#METABOLOMICS WORKBENCH araskind_20170619_114731 DATATRACK_ID:1005 STUDY_ID:ST000708 ANALYSIS_ID:AN001101 PROJECT_ID:PR000505
VERSION             	1
CREATED_ON             	July 2, 2017, 11:22 am
#PROJECT
PR:PROJECT_TITLE                 	Subfertility Study
PR:PROJECT_TYPE                  	MS analysis
PR:PROJECT_SUMMARY               	Assess the relative efficacy of a very low energy diet (VLED) using liquid meal
PR:PROJECT_SUMMARY               	replacement vs. standard of care dietary counseling and education (DCE) on the
PR:PROJECT_SUMMARY               	metabolic effects of weight reduction in the obese, subfertile population and
PR:PROJECT_SUMMARY               	assess ovulation and time to conception in these women.
PR:INSTITUTE                     	University of Michigan
PR:DEPARTMENT                    	UMich Internal Medicine
PR:LABORATORY                    	Burant Lab
PR:LAST_NAME                     	Burant
PR:FIRST_NAME                    	Chuck
PR:ADDRESS                       	1500 E. Medical Center Drive Ann Arbor, MI 48109
PR:EMAIL                         	burantc@umich.edu
PR:PHONE                         	734 615-3481
#STUDY
ST:STUDY_TITLE                   	Metabolic effects of weight reduction of very low energy diet vs dietary
ST:STUDY_TITLE                   	counseling
ST:STUDY_TYPE                    	MS analysis
ST:STUDY_SUMMARY                 	The goal of the study is to assess the relative efficacy of a very low energy
ST:STUDY_SUMMARY                 	diet (VLED) using liquid meal replacement vs. standard of care dietary
ST:STUDY_SUMMARY                 	counseling and education (DCE) on the metabolic effects of weight reduction in
ST:STUDY_SUMMARY                 	the obese, subfertile population and assess ovulation and time to conception in
ST:STUDY_SUMMARY                 	these women. Subfertile women were recruited for this study. They completed an
ST:STUDY_SUMMARY                 	OGTT at baseline and again after completing a very low energy diet intervention.
ST:INSTITUTE                     	University of Michigan
ST:DEPARTMENT                    	Biomedical Research Core Facilities
ST:LABORATORY                    	Metabolomics core
ST:LAST_NAME                     	Kachman
ST:FIRST_NAME                    	Maureen
ST:ADDRESS                       	6300 Brehm Tower, 1000 Wall Street, Ann Arbor, MI 48105-5714
ST:EMAIL                         	mkachman@med.umich.edu
ST:PHONE                         	(734) 232-8175
ST:NUM_GROUPS                    	5
ST:TOTAL_SUBJECTS                	12
#SUBJECT
SU:SUBJECT_TYPE                  	Human
SU:SUBJECT_SPECIES               	Homo sapiens
SU:TAXONOMY_ID                   	9606
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	SU0013520	S00020310	GROUP:VLED | VISIT:visit 1	
SUBJECT_SAMPLE_FACTORS           	SU0013520	S00020311	GROUP:VLED | VISIT:visit 2	
SUBJECT_SAMPLE_FACTORS           	SU0013522	S00020312	GROUP:VLED | VISIT:visit 1	
SUBJECT_SAMPLE_FACTORS           	SU0013522	S00020313	GROUP:VLED | VISIT:visit 2	
SUBJECT_SAMPLE_FACTORS           	SU0013524	S00020314	GROUP:Standard | VISIT:visit 1	
SUBJECT_SAMPLE_FACTORS           	SU0013524	S00020315	GROUP:Standard | VISIT:visit 2	
SUBJECT_SAMPLE_FACTORS           	SU0013526	S00020316	GROUP:Standard | VISIT:visit 1	
SUBJECT_SAMPLE_FACTORS           	SU0013526	S00020317	GROUP:Standard | VISIT:visit 2	
SUBJECT_SAMPLE_FACTORS           	SU0013528	S00020318	GROUP:Standard | VISIT:visit 1	
SUBJECT_SAMPLE_FACTORS           	SU0013528	S00020319	GROUP:Standard | VISIT:visit 2	
SUBJECT_SAMPLE_FACTORS           	SU0013530	S00020320	GROUP:VLED | VISIT:visit 1	
SUBJECT_SAMPLE_FACTORS           	SU0013530	S00020321	GROUP:VLED | VISIT:visit 2	
SUBJECT_SAMPLE_FACTORS           	SU0013532	S00020322	GROUP:VLED | VISIT:visit 1	
SUBJECT_SAMPLE_FACTORS           	SU0013532	S00020323	GROUP:VLED | VISIT:visit 2	
