151679	343385	130559	134591	975047	345888	192999	197215	337292	180252	144496	190065	123530
FA(22:1)	164029	167939	412360	186821	172875	77881	62755	90474	233254	77364	109998	660697	324370	150111	183555	125035	81582	69616	89467	86996
FA(22:2)	67052	53583	105829	64668	100290	39835	18425	55625	49501	18207	35376	245147	106235	49596	70603	31822	28125	27568	34317	58559
FA(22:3)	138159	98718	216932	121369	114074	43614	29838	56250	101510	27056	73860	439011	157791	99379	116510	18306	23561	36252	22882	49457
FA(22:4)	679868	320774	453597	430377	626975	347290	232939	334768	580141	221937	342914	2294228	701386	267946	699078	301167	221926	204925	258585	349855
FA(22:5)	654150	428616	876393	466978	695507	621709	522175	905040	1666940	505550	348302	2862127	878227	321834	635532	667030	533956	431621	590217	627385
FA(22:6)	1677491	1177795	2715208	1331656	1878048	1554264	1548238	2338364	4098043	1401461	1018382	8037621	3594799	1240214	1934581	1888128	1585531	1160120	1864002	1558001
FA(23:0)	6872	6535	16889	6278	7836	5506	2837	7950	5456	7464	8400	26022	21525	6236	6847	5741	6008	5706	9006	6281
FA(24:0)	193154	205231	660140	257559	225823	133056	134364	214635	336118	163528	151233	993831	457658	208284	254034	221701	151887	144445	287151	139068
FA(24:1)	206006	169467	428039	239179	250026	56240	21409	59392	65829	37300	151613	945566	330811	143113	234975	49361	35751	59091	92998	91047
FA(24:2)	46275	26070	54377	46666	82359	26722	7965	32989	19119	12033	25239	188825	72169	26610	43825	10932	11179	20122	29957	44130
FA(24:3)	15022	8033	17499	13177	15492	5646	2567	6372	6743	2739	7779	39188	17532	7549	12709	3604	3266	3960	3978	6237
FA(24:4)	37635	11481	21812	23617	56207	20140	10294	16550	17983	11098	19741	93411	43717	10392	47528	9953	9811	11683	13412	26239
FA(24:5)	27183	9732	17668	15283	32277	18768	10531	22275	25041	11891	11506	92201	38035	8668	22023	11393	13414	12606	15086	21946
FA(24:6)	28477	11933	22414	15291	31954	35113	24165	42423	75431	21159	11616	105078	49264	13186	18501	27739	24783	27086	25981	39316
FA(26:0)	17066	15003	22444	18410	20726	18826	12430	29105	28727	19439	13687	57445	52355	17096	18554	20820	20456	20923	29594	19569
FA(26:1)	10297	4892	12448	13735	17583	2266	922	5830	2497	2021	4976	30172	27135	7819	13682	1511	2403	5273	7216	6843
Hex1Cer(d16:0_24:1)	31850	56439	27716	33940	22278	56463	62706	46689	43597	37497	27371	20114	15019	28987	29096	47821	46749	36017	43654	33603
Hex1Cer(d42:1)	100246	96432	56703	84633	74044	96016	129909	80795	64709	70071	98059	52812	65387	69717	74902	59614	80756	67277	72545	80017
Hex1Cer(d42:2)	27045	36456	11731	27942	27870	9237	7814	6646	3658	4754	27208	17046	17266	21286	24508	4935	6259	5436	8008	10148
LPA(14:0)	171	269	174	100	49	2652	3332	9802	17265	9034	175	207	374	297	184	8656	7280	4163	8392	3247
LPA(16:0)	27128	19829	40956	19517	29699	119919	144890	325974	102653	271040	17884	101712	54503	20137	31969	341012	302313	173102	340466	135624
LPA(18:0)	1813	6596	2024	2489	1655	85785	107603	317026	522654	196147	3356	5420	10321	6537	4465	244226	217138	133481	232425	91556
LPC(19:1)	164430	210694	220521	191133	164351	67204	85891	73988	143583	69894	181502	354030	199561	210162	202009	154019	174276	87193	105693	99025
LPC(19:2)	42257	45862	64446	37943	41956	114380	116152	147454	156533	112065	34364	112189	69007	48373	50069	110650	138770	63793	77579	78500
LPC(19:3)	2867	2561	5920	3061	2396	7954	9490	10358	23234	16760	2687	3551	2311	4365	3767	14762	16562	6481	8031	8280
LPC(21:0)	16038	22858	34699	18393	17743	27982	33038	43028	33637	34044	14045	62021	25184	26734	23700	33244	32207	29803	36997	26968
LPC(21:1)	20678	21026	36284	24487	18142	5057	6314	6841	6229	6299	24133	60128	24038	26003	27886	8721	9797	6077	10052	8511
LPC(21:2)	9245	9927	14661	9994	10254	8379	8124	9759	8241	5982	8951	34713	13594	13856	12251	7194	9584	2933	7734	9985
LPC(21:4)	45104	33845	66557	42252	18483	60980	61944	49305	83797	61013	41531	123537	52209	57319	59853	58078	61883	33431	47286	70595
LPC(23:0)	15994	14790	17846	17824	15559	21655	21686	33119	22664	25654	14504	30172	14406	19591	20344	22142	20067	25405	30365	21472
LPC(23:6)	27175	23840	74316	25157	21148	42273	40022	49428	49749	30784	24629	162997	71019	33459	42348	31286	38484	26457	33104	36179
LPC(25:0)	18108	19475	19149	26439	23689	25098	24686	38741	17105	35671	19378	39427	22062	25260	25264	23379	20603	33049	41122	31391
LPC(O-17:0)	26211	17904	17918	20046	45159	57442	39894	41059	35873	22811	23571	20898	14743	18864	19858	31470	33185	28075	46211	35355
LPC(O-17:1)	13110	18098	46688	17799	16197	27802	34024	27395	50777	28431	15587	33194	13788	29910	21336	46334	23274	19396	41715	19388
LPC(O-19:0)	6900	4858	5681	6938	8061	21297	13437	18565	13492	9902	4246	5027	4152	6523	5366	13466	11154	10174	22503	10475
LPC(O-19:1)	21147	14080	18563	21856	30196	15236	9876	11276	9570	6254	22571	32645	20406	19176	28746	12437	9397	10436	25330	17586
LPE(O-16:1)	332844	491977	394625	372275	400005	611407	681714	546693	1048681	565175	346870	414768	277604	379008	356819	712067	808513	461691	596162	492794
LPE(O-18:1)	222664	295678	197956	243561	243941	483065	476902	503585	717648	404088	188584	415731	212992	206184	265908	552157	607200	361508	514157	356313
LPE(O-18:2)	181310	230771	204358	217117	165318	44431	41775	38772	55019	32580	201230	285282	235798	233319	232722	56924	74247	37955	56339	78060
LPE(O-18:3)	6141	5029	3987	6220	6872	6016	5035	5910	4856	4416	6276	12744	12268	8884	10311	3713	5933	3482	4865	8647
LPE(O-20:1)	7320	6467	5286	5747	7681	9157	8201	10017	10360	8774	4650	8317	7087	5011	7065	9082	11176	7565	9962	9031
LPE(O-26:7)	56531	39273	54780	43890	51113	53900	37514	37230	44534	54641	53690	38048	39924	64601	24138	69749	43418	55258	33959	38331
LPG(20:1)	9625	14434	6551	10063	7901	8378	9152	6175	16746	8157	7421	4996	3541	9544	6644	10810	11195	7660	7072	4865
LPI(16:0)	31487	48722	25109	38999	31698	68463	99760	95951	93933	65572	31806	33651	36483	35879	43599	78618	111306	49372	54043	34153
LPI(18:0)	317699	328136	167495	334109	364159	903295	955124	841566	735808	483218	352531	332605	422231	266753	423089	540624	875911	436797	420762	316888
LPI(18:1)	60882	121180	59981	82999	59643	22600	25001	31828	32453	17101	84435	74408	71126	73745	92547	47344	56462	26822	21992	21844
LPI(18:2)	5367	14720	9784	8997	7920	16399	16562	15094	12935	9267	6801	17350	14380	9163	12458	15531	11432	9724	12750	9176
LPI(20:0)	2696	5457	1097	3602	2439	8542	12568	10326	14214	6553	3213	4035	6944	4660	6474	8052	11490	5780	5558	3952
LPI(20:4)	61602	63279	39898	54342	50892	54536	55356	43756	54903	23916	39760	46406	47819	28841	64359	36431	44729	38176	27710	24906
PA(14:0_16:0)	4621	7113	2038	5027	4251	30421	36819	64709	92208	68589	2465	1886	4329	3945	4050	60027	60013	52604	65138	29004
PA(16:0_16:0)	23033	41975	13757	23409	22177	237341	298122	309665	640824	415191	20599	13552	31974	35508	28442	440333	444128	472388	525770	208206
PA(16:0_18:0)	9727	10646	5603	7235	4631	75923	109453	152785	218426	122044	7674	8325	15698	14545	10009	124684	107945	146264	141567	67244
PA(16:0_18:2)	11047	15015	9947	10503	11227	25549	29904	26362	27947	34780	8383	5969	12427	9840	9321	26930	24066	25179	27841	18044
PA(18:0_18:2)	12510	18118	15752	8001	9832	15692	16737	23082	15444	24305	5140	10556	10492	11629	7482	21613	20341	20066	22779	16113
PA(20:4_16:0)	10664	8621	7568	9602	7627	11955	14786	12658	15287	20720	5448	3596	8550	6033	6840	12779	13610	14090	17606	14046
PA(O-20:2_12:0)	19208	14035	35843	17820	22273	15729	22557	15824	44182	11435	14029	100448	30616	14509	26032	19096	10826	9540	13212	11618
PC(14:0_15:0)	72751	50777	33344	80006	56191	38103	29859	44499	38475	40931	37083	40807	49904	60345	62878	32723	27106	26204	24609	23068
PC(14:0_16:0)	55904	32767	49328	65554	58228	23251	21438	24611	44990	36582	61898	32562	32223	43101	46157	28846	32991	27708	27047	25586
PC(14:0_17:0)	444730	391701	313255	554776	512663	263001	252353	238198	263896	276396	376534	315697	314432	478599	437939	259705	234842	201648	189409	208166
PC(15:0_16:1)	186229	81678	31354	223522	195343	46532	17900	49408	110824	121311	75110	117639	107623	186890	160022	109700	30777	41747	79175	71468
PC(16:0_16:1)	33611	38609	40365	37876	39069	12740	18374	17695	19595	22894	39737	23340	24256	57466	31113	20900	18405	13504	20035	21234
PC(16:0_17:0)	790716	440799	586300	563021	686319	580513	570970	541599	524382	735156	667527	556857	512996	590461	591290	429048	461229	554110	499129	771316
PC(16:0_18:1)	156559	170278	167849	141970	188246	107785	119395	117936	62091	83786	179671	134381	155609	205523	121219	88443	110860	141636	124151	132184
PC(16:0_18:2)	39994	61233	43961	39840	46762	82580	72999	68979	73309	62516	40922	34733	39976	42002	34074	67141	65763	53738	55780	57146
PC(16:0_19:0)	131567	99782	191234	119119	164604	323640	279547	347145	334722	386366	159653	168819	158929	141836	137328	229866	235643	293916	252581	371971
PC(16:0_20:3)	19700	15946	12439	19640	8733	12708	20750	13020	17503	16004	8379	17326	17946	8942	11248	20178	12941	9109	17257	11800
PC(17:0_18:1)	3391861	3957828	3951058	3745121	3690516	1937026	2568906	1868581	2648874	2465142	4135753	3113835	2964894	3676311	3418282	3534787	3525616	3147357	3115541	2723258
PC(17:0_18:2)	2151876	2176157	2594771	2163740	2120443	3738272	3544198	4083712	3861320	3672997	2014517	2377791	2356317	2224856	2144778	3146300	3504833	2743749	3286152	2805508
PC(17:0_20:4)	1064911	597222	878213	769972	829666	1045831	945189	828855	885481	1001716	909201	993598	931455	880236	945355	660389	548089	796109	735084	967280
PC(17:1_16:1)	3747994	4282112	4262597	3624369	3696267	1937480	2460968	1713275	1808951	1604843	4144136	3611438	2430179	3624648	3293347	2370594	2111974	2089150	2146457	1913004
PC(17:1_18:2)	552265	641211	564020	646801	530034	489685	664887	473263	965551	862091	608906	537927	460561	543904	515302	726598	666824	550376	894730	486219
PC(17:1_20:4)	641886	404291	301369	497263	582845	708426	1137689	484500	1060337	825588	880409	520185	519086	457017	580935	823604	875648	551032	643226	670887
PC(17:2_18:2)	760497	848803	676261	811458	778727	1318605	1781077	1192034	1234385	1196343	778212	749083	563505	633678	539559	1186523	1122564	990356	933113	848613
PC(18:0_18:0)	9237	941	5291	1602	14336	20714	24888	11459	1151	11194	20479	2021	13635	1711	10997	2000	11801	3429	6905	11558
PC(18:0_18:2)	76622	58594	73286	39148	63976	54920	56871	68990	38595	41018	49986	81193	69660	42636	69498	40220	47797	40423	55012	54364
PC(18:0_23:6)	130882	98006	125279	94778	106872	156114	161542	239880	119038	151402	110962	227938	185397	106543	123002	119565	107634	117715	150221	155098
PC(18:1_19:1)	1005799	957953	1292183	1061348	1084419	1123727	1105022	1395860	991365	1080356	1019050	1298556	1164911	1052666	1111438	987219	1120607	940757	1126660	1130238
PC(18:1_21:4)	371463	281688	406877	340908	321667	360174	369215	407036	338469	325519	406291	480932	345461	343782	425166	298904	340415	290362	305521	300642
PC(18:1_23:6)	222717	239658	240176	220555	167594	79163	85941	87991	83909	99156	201081	362496	295357	235091	224731	140437	130412	137564	137343	154873
PC(19:0_18:1)	1041820	1120594	1255096	1195931	1006703	806512	876898	899167	897536	803904	1136573	1549090	1307231	1279535	1221481	1204790	1177066	1056631	1029977	918024
PC(19:0_20:3)	201286	147464	197428	220181	170146	261734	288520	289262	304867	275003	176993	235356	203325	198598	193978	241830	227928	242381	235452	235498
PC(19:0_20:4)	364836	265219	403319	306334	105929	366479	431779	342956	277847	379303	418608	403696	350355	288794	354613	278229	76912	313426	401078	513997