SUBJECT_SAMPLE_FACTORS           	SU0013534	S00020324	GROUP:VLED | VISIT:visit 1	
SUBJECT_SAMPLE_FACTORS           	SU0013534	S00020325	GROUP:VLED | VISIT:visit 2	
SUBJECT_SAMPLE_FACTORS           	SU0013536	S00020326	GROUP:Standard | VISIT:visit 1	
SUBJECT_SAMPLE_FACTORS           	SU0013537	S00020327	GROUP:VLED | VISIT:visit 1	
SUBJECT_SAMPLE_FACTORS           	SU0013537	S00020328	GROUP:VLED | VISIT:visit 2	
SUBJECT_SAMPLE_FACTORS           	SU0013539	S00020329	GROUP:Standard | VISIT:visit 1	
SUBJECT_SAMPLE_FACTORS           	SU0013539	S00020330	GROUP:Standard | VISIT:visit 2	
SUBJECT_SAMPLE_FACTORS           	SU9999996	S00020455	GROUP:POOLED | VISIT:POOLED	
#COLLECTION
CO:COLLECTION_SUMMARY             	-
#TREATMENT
TR:TREATMENT_SUMMARY              	-
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY             	-
SP:SAMPLEPREP_PROTOCOL_FILENAME   	A003 - Untargeted Metabolomics.pdf
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
MS:INSTRUMENT_NAME               	ABI Sciex 5600+ TripleTOF
CH:COLUMN_NAME                   	Waters Acquity HSS T3 (50 x 2.1mm, 1.8um)
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:ANALYSIS_PROTOCOL_FILE        	A004 - Shotgun Lipidomics.pdf
#MS
MS:MS_COMMENTS                   	-
MS:INSTRUMENT_NAME               	ABI Sciex 5600+ TripleTOF
MS:INSTRUMENT_TYPE               	Triple TOF
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	NEGATIVE
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS         	peak area normalized
MS_METABOLITE_DATA_START
Samples	S00020310	S00020311	S00020312	S00020313	S00020314	S00020315	S00020316	S00020317	S00020318	S00020319	S00020320	S00020321	S00020322	S00020323	S00020324	S00020325	S00020326	S00020327	S00020328	S00020329	S00020330
Factors	GROUP:VLED | VISIT:visit 1	GROUP:VLED | VISIT:visit 2	GROUP:VLED | VISIT:visit 1	GROUP:VLED | VISIT:visit 2	GROUP:Standard | VISIT:visit 1	GROUP:Standard | VISIT:visit 2	GROUP:Standard | VISIT:visit 1	GROUP:Standard | VISIT:visit 2	GROUP:Standard | VISIT:visit 1	GROUP:Standard | VISIT:visit 2	GROUP:VLED | VISIT:visit 1	GROUP:VLED | VISIT:visit 2	GROUP:VLED | VISIT:visit 1	GROUP:VLED | VISIT:visit 2	GROUP:VLED | VISIT:visit 1	GROUP:VLED | VISIT:visit 2	GROUP:Standard | VISIT:visit 1	GROUP:VLED | VISIT:visit 1	GROUP:VLED | VISIT:visit 2	GROUP:Standard | VISIT:visit 1	GROUP:Standard | VISIT:visit 2
Arachidonic acid	789522.1935	1297635.567	1099587.786	1305652.03	1102268.564	1087046.515	810810.7457	977995.9331	1063742.127	1007049.322	1224953.801	1201317.331	747370.158	1044838.018	864962.3174	1299506.101	878055.1466	1441015.495	2197223.898	847739.5344	753928.4554
CL 66:1; [M-2H](2-)@6.23	10336.83141	4526.90128	17266.62609	8741.939265	12109.38298	4617.275804	1987.633354	3834.505742	2708.876856	4081.890205	17350.65643	3290.8282	3681.089582	2656.055603	9433.190199	6165.517763	22260.13783	7294.34789	1848.72327	6275.121271	6308.288719
CL 74:1; [M-2H](2-)@6.79	37379.09746	35471.57356	50060.24903	34926.62067	109158.68	92282.79841	17029.95487	27245.7757	34477.45243	24758.00303	55475.77391	43324.75903	30663.83064	36123.89713	48706.71469	23650.21293	94748.99203	70586.59789	28416.59849	29969.9635	29045.99559
CL 76:3; [M-2H](2-)@7.08	1727.242697	4654.863228	3540.164209	2080.962495	7187.909961	3066.743464	703.0253013	1663.256467	744.1016508	1236.57551	2109.081005	2069.736723	2726.642898	1005.404941	3261.122782	4537.762633	5410.729834	1574.251748	3658.334288	829.9327145	796.4733993
CL 78:1; [M-2H](2-)@7.90	7368.637008	2672.732872	5259.242068	2744.8309	7905.64112	11786.53551	2117.671428	4260.152215	2349.868269	7429.455316	3273.794506	3148.410486	4975.188373	1478.233955	4114.877918	3034.726155	4731.876679	957.2981927	10088.56254	2335.410453	2960.282267
CL 82:15; [M-2H](2-)@5.89	7964.059518	3923.746642	13465.30326	11237.68085	13972.48602	13327.44889	4315.499386	6537.151872	6513.009259	8666.403132	13987.04786	8171.72651	8087.520544	8311.613036	7914.313772	8922.133447	12210.12521	7999.116779	6823.606911	2411.98879	5930.103966