PC(19:0_22:3)	37418	25936	32341	43512	30792	31692	34585	40297	44189	38455	32886	33524	33085	34891	42269	36159	34294	33532	35302	33240
PC(19:0_22:4)	59998	29982	38699	52379	55736	58399	56454	46266	53790	52635	53529	58889	49953	51565	60354	39314	37587	41231	46742	62196
PC(19:0_22:5)	47664	27112	42530	43848	199	64522	49197	85741	47664	55301	45719	59471	50282	43496	49220	39210	33162	50275	48996	65840
PC(19:1_18:2)	845934	845216	981092	925481	877966	1058900	1064941	965793	1177010	1010561	917583	1000546	908076	842652	958540	991835	1025074	978771	850367	839692
PC(21:0_16:0)	27730	20476	35451	40083	34263	58555	83309	109160	129028	112732	36382	44684	47037	47481	38343	86102	90099	110062	73244	83037
PC(21:0_18:1)	124615	124779	135320	141997	116795	128364	130169	149066	236843	194960	112753	203639	149311	182176	152576	189370	159888	176223	162266	136664
PC(21:0_18:2)	246298	178714	193132	190343	183711	132481	141593	153797	145831	135363	274365	222540	200448	215519	275221	126440	134317	111591	128432	121525
PC(21:5_18:1)	683578	399420	955669	654502	465888	896623	988780	1164425	815484	1211190	595542	929527	893751	640206	768359	856104	1101452	1054260	925747	779688
PC(23:0_16:0)	10703	8858	7396	13968	11940	17512	17302	23084	24321	22854	2979	0	13380	14654	16693	15157	19240	23464	16247	11748
PC(23:0_18:1)	72835	68767	68316	112435	95209	55078	57230	61874	73564	61406	99182	118973	68016	100293	101092	73488	63680	77653	66549	72521
PC(23:0_18:2)	63650	57025	52281	88465	62098	44675	47332	72562	50855	60911	74066	81456	57513	77215	70935	57328	46259	52022	60792	49966
PC(25:0_16:0)	18555	15136	15202	22387	24024	20966	19600	31886	26690	29026	13921	34472	30846	20353	29963	22248	22726	27173	29772	26573
PC(25:0_18:1)	100855	68758	78511	108254	94762	60337	59393	60625	48212	50858	97416	125877	80615	106591	106928	73800	52228	61664	90119	72395
PC(25:0_18:2)	56968	31765	34094	67567	62368	41449	40373	62677	36739	48826	54770	80175	65758	57407	66115	38093	36533	42504	49144	50656
PC(3:0_18:2)	2569	1836	771	1963	2196	4308	4416	5199	13152	6676	560	1793	2167	2098	1699	5696	10288	6658	5972	4322
PC(O-17:0)	79380	204711	175320	111199	113868	207515	222133	217934	146582	204480	133644	298433	167433	206862	156586	200491	129971	160075	238496	283900
PC(O-17:0_18:1)	116880	84766	142708	101569	120238	25908	17836	21818	34234	31855	131742	163878	97021	120241	128051	30710	35921	37089	58494	63276
PC(O-17:0_20:4)	43280	15839	46435	19438	53110	89410	45654	69550	64114	44578	35609	37043	41657	29490	30893	45818	37096	42678	68967	78442
PC(O-17:1_18:1)	32361	44846	118623	19279	23440	19469	22502	48817	28943	21067	24659	81962	23636	66623	36169	50170	30069	25268	46998	21203
PC(O-17:1_18:2)	10021	10552	28973	6204	9577	36087	30408	43708	37058	29724	9475	23550	13530	17623	10716	42084	21142	26535	46098	28242
PC(O-17:1_20:4)	33283	28406	57333	31655	33209	60660	45151	80660	100213	92855	38402	35352	27578	42063	44065	82399	43794	51884	71217	61155
PC(O-18:0_18:1)	340793	588950	287511	379818	276423	689577	749686	540432	605154	571784	352261	193720	173351	358731	318881	546531	685529	489252	505454	381883
PC(O-18:1_22:6)	38622	20103	13042	28306	34255	58003	56802	75284	51014	42854	34161	32693	44578	21837	33069	37302	43467	52231	40552	60556
PC(O-19:0_18:1)	19236	23606	32122	25236	20649	19260	11453	15365	14571	10851	17810	37157	22935	25208	16944	20949	17680	16113	21827	13027
PC(O-19:2_18:1)	26985	24530	52902	19595	29399	22525	18522	29569	32404	23398	26338	50973	21669	46081	29085	34774	22486	22455	43155	19829
PC(O-20:0_18:1)	332490	464530	185247	318624	316304	450388	562112	370602	381498	362557	338600	168522	219142	357764	292642	356175	438225	407291	326719	278452
PE(14:0_16:0)	35092	19451	20709	31056	19729	8149	7301	4969	10017	11754	18872	15264	13306	25892	21732	11858	7642	6597	7251	4789
PE(14:0_20:4)	14013	8330	6657	18537	12020	8900	9842	5551	2750	14225	10634	7903	10063	16073	12806	6441	6660	8030	3703	9869
PE(16:0_16:0)	45634	25966	40907	50488	44576	17970	16100	19884	38621	30278	51107	25830	25693	31192	38442	22108	23207	22066	21047	21004
PE(16:0_16:1)	370113	399252	326607	406430	389898	91925	92987	83371	149519	167936	366718	200972	221160	350525	327601	144432	131358	92827	106605	93362
PE(16:0_17:1)	22490	25028	17458	17164	21540	5766	5990	9545	6769	4185	20870	12933	14596	20233	15528	7369	8961	1986	9067	5443
PE(16:0_18:1)	2551354	3230962	2544723	2476810	2647739	873406	1046430	716213	1083012	1033781	2546282	1718886	1797255	3089740	2382062	1756880	1652023	1244968	1279607	1085255
PE(16:0_18:2)	1020884	1282978	763343	1089540	1050396	1505068	1808148	1535891	1647497	1536802	942496	799528	833357	1085584	932323	1800204	3778797	1337303	1392035	1054267
PE(16:0_20:4)	845288	937481	619384	964556	880294	1315898	2352789	1113530	3301373	1502300	779007	595063	656191	862896	860539	1957000	1331052	1309201	1600068	1139305
PE(16:0_20:5)	72563	93578	64257	112117	88171	208544	269824	215238	398766	472369	73656	53606	69091	97916	84591	360563	307966	220869	202527	157868
PE(16:0_22:6)	849982	655972	585878	657202	789797	1161054	1437387	1600951	1718932	1591024	773069	796626	879164	779269	828156	1252596	1362894	1258073	1335567	1083316
PE(16:1_16:1)	43370	44469	30421	50552	41238	18613	18077	25231	25668	24298	35132	27568	26501	34425	38613	25907	26045	18712	15147	14664
PE(16:1_18:2)	56242	59826	30627	118716	94974	124663	131233	126018	205478	323053	75856	66636	78422	60154	110210	169643	136145	119950	104138	92782
PE(17:0_18:1)	55981	64828	35714	52522	54108	12748	13720	15293	14152	14263	49625	51904	42547	50179	53869	20515	24225	17888	15871	17075
PE(17:1_18:1)	23687	23921	14196	22896	18817	21969	19926	25520	22089	16292	23884	23840	24415	20964	23821	15539	22527	13556	13318	16419
PE(18:0_18:1)	2874163	3206896	2639440	2855194	2324727	1081232	1386876	1183105	1512243	1106253	2744532	2434245	2477427	2830850	2779886	2140115	2212236	1717714	2972148	1405850
PE(18:0_18:2)	2321726	2897382	2054276	2543133	2231281	2502309	2428580	2719839	2166252	1783244	2381265	2313686	2626056	2452076	2528090	2426221	2843270	2046862	2228715	1710080
PE(18:0_19:1)	18262	18336	13888	18926	17349	7726	7506	8114	9864	10835	17024	23134	20479	16808	19353	9418	8380	7987	7773	8779
PE(18:0_20:3)	823140	806281	622395	876152	736645	1036995	1105966	996817	1092561	864199	756647	697743	795000	691997	596961	1029357	1038513	835736	763404	779805
PE(18:0_22:3)	113686	89045	61070	118914	91793	54104	48500	55985	75410	56202	87737	73545	84002	83811	95643	56376	62055	51612	48358	40876
PE(18:0_22:4)	298795	154273	75671	252479	282912	305666	357852	281898	244091	253429	268721	310206	262253	205598	326705	193626	246849	202372	188274	251424
PE(18:0_22:5)	333970	236555	122521	246934	285463	431271	470924	550796	361654	306379	279397	240726	300887	238133	302055	270732	367653	260225	263274	233839
PE(18:0_22:6)	1777718	820086	645078	1103996	1531661	2761240	2833455	3943474	2589658	2944227	1449119	2252042	2594097	1128616	1578063	2274557	2337394	2205682	2141817	2421117
PE(18:1_18:2)	943792	1169687	766366	1006215	924491	612476	786900	721834	871513	795345	895489	793049	1050668	887468	948816	1081954	1050702	787978	825180	582600
PE(18:1_20:1)	347579	442578	322962	408246	299999	126894	139706	163251	169258	135782	347673	351200	346837	342939	367748	191922	180669	144538	123717	109463
PE(18:1_20:3)	1417250	806173	616859	1290387	1405516	2749279	2527669	2146074	2285619	2262223	1594216	1183552	1484581	1013332	1359540	1852942	2062112	2097142	1657285	2263307
PE(18:1_20:4)	924434	611940	552024	890090	732039	752981	842721	807711	914928	883598	820084	609461	821378	819723	832215	881980	927840	702539	659231	587079
PE(18:1_22:1)	87153	86979	79149	127147	84832	50761	46844	72648	68801	61360	91176	113082	79290	99526	93522	79477	60921	49152	57057	52542
PE(18:1_24:1)	48391	31503	31136	59930	44127	34079	30108	51418	48723	50935	46340	63611	61932	46498	57757	38796	38542	38524	38252	40457
PE(20:0_18:1)	172772	209108	192665	200575	140622	84605	90418	110831	149478	124198	153296	226147	196916	212659	203483	182425	151125	114483	123365	118628
PE(20:0_3:0)	2707	4287	14605	4210	3058	677	320	436	1038	494	4440	12305	5946	11193	5888	2319	329	378	1980	871
PE(22:0_18:1)	122951	111886	138533	139593	98703	69101	56442	64929	87183	79248	95938	145005	99551	134666	113687	93419	78898	73314	75863	68837
PE(22:0_20:3)	27149	17105	15074	38659	23517	16334	19802	23919	32350	25232	25352	27371	24947	23807	27550	24416	20018	19377	18555	17002
PE(24:0_18:1)	195064	116446	129827	218834	155439	59980	78669	68893	78179	64655	162264	205877	169352	161278	183047	106728	62552	82026	97976	112370
PE(O-14:1_20:4)	25079	11547	11951	20036	19974	31002	32337	20344	29978	33582	15704	18779	15007	19994	27305	20434	15876	18546	15313	20194
PE(O-16:1_16:0)	81853	70264	98853	93956	72399	35936	42457	30761	74395	54127	69477	59719	20750	64762	57986	44219	52914	46380	35858	33842
PE(O-16:1_16:1)	150409	244761	330292	185684	158414	31712	36627	23088	52620	49305	158977	88387	66041	150377	139153	47530	47479	36831	37177	34442
PE(O-16:1_18:1)	2046998	2700311	3091926	2056408	1625344	565079	761706	422520	746410	503661	1830728	1517398	989820	2016101	1462164	1098743	1029002	686899	963543	641799
PE(O-16:1_18:2)	286363	572585	474641	337189	377771	730663	742053	897983	677629	795099	357501	362822	232620	284792	275405	1009951	1294601	574725	889545	508818
PE(O-16:1_18:3)	24131	34756	41410	34439	35019	44119	52044	51403	115837	102481	30130	23277	13785	30902	25374	93808	87127	60537	63173	46587
PE(O-16:1_20:3)	401821	723345	583838	497174	560819	713915	810317	558380	966610	960861	529129	597968	372561	0	386502	957397	1004479	697623	658023	564969
PE(O-16:1_20:4)	67665	51011	3305	141205	51051	149716	192208	121974	263242	67658	58819	1396952	46044	12244	36872	90867	62800	187947	89658	93317
PE(O-16:1_20:5)	151112	174706	160020	128267	150852	393016	479136	433308	804187	603207	118357	90752	78942	108561	96447	459490	464481	382442	415835	336930
PE(O-16:1_22:1)	234323	270617	348895	314965	187724	150221	141350	140297	371220	257220	198921	246818	190879	269047	206221	272379	276546	240430	181606	170307
PE(O-16:1_22:6)	1069677	986532	872716	990648	1301308	1805593	2174123	2283041	1841241	1940468	1243478	863482	1068781	778312	968716	1356343	1768610	1423571	1906837	1504041
PE(O-16:2_20:3)	1631824	1259493	1238227	1568690	1902521	2498296	2535979	2162697	2696065	2118219	1611036	1299081	1168716	1095398	1373813	2132394	1822406	1656527	2155001	2340284
PE(O-18:1_16:0)	149004	123827	178653	214949	142928	91328	97447	95481	189210	131404	147970	437254	103182	169579	141701	133649	140216	115922	94716	82362
PE(O-18:1_18:1)	861277	1610256	1521023	1014941	1016775	576023	638751	443655	708164	560632	1246312	968224	737022	984842	711467	807853	798123	591302	699614	621315
PE(O-18:1_18:2)	875872	1113345	1000219	885817	929464	965654	880656	1070846	795582	622743	1040858	946336	952725	735011	707326	957643	1205512	687007	924167	705497
PE(O-18:1_20:3)	525882	686078	547598	646419	506552	782071	909521	774067	1032456	737132	549850	500966	373894	626803	432627	984079	1034074	776627	620325	479676
PE(O-18:1_20:4)	1494695	967308	1010375	1320457	1498759	2657316	2052473	2072840	2251158	1988632	1445555	1183752	1097294	1146040	1272493	1783229	1630178	1753059	1788825	2236884
PE(O-18:1_22:1)	41731	34129	55142	60385	43837	36821	34159	42576	102652	70172	37668	41401	36916	44300	44525	64310	56695	55600	59562	44346