CerP 34:1; [M-H]-@5.83	5858.993584	6154.639628	8775.735741	8100.691848	6594.409241	3110.552574	5226.515737	3015.244344	4888.858595	7012.375672	7435.426443	3530.880698	6321.523791	3764.075182	5207.966491	7802.291671	2479.116384	8682.17686	4436.140175	7853.281471	8521.892339
FFA(16:0)	38703262.84	42369240.08	42629674.56	37636430.25	44618815.74	39250521.37	38466325.92	41204317.21	39566998.75	36942686.77	44934016.22	39087678.17	35305712.04	37592859.01	39471862.02	45682156.58	46624042.62	43812196.74	47675192.9	40460909.48	35726910.33
FFA(18:0)	37623878.59	40600820.67	36880945.68	42154663.33	38302872.79	39916308.8	38399293.97	38050004.14	39714957.38	40956413.29	34914966.18	37008247.34	37408965.16	36891964.3	40587319.9	46191349.59	42280055.7	39758193.27	42104113.49	35922078.73	39973257.27
FFA(18:1)	32231116.98	46105928.88	37362436.4	35920730.4	29872648.49	26692235.28	26624412.7	26769500.03	33239816.03	28407630.11	46711193.38	35996036.63	19348779.39	34376150.36	30954754.27	38350816.59	36620188.14	35432035.74	45623536.59	31134790.78	22186369.47
FFA(18:2)	17174428.28	24407370.89	18035840.66	15871212.13	22437735.99	15639293.36	13207996.4	14806061.35	18701859.69	13310463.85	26029504.19	18687649.42	11083945.3	19739929.04	16876700.41	18055900.72	19114853.69	25426203.15	28436069.57	15812813.56	10532038.11
FFA(20:0)	1085977.83	1169224.12	997481.9194	1135361.148	1214882.339	1060153.014	1100923.849	1235150.186	1267794.116	1190701.601	1039188.711	1128080.875	1219963.021	1264758.887	1202993.866	1373805.078	1224494.849	1150395.806	1326111.495	1192856.653	1355219.691
FFA(20:1)	434303.7179	654396.5385	436210.5033	455039.9149	395261.6882	390233.1554	375446.9504	351640.426	357219.7248	357188.6684	550215.5322	500109.5546	252730.6692	408744.5304	425068.6239	508280.6728	396804.1097	381075.4332	583010.9822	345863.6842	301776.1286
FFA(20:2)	421580.3587	592199.7177	374516.4691	427682.2481	462091.2893	348430.5593	393561.9738	428907.1599	353451.031	320541.8135	527586.9082	462063.9049	237315.6663	396906.9659	349399.5233	407346.7284	353591.0167	495081.6389	708382.1914	318621.2314	251103.1436
FFA(22:0)	286040.0247	340582.951	317450.7432	409344.9421	346717.3977	304306.6642	296523.8008	326965.6732	313584.1293	275581.7293	327941.8163	311544.2653	379839.3487	308713.3917	363740.3117	424249.5549	355693.1641	329539.2749	302750.3265	402550.9028	384239.6352
FFA(22:1)	40755.01408	80811.12043	62340.33786	57675.70426	63624.9474	53843.37591	64464.34959	46169.7414	63069.69012	36579.49711	77423.82574	63221.86504	66522.52742	49268.21229	53874.98662	52724.06575	44101.81561	44882.38369	73748.86302	78284.22966	78637.77939
FFA(22:2)	20578.86489	19720.06054	16187.69266	23092.99623	27714.07264	28585.49874	18804.90589	18098.24568	19481.43362	15384.99773	21422.0455	23757.26529	13092.94142	23856.22593	25075.63739	19007.99874	22066.74445	29485.49166	15936.39094	21578.42748	16362.41475
FFA(22:3)	21758.626	33109.88083	22616.38717	24254.61501	28182.59363	24372.45252	21177.86078	19446.12738	15541.68901	12733.95005	26049.43545	29745.66009	21081.13935	17240.21961	24472.07957	21301.71317	27088.5392	21747.29679	31303.038	24421.45375	21596.46514
FFA(24:0)	128572.4502	83489.5205	66088.0713	88152.87358	113373.8109	108967.9029	71019.44333	118699.7724	106753.1686	66632.96344	91999.90002	67010.25579	90539.19764	75439.0968	90990.51756	60989.22495	88270.89031	108557.0104	67783.06159	141915.5346	86592.89561
FFA(24:1)	81778.23051	131783.5554	78312.81374	96304.91173	104107.5668	97094.68198	84425.2969	62803.92559	84576.33947	106724.4766	96700.49539	126396.3841	89442.11253	79520.77461	90907.92009	109944.7973	92579.33557	78056.66448	102870.9582	107456.0461	112025.0203
FFA(24:2)	32474.92786	31785.47868	17352.4817	26455.13502	29265.0859	28187.53324	14557.34646	19193.0316	26933.92666	28412.76033	27061.62304	26653.49055	22297.27233	21852.07473	22869.83032	24534.42692	26522.80976	23695.87001	33780.10861	25357.56278	29680.75501