PE(O-18:1_22:4)	406498	216079	232784	429478	389274	457255	448857	356233	314054	321682	376500	308468	287967	311967	330092	253044	305209	293953	257566	356010
PE(O-18:1_22:5)	503706	341925	338702	417295	383723	676705	721861	776342	508204	422138	426282	511992	466676	409982	495487	425847	485708	391426	452903	485206
PE(O-18:2_20:1)	195239	191611	218012	245438	197767	64089	55627	63433	75544	58233	193033	222806	180093	216019	168056	82050	87469	75134	63735	60051
PE(O-18:2_22:1)	63996	47116	66084	102047	69682	10116	7962	7966	17006	10959	66042	69127	50447	87791	57731	15295	12952	13553	13812	21616
PE(O-18:2_22:5)	818371	636479	633364	686196	612216	1342802	1256035	1239637	963346	824273	591035	725155	926975	758556	806318	801906	864338	862298	1238481	1198337
PE(O-18:2_22:6)	559479	484273	316508	509451	527585	123905	95409	159079	118227	151762	571016	607387	734548	568350	559717	124115	152830	132474	166134	270607
PE(O-18:3_22:6)	27364	12824	4390	23112	34350	26756	25415	42377	19965	25475	30380	47670	315	30648	44792	16764	19575	16808	23890	36009
PE(O-20:1_22:6)	38997	20829	13072	27886	32555	58009	53376	64456	50998	45357	34159	32701	44739	21848	33064	37293	40583	53027	40683	51451
PG(14:0_16:0)	60091	48777	30126	80251	65436	57780	68287	43690	101827	79929	39570	17793	29293	51362	48830	70621	80502	51781	48817	39297
PG(16:0_16:1)	240658	263215	148916	296817	246412	71098	72247	51797	133884	123254	195263	81666	91822	245438	203897	123047	117827	85854	74469	57505
PG(16:0_17:1)	13191	11480	6147	15715	12525	4042	2729	3504	4756	2875	11471	5480	5076	10794	11482	2532	6339	3010	3341	2176
PG(16:0_20:5)	36362	30707	26544	34765	23323	38558	44050	21121	135103	100368	18496	15076	11263	34438	23631	103304	74771	43813	44820	29347
PG(16:1_16:1)	23014	18981	31119	28504	19487	7861	7667	6984	14637	10177	17195	15121	9843	25565	17669	10580	9866	5301	6550	4415
PG(16:1_18:2)	37000	39642	78654	47172	28345	16711	16268	15627	26173	25443	27531	45708	22829	49015	33129	27587	26440	15459	14455	11004
PG(18:0_20:1)	58354	61798	29206	54308	50189	40167	52892	31028	90621	68272	42716	35274	34550	71295	62396	94693	72585	48284	46552	38917
PG(18:0_20:3)	103551	254697	204073	241195	249569	265058	367325	184390	429748	334091	191500	201913	126954	230953	187532	409043	376955	248481	250455	210226
PG(18:0_20:4)	67086	46891	150	50431	55451	52905	72678	28226	99196	78353	40699	31582	21433	41401	40438	120394	59343	69632	65327	61703
PG(18:0_22:6)	72522	61832	27422	71965	69882	163425	166249	162729	201494	163750	72145	88894	69256	81664	79034	162180	157299	138273	124517	100328
PG(18:1_20:3)	746515	490673	220234	640979	516397	624476	698829	262931	983512	842088	447453	319483	257401	475077	553005	891722	712279	576276	472180	550826
PG(18:1_20:4)	168568	150306	92967	171284	119019	127815	187912	89883	270615	212126	125045	88984	53690	150147	120846	217635	211559	129770	126718	101262
PG(18:2_20:5)	12764	8958	7381	9515	12345	12825	13917	13311	36844	20158	7106	5523	7285	5566	9057	11312	9041	9485	11665	8014
PG(20:3_20:4)	178625	118093	80508	135622	175727	134439	129485	140355	167399	60067	134482	145859	116484	104135	152216	163714	142483	123451	134590	109271
PG(20:3_22:6)	50806	25043	22488	43780	52819	76875	67352	72764	92026	67172	33596	41131	26210	24604	45110	65611	53618	39900	43138	38775
PG(20:4_20:5)	5642	1918	1527	3184	4779	8828	8383	8164	18490	11765	3113	2413	2332	2031	4446	8841	8896	5222	6048	4625
PG(20:5_22:6)	5567	2592	1889	3703	5922	13198	11806	14972	21245	17401	2951	5458	3188	1994	4321	12592	12136	9448	11287	8977
PG(22:0_18:1)	57988	38092	12032	74587	33843	9266	14374	10257	38757	29337	37778	26339	24507	75879	59866	44541	32498	20494	18515	14942
PG(22:0_18:2)	20576	17426	12378	29200	19803	9747	8556	6991	28775	15375	25785	14012	12541	27040	27973	33996	15978	6676	15416	7302
PG(22:4_22:6)	18383	6071	2381	11014	20632	29421	19554	21223	15456	19492	13806	15069	14451	5488	18874	12154	12347	11933	14276	20116
PG(24:0_18:1)	37579	22681	14653	49499	32642	5757	5682	8487	16901	9231	22666	28087	26172	49723	39069	24363	14790	13332	9236	7960
PG(24:0_18:2)	19746	12400	7411	27004	12152	7210	9447	10880	18019	12799	16612	18473	18490	27278	23283	23075	11172	9769	10278	6755
PI(14:0_16:0)	4576	8124	4697	3787	2752	19961	23321	32503	22117	20861	1652	2005	3067	2349	2615	18649	25335	16135	14317	12381
PI(16:0_16:0)	65211	90339	75634	47219	41298	280788	313434	473278	322833	295269	43000	40659	49424	50261	46114	244795	424482	271735	242146	218520
PI(16:0_16:1)	82449	87229	90248	71642	66175	74266	90116	109353	90285	104736	70713	50837	53746	68234	57895	86821	92644	97291	79631	71790
PI(16:0_18:0)	256081	304848	155893	195011	229173	1187949	1374064	1924130	1485884	1318292	222814	210062	311566	154026	271840	1176705	1458907	1107358	1038423	934631
PI(16:0_18:2)	129249	165376	157468	138196	120689	152746	175973	235134	190782	126717	131181	113169	125400	105640	99814	150407	173331	114488	124983	100385
PI(16:0_20:5)	51136	52811	100213	49771	34289	49942	59586	63903	113880	78201	39059	23736	25314	39884	29016	87505	77967	46027	47025	36227
PI(17:0_20:4)	15678	9170	10494	14418	15847	14706	14643	16811	10909	9048	13228	13066	11685	9478	13671	10314	9568	7585	8927	9337
PI(18:0_20:2)	113695	286865	141712	155743	130948	145529	157691	224550	68050	76177	151268	164811	123659	180772	93603	117086	179549	104523	140888	94868
PI(18:0_20:3)	405050	513286	473904	547479	501701	729302	720208	889893	555264	501175	503587	415917	323727	256446	317727	521559	730786	542843	532040	389523
PI(18:0_20:4)	2918333	1945786	1541768	2501128	2812894	3824856	4117185	3747925	2829423	2766840	2935297	1906067	2192152	1473699	2553349	2493039	2741372	2747747	2647614	2917323