FFA(24:3)	430.4194557	694.3487782	859.7949166	859.3752245	577.4659952	1131.711382	1963.375064	2306.355704	786.3055353	136.2963191	1496.956737	126.5516778	1517.372114	786.1818661	862.7874568	372.9414334	8643.109991	353.3746124	2688.324049	1683.025596	2432.116433
PC 30:0; [M-Ac-H]-@5.96	24755.76501	16357.44455	30765.53385	17101.69766	41913.31036	36391.07073	20144.44498	19735.01635	11674.84928	23626.24778	46777.47442	26212.27726	50805.77328	14945.61703	30389.90511	19485.10536	49478.99207	15078.09678	15271.60527	37686.58989	28192.56884
PC 30:1; [M-Ac-H]-@5.41	7666.494581	6241.734097	12654.45409	5228.570732	13905.87707	10490.22169	4102.902552	9648.959292	9679.023391	8584.388144	18236.82437	2982.829448	10138.36834	8480.545481	11928.95387	10346.02438	27439.69431	8687.584045	5356.442595	11010.79467	23864.40841
PC 32:0; [M-Ac-H]-@6.61	73239.2548	76322.09842	67702.80592	79492.39881	102412.369	91661.2012	59795.02017	75697.15925	69625.64439	81311.95003	85708.80101	106079.4651	84774.9801	99158.561	98535.81106	93472.39111	103810.5359	67359.62848	89039.70002	80763.70287	115603.4393
PC 32:1; [M-Ac-H]-@6.06	187953.0588	118969.3344	116539.8814	112360.1789	207905.5997	193853.7872	85655.34256	133892.187	80750.98097	122769.892	263252.8743	92231.17534	105794.0491	75684.23985	211742.5479	173515.1487	315724.0466	106706.626	64785.56145	166262.9077	181670.6892
PC 32:2; [M-Ac-H]-@5.62	93756.31262	63538.01912	118113.1541	52825.97717	131381.6337	119216.8621	44167.60308	62832.36722	55850.38338	66897.01542	157552.1978	83393.61133	101149.3309	62885.90482	131172.6537	79100.85951	140698.2035	96554.51165	31087.21547	81972.70035	133029.9037
PC 32:3; [M-Ac-H]-@5.15	2462.724215	1784.442426	3856.649133	2855.537902	1943.222345	441.9792501	476.9373061	2446.923846	3075.886265	2796.978198	3049.476025	359.2195071	4524.179741	1.795830481	4744.743957	2067.601726	9794.523831	3214.99916	685.7643966	2508.879992	1735.392265
PC 33:0; [M-Ac-H]-@6.81	7633.007648	3639.680861	11683.98375	6972.915244	2951.523374	4587.826821	5875.078933	1078.123353	9180.904853	10000.77052	13216.82763	9105.441741	6911.353806	4359.4641	9310.181898	6035.254621	10377.53909	8056.98434	6098.785208	5197.486891	11313.19573
PC 33:1; [M-Ac-H]-@6.43	17525.90758	23205.15313	38603.8574	30643.23149	16309.33231	18114.82269	27409.39306	33468.08744	20069.93189	39687.0563	22799.97082	21310.8834	18482.69448	20346.62657	14713.432	37327.78137	29423.04922	16383.82394	16595.91673	25559.37497	39897.25001
PC 33:2; [M-Ac-H]-@5.96	30679.60537	35097.59694	39636.7916	37856.01132	36687.35607	36063.61747	26949.73723	27618.23472	25379.27603	36316.84677	36425.26471	26586.66182	43633.04529	45958.25188	35468.14523	29901.24713	36048.23937	32922.80921	31425.26281	39447.72121	42914.46113
PC 34:2; [M-Ac-H]-@6.21	2389036.567	2165742.939	3293017.812	2743296.613	4280288.944	3466628.16	1332457.41	1559325.078	1586651.017	2045737.622	3812106.051	2635640.252	2338568.828	2378362.031	2521210.362	2349352.151	3124500.001	2498333.241	1713421.045	2488540.88	2675296.15
PC 34:3; [M-Ac-H]-@5.80	145344.4356	124367.5138	173141.925	142844.3817	209083.2857	163917.0668	83063.90125	120054.3679	95218.89084	116011.9771	259493.4708	170169.6054	125993.0953	140275.2185	211792.7387	154473.4349	214245.3745	142422.087	89231.41196	124053.6387	130777.1946
PC 35:1; [M-Ac-H]-@7.03	20857.39869	42340.38354	24332.02558	44943.30235	24347.03521	17668.65358	25383.21955	21222.06159	22228.76348	22896.66871	24059.504	25616.73211	29313.44142	15937.18919	27431.48325	34684.56365	25757.26561	23289.67937	23164.47646	13150.69099	30358.46556
PC 35:2; [M-Ac-H]-@6.56	43840.09312	58848.88406	59082.19055	61564.77354	29833.56417	67349.11746	34637.06602	39093.7177	37110.11064	56759.80486	64347.85949	67850.56682	64554.10678	52762.20059	63319.55808	47379.47676	42479.30855	52414.38732	50451.43898	36996.55164	55506.12159
PC 35:3; [M-Ac-H]-@6.08	29289.80032	17481.88851	15707.96874	16959.15414	22191.56374	30167.84694	17536.8897	16698.04342	22331.2248	11853.84722	20984.15386	11866.93383	21856.29856	23535.08334	20008.81058	31291.02722	14558.3892	21790.04217	17070.90893	13649.12267	15020.47707
PC 35:4; [M-Ac-H]-@5.93	25086.25602	33173.87247	47353.94703	39868.03281	30585.52114	36638.34305	27298.3886	36449.22779	9667.920786	41435.46325	21339.14312	32340.81366	34666.11059	30646.28578	43690.28732	53206.35116	21853.6154	28229.86177	35683.25436	44447.91421	27810.66344
PC 36:1; [M-Ac-H]-@7.30	286274.1652	344492.1081	335801.1124	311824.1362	559566.4689	530390.0531	251313.8152	353043.7754	270397.6901	306663.2241	514714.1884	338467.9199	409265.8908	308263.6769	413526.9753	408762.1015	513190.8385	202559.5701	240485.8528	314754.6366	451058.7783
PC 36:4; [M-Ac-H]-@6.06	944161.7328	833891.738	1437578.466	1410581.973	1034827	1236396.145	826863.3717	760209.0554	671979.554	1080770.054	1498131.592	1033895.452	872634.7131	931491.7195	1254183.306	1311319.524	1243507.321	660205.4091	953426.0796	913305.8982	888411.7904
PC 36:5; [M-Ac-H]-@5.71	96741.80207	86310.01393	117530.9939	109213.9247	193842.5798	157626.0952	79219.48161	89862.51941	88351.79962	79177.85641	167373.4929	107585.8549	146345.9873	136006.9293	255855.6406	231267.8454	153455.457	75849.85373	61177.07973	86903.79006	97792.13116
PC 36:6; [M-Ac-H]-@5.46	8960.210621	10164.90398	14731.03032	11772.60428	14609.20504	16274.75064	1246.253671	10011.02919	11261.18964	11127.68735	19193.66108	12546.06579	10163.83123	15349.04342	19671.06166	19898.14484	23146.00758	10089.2372	4639.459879	12871.43902	6780.943244
PC 37:2; [M-Ac-H]-@7.22	11622.71236	6894.04325	13576.89126	12591.89512	12856.82451	13278.13189	4249.279253	9416.480828	10225.70856	15378.76329	17661.51249	12207.3994	9750.981846	12735.71444	9169.909303	9469.635901	8478.934367	7131.416993	11654.54706	7728.170646	10212.04193
PC 37:3; [M-Ac-H]-@6.71	19115.32921	11504.33422	21301.07623	10363.16949	10327.71014	9626.449323	13340.94195	5761.913789	13395.17432	15715.03968	24935.17328	27080.07068	18812.25555	12314.92323	16066.05175	22077.6055	10286.6823	11411.37209	19885.74238	11967.07674	23703.63581
PC 37:6; [M-Ac-H]-@5.80	26310.94847	24283.8059	29828.71969	22463.96753	36816.60882	30586.80834	16981.2375	13811.68238	19436.97352	24076.37498	25906.85194	32644.45925	22873.97953	24123.07432	12353.50367	30957.70716	17693.11281	19093.60814	21025.22768	18583.2533	14684.24477
PC 38:2; [M-Ac-H]-@7.45	71898.15385	54389.13506	70264.39511	40034.77387	69585.85064	72010.63517	53165.48212	66191.65817	52215.75547	48433.32323	76918.59105	52785.38546	65866.24017	57017.52348	60472.21771	58084.49446	74918.83538	39510.58829	33900.58346	45532.29537	45276.06562
PC 38:3; [M-Ac-H]-@7.08	415747.9894	402770.2881	370395.6465	256811.9308	558565.4897	532142.5957	232901.526	280223.711	243012.2317	249565.9625	561915.0539	321277.3927	390455.5669	414607.3718	352002.44	306135.4751	517079.4291	222486.659	179613.7994	221445.6894	379915.8394
PC 38:5; [M-Ac-H]-@6.38	202264.6035	229279.7596	245208.2222	229449.0417	312652.6564	332826.2137	255951.9032	257003.852	221662.5141	223378.9925	315227.5555	284714.7103	266414.8493	257235.192	290863.3077	345785.1647	292554.8639	239152.2121	258309.7313	188437.1668	206673.0279
PC 40:4; [M-Ac-H]-@7.32	31064.39768	48281.25883	43686.97298	24886.82924	48688.04849	53925.3348	38560.2524	48379.43266	35024.42965	31537.84251	73945.52574	42434.17444	40873.42649	35071.68002	33583.93815	31534.82759	52407.93568	27566.82359	29088.96035	33392.25837	39968.69012
PC 40:5; [M-Ac-H]-@7.01	46691.78636	57196.79845	59998.39005	48919.32516	94070.72168	78325.831	76263.80356	95405.92871	59657.30922	28727.85587	87639.15161	58793.22266	76757.09627	80649.84369	54358.68447	69192.72247	82615.30673	74787.02711	59390.76411	60279.9665	66952.90293
PC 40:6; [M-Ac-H]-@6.72	78908.3038	81388.23603	78722.01247	73291.01723	152659.6763	90790.33641	85042.41031	86000.39388	53025.32496	114649.1439	126624.6886	96012.33088	95243.68804	166468.6803	78530.9568	132002.3128	85871.02778	75766.97975	66730.78456	64291.59897	79980.6961