PI(18:0_20:5)	704052	743429	508896	891953	639674	372938	425551	451523	480678	362999	810596	547785	531727	559049	555666	484094	528574	363170	351971	305419
PI(18:0_22:3)	30197	36882	22315	33579	28716	16722	18515	19938	13179	6223	29993	22969	19034	19528	21673	17734	23072	14468	17698	8871
PI(18:0_22:4)	152942	163398	113155	133849	170474	207999	214712	199745	116636	129845	170856	118510	138128	99308	139804	147793	173755	119251	140659	152054
PI(18:0_22:5)	124820	101931	69794	104801	106645	137616	117494	184381	78418	89787	111147	91013	81213	74655	99170	68353	89518	80263	77676	89827
PI(18:0_22:6)	96544	38326	54458	33892	78399	185656	178117	416093	133732	109395	67826	94559	108800	50530	92532	76403	127859	118280	120548	114614
PI(18:1_18:1)	44878	55548	41923	33575	30198	51584	54538	52427	38213	25655	38411	78680	645	26996	32436	44694	52768	30289	38934	25810
PI(18:1_18:2)	216066	312436	212036	208781	190377	168596	178601	230846	172873	127380	214033	284146	303473	184178	209822	199405	233346	147271	157099	121750
PI(18:1_22:6)	30607	26556	22697	26882	22619	23602	24478	19487	22291	19103	28873	41219	31665	25111	29401	23079	21739	17838	18484	16033
PI(18:2_20:4)	91706	91431	44017	84246	76414	45382	46479	44191	53471	30215	55433	50243	41106	61445	67007	96297	48038	31872	33268	26013
PI(20:4_20:4)	10869	7631	12053	11967	9539	12488	12408	15372	10979	8621	10632	18028	12444	10741	12377	9739	7887	5911	7649	7370
PI(O-18:0_20:4)	25913	28664	40404	24755	32506	36057	27791	23987	25258	18574	25163	48480	23260	22493	22549	32424	19014	19402	36319	24029
PI(O-18:0_22:6)	7912	15848	9039	8960	9922	22425	23275	24566	16950	13901	6053	16229	14934	6477	9890	16999	19011	17064	16653	13634
PI(O-18:1_20:4)	25959	20731	22984	31948	37575	15813	13630	11461	15645	12230	28697	39105	25102	17131	26271	14461	12576	12905	18596	16140
PS(16:0_16:1)	42090	40971	45952	39330	37836	19839	22306	11611	35093	39799	33324	19365	10682	37804	25180	20994	21406	24107	19339	15281
PS(16:0_18:3)	4616	3144	4638	3861	3541	10522	10662	7464	17435	22272	2774	1906	1483	3172	2983	13629	12923	11478	9314	7398
PS(16:0_20:3)	91728	82757	102805	91061	83598	133547	164603	96197	188387	178859	81368	75606	57505	78699	69038	144478	151695	127159	126434	88442
PS(16:0_20:4)	63350	37211	72513	42722	52584	62794	68350	47419	57131	68758	51435	44717	26650	59375	40209	47551	48358	59644	52645	57360
PS(16:0_20:5)	2445	2849	5901	2217	1528	7895	5253	5027	7997	8269	1839	2058	1378	2436	2126	5480	5836	4790	4926	3583
PS(16:0_22:5)	79201	49973	105744	54116	62936	88046	85032	84891	91529	86864	67999	48820	39730	67839	50055	71823	89794	71177	72103	72742
PS(18:0_19:1)	225481	321786	484006	248577	262184	203208	148995	143459	161023	150792	243522	389694	235274	294257	257755	216151	164666	128562	183653	155194
PS(18:0_20:2)	229989	292164	314667	269588	232920	4740	91565	2186	98820	60371	293978	289785	240189	223863	189570	123155	108510	80702	424356	78605
PS(18:0_20:4)	525315	223963	212694	275701	565462	562457	496415	454773	290518	495453	520274	359230	374891	253792	467969	268728	292293	385452	389531	665651
PS(18:0_21:3)	73430	26635	94512	68060	63149	64440	76652	67632	33212	65999	62660	106223	50833	70046	67794	70620	58831	43142	46326	59352
PS(18:0_21:4)	28669	22318	23368	35584	42465	33083	25157	27807	17487	45014	34727	47131	24340	25621	40510	35698	20675	23222	30934	35441
PS(18:0_23:4)	28343	13497	21206	21865	23086	23161	19686	14643	16094	20940	18675	35546	23170	22745	29125	19123	5674	3233	18541	21096
PS(18:0_23:6)	19041	12534	21025	12252	17040	21276	14202	36258	25200	21761	13418	50064	25909	25823	23647	24132	18396	14399	20970	21408
PS(18:1_20:3)	525315	223963	212694	275701	565462	562457	496415	454773	290518	495453	520274	359230	374891	253792	467969	268728	292293	385452	389531	665651
PS(18:1_22:1)	823196	844915	844805	782079	698312	1066064	1064816	966129	1183353	1011154	766040	1021865	977571	807177	859690	991146	1024113	952837	850456	838896
PS(20:0_18:1)	2284323	2271012	2590165	2205262	2183547	3653820	3547792	4097942	3943754	3606155	2155414	2392998	2342381	2273580	2099855	3148213	3584326	2837085	3336579	2812689
PS(20:4_20:4)	11943	9859	110468	4754	12559	6312	11800	14594	7704	9517	7025	4199	10220	15231	8262	5802	9838	4734	14234	21100
PS(22:0_18:1)	1031074	1050799	1323037	1102181	1085602	1144044	1160316	1375379	1069193	1002682	1039033	1308762	1263075	1083897	1154565	1082715	1148678	958937	1180176	1152863
PS(22:0_20:3)	456209	264555	403191	303950	382135	446627	390721	387117	331398	432585	417926	512936	404114	351842	343953	276145	262669	307021	418975	482297
PS(O-16:1_18:1)	6736	17542	46160	8664	5761	2855	2890	1836	2409	1099	10738	16609	2450	11119	7518	2854	2026	2290	4419	2173
SM(d18:1_23:0)	151869	115829	138027	90128	107394	346321	246255	415464	224584	321524	114161	178014	96500	74071	147493	139456	152997	183337	294394	235594
SM(d35:2)	29694	9152	20335	16207	30520	23639	15817	33789	16347	26769	29625	25972	25328	12991	22280	9751	15682	20654	30313	33571
SM(d37:1)	53302	29297	45899	27105	30331	90088	50109	104949	28289	52185	43545	46527	67456	12208	36349	23778	37400	38269	50899	59774
SM(d39:1)	28555	14302	35021	22172	21609	25368	24480	34567	16333	25783	24447	26956	26819	19573	28598	10983	20369	15518	24259	27203
SM(d43:2)	475484	197408	423476	335787	568050	277606	176342	235000	75752	202895	472956	576395	532089	217329	482752	93183	156831	172764	286050	445791
SM(d43:3)	76446	11693	50553	36028	84771	56850	31530	44235	14328	42931	60568	74725	64964	18973	55745	7449	16676	31140	56650	95341
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	Lipid Class	m/z	rt
Cer(d19:0_16:0)	Cer	598.5415975	3.458015037
CL(16:0_16:0_18:1_18:1)	CL	1403.996255	3.745531531
CL(16:0_16:1_18:1_18:1)	CL	1401.980605	3.717704596
CL(16:0_16:1_18:1_18:2)	CL	1399.964955	3.68875314