PC 40:7; [M-Ac-H]-@6.23	17098.09719	16396.07579	26251.29998	20581.2914	20177.21002	24964.16577	13805.74519	28232.30726	17144.97256	24530.08595	24055.4862	24833.23611	21564.29007	32523.30485	17974.27037	24147.88143	25967.41257	21216.47452	16958.0767	11879.93113	15388.89547
PE 30:0; [M-H]-@6.07	238.6995518	2325.29135	2391.188793	172.6141004	3802.546514	5683.508536	257.9900457	478.777965	1691.128774	1546.313393	7082.767977	749.8240105	805.4786588	739.9311661	4492.787444	988.9762946	12870.64615	4873.087732	853.4718	481.8733176	1445.279865
PE 32:1; [M-H]-@6.22	14763.81546	8255.083169	21230.21547	15788.39056	20102.66775	13855.64106	3779.788223	2419.335209	3844.820683	6299.944954	32400.03144	4608.649831	4136.862986	3464.369372	10927.12339	4884.686855	30535.76524	17379.68083	8235.596152	6865.235027	4997.52344
PE 33:2; [M-H]-@6.07	5813.096393	6671.912982	15283.95636	11100.38053	9973.873057	8876.672479	2407.598466	4729.07216	2066.100136	5825.304986	9690.354118	6597.217794	1432.424054	2375.365041	9194.58495	4159.442811	13652.83082	9702.360424	5811.802202	5932.325518	4650.833738
PE 35:1; [M-H]-@7.10	2656.109164	4540.672361	7815.594211	2910.572964	9560.378086	9086.139459	1615.0726	1966.467821	1518.326246	2354.340463	4736.498003	4103.414151	2341.156815	769.1813983	5764.587655	7634.941176	11182.26802	4350.124609	2820.219711	829.5914545	2613.146781
PE 35:2; [M-H]-@6.68	5763.970576	14713.35695	18528.65867	15764.05581	13145.67732	9240.420536	4752.692103	7653.032093	2801.137016	5286.301373	18689.53813	8321.396094	12705.16489	9451.650517	12156.40482	12465.04081	15658.12388	20737.99395	9946.263348	4828.564709	9429.696871
PE 35:4; [M-H]-@6.04	3825.890661	9389.54821	24969.10186	12851.35714	9794.405186	7636.990838	5960.225173	5991.723406	4258.050214	5061.343366	9547.96029	7584.335173	3374.359856	2477.474046	9240.096579	8712.476923	20183.16601	8605.846581	15632.77997	1854.275893	2687.805083
PE 36:0; [M-H]-@7.84	10275.69581	7223.675554	9776.536089	6787.66201	10562.68902	20011.21086	10722.33658	12961.48489	8704.696319	12720.07065	10306.90583	11789.739	6127.860807	14869.58196	24529.61066	11565.9046	14705.94426	9030.633188	9372.520015	11380.59184	9797.058137
PE 36:5; [M-H]-@6.00	29225.88881	34294.79325	81405.33099	40655.0454	135019.4215	88369.3023	13922.10192	22246.74099	10485.25791	19808.65528	61006.48633	27663.64845	19365.08511	20733.96238	67120.03822	54708.85426	135510.3864	47402.16462	23823.35732	15464.20417	15797.21829
PE 37:4; [M-H]-@6.66	13320.14663	31886.99607	25299.49669	35096.3782	10028.33431	35573.38633	11421.48928	26033.79715	16331.13532	18619.18874	32503.36151	15485.71695	10551.4518	11635.88321	16487.50989	12540.34915	22467.75081	26668.14154	19401.62446	13357.9202	13990.04209
PE 37:6; [M-H]-@5.90	2090.439155	3598.9596	7984.214175	4091.069224	1869.674535	4912.646743	3177.49671	3305.185428	469.1278307	3033.417794	4582.032208	1717.437632	461.3649989	1387.618552	2555.201834	1341.774436	3711.904337	1652.784142	3542.994696	578.2990941	491.199376
PE 38:1; [M-H]-@7.92	2851.503351	3152.274536	4539.835165	1850.742094	7323.103983	6665.10189	1158.559198	11050.23662	9380.877842	11543.58558	7690.637171	3437.95292	3469.862361	4105.021193	8243.896452	2337.672335	3054.659833	1348.426651	9352.677675	957.8818516	3059.608749
PE 38:2; [M-H]-@6.88	13385.98136	21063.29157	15553.95853	11893.98081	17158.46516	37748.3729	19713.47555	15496.83906	13236.66476	10508.34359	23922.15124	26577.2816	23269.8311	19695.85991	21060.20102	16321.70139	21089.89283	20164.66322	11076.23791	16866.86643	17599.3187
PE 40:4; [M-H]-@7.42	48425.59161	46651.07831	74957.68449	52644.38842	71230.53875	104822.4999	54390.60929	120416.5411	42387.34591	43153.99991	73672.26936	38997.73239	40134.92069	48594.23905	58656.37818	72131.88759	105505.2608	84345.32353	89863.10183	43936.73805	33838.17137
PE 40:7; [M-H]-@6.39	25964.52938	35083.08052	72679.9774	49456.78151	48777.88759	63956.24681	23192.56877	41424.55258	21625.58886	32252.7041	49631.2538	50408.69248	30811.5232	26277.80933	35303.11589	37462.14922	62336.25978	39419.65235	52787.66631	20240.44534	14194.52001
PE 40:8; [M-H]-@5.95	8634.458303	8039.225286	13788.73042	15183.15981	24459.66591	20615.11095	1975.790759	15071.69343	7016.171295	8164.215839	17151.81495	9405.656752	10583.7208	8815.549284	7601.054903	18183.05077	26780.74642	14490.69123	8280.987642	10511.39767	6727.840654
PE 42:9; [M-H]-@6.04	2264.398002	3929.365908	8388.694977	1479.233321	8453.744013	5749.563604	6652.477618	17305.39345	3967.807294	1502.521494	6074.997777	2028.544737	9629.759474	5042.978629	3559.518006	11386.19424	8855.295427	476.5823084	5646.409429	7121.120458	7379.666932
PG 33:0; [M-H]-@6.05	12058.44035	17987.11028	15083.39839	8618.840169	7743.955218	12842.60371	8375.321378	19913.99189	6794.130707	12666.85484	9700.666032	9879.165687	12680.94343	9823.277433	10749.73639	8741.811442	9142.62375	8709.997156	15128.13885	11875.43026	13366.36653
PG 36:0; [M-H]-@6.87	13250.84888	11527.87634	10912.03225	10741.12904	14019.00636	15486.00965	15272.48678	13284.14028	6998.72769	18522.58963	15640.0649	21844.5472	12708.86263	20083.47785	18114.29612	15452.16691	8712.827515	13308.71707	12006.43213	11286.60542	18702.89147
PG 36:2; [M-H]-@6.07	40219.2157	40294.88863	44247.84356	19062.43902	115260.422	118264.4293	14162.95038	21376.23574	26398.69307	46925.6462	50001.83551	38227.07757	37638.49016	27906.5477	33225.74951	36269.52759	81740.35073	50321.77731	24721.18221	11321.53346	14679.69621
PG 36:3; [M-H]-@5.28	2399.267841	3165.305328	4678.530448	5479.602452	2301.022802	7169.893808	2178.271925	2265.115836	4684.895927	3841.405902	2142.341348	5765.196842	4126.425034	2434.07788	393.9116646	2962.267675	6856.227557	6641.870988	8465.886112	2390.776331	2396.929942
PG 38:4; [M-H]-@6.06	5905.785751	2926.756753	4905.626364	3549.339685	10804.38615	11462.95918	3491.03982	6916.021478	4269.902515	5854.787995	5897.48235	4723.91886	2182.34082	5951.759207	2540.788014	5440.015256	11817.13797	7756.266012	4976.592674	2588.159031	3743.220392
PI 34:1; [M-H]-@5.68	8452.230967	8271.380709	10475.66001	3998.913789	6786.029571	14416.53117	3316.741451	4848.590927	3782.075297	7489.313554	7892.4236	7931.450994	8894.450745	7272.285226	7766.325019	4191.786246	17248.88285	3025.249512	5291.470291	11529.63051	9478.417185
PI 34:2; [M-H]-@5.24	13519.86452	17010.09108	18129.20638	9038.750317	17738.19629	20298.08681	7671.999595	16530.25147	10554.83124	12246.1322	25521.85996	12536.81285	17989.00116	18939.9408	18496.98413	13811.03986	27552.65463	15724.99802	6496.74113	17048.93772	32376.56428
PI 36:1; [M-H]-@6.31	5501.276018	4591.881932	2947.737111	4627.500821	3619.275184	10897.04768	3205.66181	3465.93817	24597.01841	2702.387258	6896.268531	2222.003061	10272.27745	4571.64343	5151.315088	5150.49478	6410.813712	2380.390315	4750.853716	5234.056824	9629.309273
PI 36:2; [M-H]-@5.89	45326.25803	49909.17878	42897.47204	29817.76173	57767.07237	54759.36255	25921.23078	39865.38134	30418.38233	37611.9548	66389.08152	54025.62386	56350.3889	53437.81914	40455.78508	52488.27768	52917.12563	34510.35092	19027.08428	45363.46415	63741.09063
PI 36:3; [M-H]-@5.46	11036.0161	13568.98889	6876.524965	11279.04755	16083.78937	16540.36113	11242.53599	12582.79901	12646.39641	10347.50923	9880.844824	9167.750924	16172.27152	18307.88178	14013.06264	15598.1181	21155.75927	15079.07853	6424.625285	15274.43205	18278.87845
PI 36:4; [M-H]-@5.22	10085.92749	14399.76937	26638.90103	16681.91246	25570.26743	25290.96642	12922.84484	29565.89888	17428.22443	21539.61057	14217.55862	15604.61756	18881.79103	19979.8542	16689.46049	25386.84936	31164.48869	15485.9491	12395.24282	14528.8519	16213.58792
PI 37:4; [M-H]-@5.57	23751.07937	34658.11715	33902.78751	37814.89025	18736.14026	32656.77111	45928.24115	43558.39091	24573.53248	36801.17925	21406.09681	25703.32016	39088.41618	34026.83452	36882.94953	37715.97251	41601.22259	22676.28324	26300.1672	26867.99325	47442.38239