CL(16:0_18:0_18:1_18:2)	CL	1430.011905	3.747099428
CL(16:0_18:0_18:2_18:2)	CL	1427.996255	3.72059912
CL(16:0_18:2_18:2_18:2)	CL	1423.964955	3.653717989
CL(16:1_16:1_18:1_18:2)	CL	1397.949305	3.651641128
CL(16:1_18:1_18:1_18:2)	CL	1425.980605	3.685259609
CL(16:1_18:2_18:2_18:2)	CL	1421.949305	3.633992094
CL(18:0_18:1_18:2_18:2)-2H	CL	726.502314	3.735976991
CL(18:0_18:2_18:2_20:2)	CL	1480.027555	3.727838678
CL(18:1_18:1_18:2_18:2)	CL	1451.996255	3.704227521
CL(18:1_18:1_18:2_18:2)-2H	CL	725.494489	3.704227521
CL(18:1_18:1_18:2_20:3)	CL	1478.011905	3.701192139
CL(18:1_18:1_18:2_20:4)	CL	1475.996255	3.675421898
CL(18:1_18:2_18:2_18:2)-2H	CL	724.486664	3.669438546
CL(18:1_18:2_18:2_20:4)	CL	1473.980605	3.650145024
CL(18:2_18:2_18:2_18:2)	CL	1447.964955	3.636498774
CL(18:2_18:2_18:2_20:4)	CL	1471.964955	3.640873902
CL(18:2_18:2_20:4_20:4)	CL	1495.964955	3.627913474
CL(20:3_18:2_18:2_20:4)	CL	1497.980605	3.647064357
CL(38:7_18:2_18:2)	CL	1469.949305	3.6170597
FA(13:0)	FA	213.1860035	2.221261319
FA(14:0)	FA	227.2016535	2.385029208
FA(14:1)	FA	225.1860035	2.181435975
FA(15:0)	FA	241.2173035	2.520279761
FA(17:0)	FA	269.2486035	2.764938183
FA(17:1)	FA	267.2329535	2.592974106
FA(19:0)	FA	297.2799035	2.969886844
FA(19:1)	FA	295.2642535	2.810592755
FA(19:2)	FA	293.2486035	2.664142711
FA(20:0)	FA	311.2955535	2.742236964
FA(20:1)	FA	309.2799035	2.908329006
FA(20:2)	FA	307.2642535	2.766032525
FA(20:3)	FA	305.2486035	2.63551995
FA(20:4)	FA	303.2329535	2.512213203
FA(20:5)	FA	301.2173035	2.365957879
FA(21:0)	FA	325.3112035	3.14714367
FA(21:5)	FA	315.2329535	2.478331204
FA(22:0)	FA	339.3268535	3.222128276
FA(22:1)	FA	337.3112035	3.082514337
FA(22:2)	FA	335.2955535	2.960686534
FA(22:3)	FA	333.2799035	2.847158347
FA(22:4)	FA	331.2642535	2.713531443
FA(22:5)	FA	329.2486035	2.581494873
FA(22:6)	FA	327.2329535	2.462561676
FA(23:0)	FA	353.3425035	3.292461685
FA(24:0)	FA	367.3581535	3.359244375
FA(24:1)	FA	365.3425035	3.233822282
FA(24:2)	FA	363.3268535	3.121363803
FA(24:3)	FA	361.3112035	3.016740636
FA(24:4)	FA	359.2955535	2.89707199
FA(24:5)	FA	357.2799035	2.784170914
FA(24:6)	FA	355.2642535	2.674876883
FA(26:0)	FA	395.3894535	3.476439109
FA(26:1)	FA	393.3738035	3.36293208
Hex1Cer(d16:0_24:1)	Hex1Cer	828.6570225	3.572731402
Hex1Cer(d42:1)	Hex1Cer	856.6883225	3.608879422
Hex1Cer(d42:2)	Hex1Cer	854.6726725	3.568967351
LPA(14:0)	LPA	381.2047665	1.988161297
LPA(16:0)	LPA	409.2360665	2.243686854
LPA(18:0)	LPA	437.2673665	2.468304412
LPC(19:1)	LPC	580.3619955	2.365974661
LPC(19:2)	LPC	578.3463455	2.208935421
LPC(19:3)	LPC	576.3306955	2.127610837
LPC(21:0)	LPC	610.4089455	2.784580771
LPC(21:1)	LPC	608.3932955	2.616350599
LPC(21:2)	LPC	606.3776455	2.475615455
LPC(21:4)	LPC	602.3463455	2.196919429
LPC(23:0)	LPC	638.4402455	2.961721097
LPC(23:6)	LPC	626.3463455	2.213786947
LPC(25:0)	LPC	666.4715455	3.115029149
LPC(O-17:0)	LPC	540.3670805	2.457348696
LPC(O-17:1)	LPC	538.3514305	2.459021975
LPC(O-19:0)	LPC	568.3983805	2.678528163
LPC(O-19:1)	LPC	566.3827305	2.50243442
LPE(O-16:1)	LPE	436.2833505	2.49902255
LPE(O-18:1)	LPE	464.3146505	2.720424721
LPE(O-18:2)	LPE	462.2990005	2.544493785
LPE(O-18:3)	LPE	460.2833505	2.39765424
LPE(O-20:1)	LPE	492.3459505	2.908990618
LPE(O-26:7)	LPE	564.3459505	3.138756262
LPG(20:1)	LPG	537.3197965	2.422631402
LPI(16:0)	LPI	571.2888915	2.156799651
LPI(18:0)	LPI	599.3201915	2.382516591
LPI(18:1)	LPI	597.3045415	2.206971864
LPI(18:2)	LPI	595.2888915	2.012154265
LPI(20:0)	LPI	627.3514915	2.577594095
LPI(20:4)	LPI	619.2888915	2.009411026
PA(14:0_16:0)	PA	619.4344315	3.128804649
PA(16:0_16:0)	PA	647.4657315	3.228887782
PA(16:0_18:0)	PA	675.4970315	3.351365542
PA(16:0_18:2)	PA	671.4657315	3.188316243
PA(18:0_18:2)	PA	699.4970315	3.287482502
PA(20:4_16:0)	PA	695.4657315	3.175000971
PA(O-20:2_12:0)	PA	629.4551665	2.517240974
PC(14:0_15:0)	PC	736.5134105	3.144223083
PC(14:0_16:0)	PC	690.5079305	3.264247815
PC(14:0_17:0)	PC	764.5447105	3.265101204
PC(15:0_16:1)	PC	762.5290605	3.175680938
PC(16:0_16:1)	PC	716.5235805	3.292656355
PC(16:0_17:0)	PC	792.5760105	3.366665998
PC(16:0_18:1)	PC	804.5760105	3.339836596
PC(16:0_18:2)	PC	742.5392305	3.303146681
PC(16:0_19:0)	PC	820.6073105	3.460130819
PC(16:0_20:3)	PC	768.5548805	3.354669399
PC(17:0_18:1)	PC	818.5916605	3.378627173
PC(17:0_18:2)	PC	816.5760105	3.313670036
PC(17:0_20:4)	PC	840.5760105	3.311784439
PC(17:1_16:1)	PC	788.5447105	3.209227949
PC(17:1_18:2)	PC	814.5603605	3.2457165
PC(17:1_20:4)	PC	838.5603605	3.239313102
PC(17:2_18:2)	PC	812.5447105	3.255501252
PC(18:0_18:0)	PC	834.6229605	3.546397591
PC(18:0_18:2)	PC	770.5705305	3.371308457
PC(18:0_23:6)	PC	892.6073105	3.376940849
PC(18:1_19:1)	PC	844.6073105	3.414289564
PC(18:1_21:4)	PC	866.5916605	3.327085224
PC(18:1_23:6)	PC	890.5916605	3.296503249
PC(19:0_18:1)	PC	846.6229605	3.470257486
PC(19:0_20:3)	PC	870.6229605	3.437614407
PC(19:0_20:4)	PC	868.6073105	3.381990169
PC(19:0_22:3)	PC	898.6542605	3.522283838
PC(19:0_22:4)	PC	896.6386105	3.470197989
PC(19:0_22:5)	PC	894.6229605	3.418960851
PC(19:1_18:2)	PC	842.5916605	3.347409777
PC(21:0_16:0)	PC	848.6386105	3.541434866
PC(21:0_18:1)	PC	874.6542605	3.546707409
PC(21:0_18:2)	PC	872.6386105	3.496432984
PC(21:5_18:1)	PC	864.5760105	3.286949446
PC(23:0_16:0)	PC	876.6699105	3.601961058
PC(23:0_18:1)	PC	902.6855605	3.61275089
PC(23:0_18:2)	PC	900.6699105	3.570774623
PC(25:0_16:0)	PC	904.7012105	3.673878857
PC(25:0_18:1)	PC	930.7168605	3.683071364
PC(25:0_18:2)	PC	928.7012105	3.624647714
PC(3:0_18:2)	PC	620.3569105	2.285143509
PC(O-17:0)	PC	554.3463455	2.303295965
PC(O-17:0_18:1)	PC	804.6123955	3.447386579
PC(O-17:0_20:4)	PC	826.5967455	3.394746739
PC(O-17:1_18:1)	PC	802.5967455	3.431249939
PC(O-17:1_18:2)	PC	800.5810955	3.362066083
PC(O-17:1_20:4)	PC	824.5810955	3.343325646
PC(O-18:0_18:1)	PC	818.6280455	3.575334501
PC(O-18:1_22:6)	PC	802.5756155	3.519121972
PC(O-19:0_18:1)	PC	832.6436955	3.54139053
PC(O-19:2_18:1)	PC	828.6123955	3.434999155
PC(O-20:0_18:1)	PC	846.6593455	3.632094118
PE(14:0_16:0)	PE	662.4766305	3.292723965
PE(14:0_20:4)	PE	710.4766305	3.235250888
PE(16:0_16:0)	PE	690.5079305	3.395805241
PE(16:0_16:1)	PE	688.4922805	3.319106412
PE(16:0_17:1)	PE	702.5079305	3.365784387
PE(16:0_18:1)	PE	716.5235805	3.412727821
PE(16:0_18:2)	PE	714.5079305	3.341088336
PE(16:0_20:4)	PE	738.5079305	3.332599749
PE(16:0_20:5)	PE	736.4922805	3.278815511
PE(16:0_22:6)	PE	762.5079305	3.315693473
PE(16:1_16:1)	PE	686.4766305	3.241058794
PE(16:1_18:2)	PE	712.4922805	3.270572247
PE(17:0_18:1)	PE	730.5392305	3.454533345
PE(17:1_18:1)	PE	728.5235805	3.391217291
PE(18:0_18:1)	PE	744.5548805	3.494951338
PE(18:0_18:2)	PE	742.5392305	3.427102505
PE(18:0_19:1)	PE	758.5705305	3.52583291
PE(18:0_20:3)	PE	768.5548805	3.468716046
PE(18:0_22:3)	PE	796.5861805	3.544880881
PE(18:0_22:4)	PE	794.5705305	3.494999997
PE(18:0_22:5)	PE	792.5548805	3.445256342
PE(18:0_22:6)	PE	790.5392305	3.40539904
PE(18:1_18:2)	PE	740.5235805	3.365905529
PE(18:1_20:1)	PE	770.5705305	3.50912522
PE(18:1_20:3)	PE	766.5392305	3.436471577
PE(18:1_20:4)	PE	764.5235805	3.358386762
PE(18:1_22:1)	PE	798.6018305	3.576935906
PE(18:1_24:1)	PE	826.6331305	3.63787281
PE(20:0_18:1)	PE	772.5861805	3.565051513
PE(20:0_3:0)	PE	564.3670805	2.502513462
PE(22:0_18:1)	PE	800.6174805	3.63345228
PE(22:0_20:3)	PE	824.6174805	3.602854666
PE(24:0_18:1)	PE	828.6487805	3.689967011
PE(O-14:1_20:4)	PE	694.4817155	3.298734225
PE(O-16:1_16:0)	PE	674.5130155	3.448832798
PE(O-16:1_16:1)	PE	672.4973655	3.377158726
PE(O-16:1_18:1)	PE	700.5286655	3.460324379
PE(O-16:1_18:2)	PE	698.5130155	3.398175671
PE(O-16:1_18:3)	PE	696.4973655	3.347038476
PE(O-16:1_20:3)	PE	724.5286655	3.427847751
PE(O-16:1_20:4)	PE	722.5130155	3.469048859
PE(O-16:1_20:5)	PE	720.4973655	3.33312003
PE(O-16:1_22:1)	PE	756.5912655	3.610612073
PE(O-16:1_22:6)	PE	746.5130155	3.368398181
PE(O-16:2_20:3)	PE	722.5130155	3.395568954
PE(O-18:1_16:0)	PE	702.5443155	3.529560638
PE(O-18:1_18:1)	PE	728.5599655	3.544704231
PE(O-18:1_18:2)	PE	726.5443155	3.490654007
PE(O-18:1_20:3)	PE	752.5599655	3.515238856
PE(O-18:1_20:4)	PE	750.5443155	3.472437187
PE(O-18:1_22:1)	PE	784.6225655	3.668004236
PE(O-18:1_22:4)	PE	778.5756155	3.53322701
PE(O-18:1_22:5)	PE	776.5599655	3.488929477
PE(O-18:2_20:1)	PE	754.5756155	3.549054629
PE(O-18:2_22:1)	PE	782.6069155	3.610748346
PE(O-18:2_22:5)	PE	774.5443155	3.456859416
PE(O-18:2_22:6)	PE	772.5286655	3.388421489
PE(O-18:3_22:6)	PE	770.5130155	3.31449021
PE(O-20:1_22:6)	PE	802.5756155	3.533911739
PG(14:0_16:0)	PG	693.4712115	3.078235877
PG(16:0_16:1)	PG	719.4868615	3.105493808
PG(16:0_17:1)	PG	733.5025115	3.15601333
PG(16:0_20:5)	PG	767.4868615	3.062869242
PG(16:1_16:1)	PG	717.4712115	3.030606243
PG(16:1_18:2)	PG	743.4868615	3.042419345
PG(18:0_20:1)	PG	803.5807615	3.374741464
PG(18:0_20:3)	PG	799.5494615	3.265127203
PG(18:0_20:4)	PG	797.5338115	3.335846649
PG(18:0_22:6)	PG	821.5338115	3.137805341
PG(18:1_20:3)	PG	797.5338115	3.178096694
PG(18:1_20:4)	PG	795.5181615	3.147901553
PG(18:2_20:5)	PG	791.4868615	2.960081577
PG(20:3_20:4)	PG	819.5181615	3.065371014
PG(20:3_22:6)	PG	843.5181615	3.02731718
PG(20:4_20:5)	PG	815.4868615	2.929587368
PG(20:5_22:6)	PG	839.4868615	2.913140033
PG(22:0_18:1)	PG	831.6120615	3.445642518
PG(22:0_18:2)	PG	829.5964115	3.391266929
PG(22:4_22:6)	PG	869.5338115	3.064459182
PG(24:0_18:1)	PG	859.6433615	3.507024894
PG(24:0_18:2)	PG	857.6277115	3.458067654
PI(14:0_16:0)	PI	781.4872565	3.039337889
PI(16:0_16:0)	PI	809.5185565	3.151622607
PI(16:0_16:1)	PI	807.5029065	3.097175172
PI(16:0_18:0)	PI	837.5498565	3.244122677
PI(16:0_18:2)	PI	833.5185565	3.106518335
PI(16:0_20:5)	PI	855.5029065	3.02847034
PI(17:0_20:4)	PI	871.5342065	3.155288876
PI(18:0_20:2)	PI	889.5811565	3.289313351
PI(18:0_20:3)	PI	887.5655065	3.248531865
PI(18:0_20:4)	PI	885.5498565	3.200483099
PI(18:0_20:5)	PI	883.5342065	3.126298376
PI(18:0_22:3)	PI	915.5968065	3.317646454
PI(18:0_22:4)	PI	913.5811565	3.281030665
PI(18:0_22:5)	PI	911.5655065	3.210854601
PI(18:0_22:6)	PI	909.5498565	3.179971753
PI(18:1_18:1)	PI	861.5498565	3.299884405
PI(18:1_18:2)	PI	859.5342065	3.124480367
PI(18:1_22:6)	PI	907.5342065	3.099237551
PI(18:2_20:4)	PI	881.5185565	3.046543115
PI(20:4_20:4)	PI	905.5185565	3.030386687
PI(O-18:0_20:4)	PI	871.5705915	3.254403974
PI(O-18:0_22:6)	PI	895.5705915	3.238144425
PI(O-18:1_20:4)	PI	869.5549415	3.168567725
PS(16:0_16:1)	PS	732.4821105	3.08616024
PS(16:0_18:3)	PS	756.4821105	3.067666026
PS(16:0_20:3)	PS	784.5134105	3.154864908
PS(16:0_20:4)	PS	782.4977605	3.113042366
PS(16:0_20:5)	PS	780.4821105	3.048090661
PS(16:0_22:5)	PS	808.5134105	3.122902479
PS(18:0_19:1)	PS	802.5603605	3.298686929
PS(18:0_20:2)	PS	814.5603605	3.320138116
PS(18:0_20:4)	PS	810.5290605	3.218001133
PS(18:0_21:3)	PS	826.5603605	3.294537464
PS(18:0_21:4)	PS	824.5447105	3.233728364
PS(18:0_23:4)	PS	852.5760105	3.29403284
PS(18:0_23:6)	PS	848.5447105	3.207378993
PS(18:1_20:3)	PS	810.5290605	3.171159991
PS(18:1_22:1)	PS	842.5916605	3.348848197
PS(20:0_18:1)	PS	816.5760105	3.314495935
PS(20:4_20:4)	PS	830.4977605	3.49244638
PS(22:0_18:1)	PS	844.6073105	3.412164518
PS(22:0_20:3)	PS	868.6073105	3.401579728
PS(O-16:1_18:1)	PS	744.5184955	3.233518656
SM(d18:1_23:0)	SM	845.6753295	3.540670572
SM(d35:2)	SM	759.5657795	3.176012459
SM(d37:1)	SM	789.6127295	3.369222316
SM(d39:1)	SM	817.6440295	3.46488529
SM(d43:2)	SM	871.6909795	3.550929381
SM(d43:3)	SM	869.6753295	3.489157166
METABOLITES_END
#END