PI 38:3; [M-H]-@6.07	173106.6961	196911.1346	209888.4216	151829.5874	145166.0664	224095.9902	166854.1202	202197.7294	135600.615	132399.0571	106808.6095	102177.9824	196577.3624	181957.9699	171248.4279	239002.6423	206059.6533	108968.2194	80544.02749	101337.2641	162258.1697
PI 38:4; [M-H]-@5.87	175544.9478	182952.6266	184798.081	251364.681	220622.6156	287779.4847	261148.8641	350510.67	179974.5674	273936.5243	161799.2179	192896.4801	252056.6139	202591.2799	219546.7991	292117.1276	193081.6863	152750.5957	207753.9137	154058.7069	236152.6902
PI 38:5; [M-H]-@5.35	11143.80939	16221.32865	15983.50527	7811.099485	10834.81189	12566.51614	10869.11761	18630.75033	13104.47717	16732.74686	23387.89279	9565.106121	16950.58567	15415.52243	15872.77738	22921.12014	24869.78958	15567.83378	16397.0788	13460.57483	14079.87729
PI 40:5; [M-H]-@5.96	15410.0598	16377.48742	15176.03713	6436.703856	8267.284595	16938.40958	7269.063494	18355.15278	10133.76726	11203.09223	10082.54148	8659.174561	4978.756794	13665.35137	9308.245075	11691.58258	10770.9329	6872.879697	14604.11517	11294.58688	9779.195784
PI 40:6; [M-H]-@5.79	5491.252969	4015.021281	2096.022439	6138.705364	2679.116604	5276.54408	4613.231282	5332.04885	2387.074957	4976.59511	6112.913272	3203.016977	8094.87058	9273.416369	2505.30925	4532.535415	5009.803452	408.1900953	4686.870504	1999.043425	5790.202847
PS 36:1; [M-H]-@6.40	10833.78525	16021.93542	22188.28696	13398.26937	24172.67426	40465.31245	15330.41347	44786.74499	23994.79028	14533.61063	16067.32922	16022.6845	19931.16393	20378.5673	8619.091016	40408.99242	32419.7276	12926.23415	18067.63378	19038.01479	25008.62114
PS 38:4; [M-H]-@5.98	14729.19545	21047.66337	19507.59009	7541.956956	14342.79876	22532.57636	21880.63254	99997.37177	24736.48761	13376.82248	5990.112633	10281.86139	17336.60787	22490.04845	5266.926605	35752.7814	23341.89084	14748.72239	25326.70216	20532.37888	23354.01823
lysoPE 18:2; [M-H]-@1.36	38057.65532	58028.29259	48792.21047	110160.7183	137746.5716	89955.10751	13286.00752	27493.5381	48345.08779	42565.54588	129376.78	53699.117	146188.495	77338.1151	112580.235	104596.953	195716.0965	103115.0487	38395.67157	85456.57433	63758.10205
lysoPE 20:3; [M-H]-@1.64	8816.2445	8438.728107	16361.05405	20173.38712	23594.56608	11488.38606	3191.933507	6439.217979	2021.68636	4851.302814	14304.14894	11786.44694	15473.33449	16811.82515	8762.576521	14522.22424	24607.57527	10447.98985	7296.507438	10068.16629	7361.929915
lysoPE 22:6; [M-H]-@1.29	24364.63754	33287.46555	33832.51688	89302.26866	72049.60712	56325.14863	20313.55202	17831.99384	23877.78724	26630.46751	64513.49891	35124.67845	67165.29603	75148.68062	54770.33632	94055.21987	66570.06076	63517.53724	37243.18733	52461.15355	24132.81801
plasmenyl-PE 34:1; [M-H]-@7.17	60400.7907	49224.97357	69967.59393	56076.01811	122156.6576	112582.9998	36617.52759	27022.45615	49120.15212	53531.9348	91237.80598	52971.01853	53302.98268	40361.00429	61456.8184	52315.25323	108797.4765	57478.56117	41302.75733	48969.88902	61767.45722
plasmenyl-PE 34:2; [M-H]-@6.71	130571.3212	132990.9932	209858.5963	114079.7909	246509.2849	55764.74918	79317.10848	87232.37855	123949.4896	66180.43377	250666.7244	133323.0597	136316.1885	115365.6687	148244.1078	97990.87503	195710.8943	113914.0471	44139.04354	161215.5791	224267.7162
plasmenyl-PE 36:1; [M-H]-@7.72	70169.52221	74669.54451	84637.08234	63908.07381	111792.1782	129557.219	45653.82581	49821.6906	60474.05731	51554.28382	106188.951	56813.89248	71051.59322	55429.75498	68122.97988	57442.09078	118738.0574	51295.39617	33649.97435	59083.99058	78013.38959
plasmenyl-PE 36:2; [M-H]-@7.31	241259.0277	193660.7366	295638.9328	198138.0355	325689.9455	310539.0631	189186.9657	109599.5844	225094.457	155325.102	351289.9983	227830.0225	269223.8589	187371.2601	274382.8663	173165.9345	337109.9956	190015.607	91848.33537	253484.371	284562.6064
plasmenyl-PE 36:3; [M-H]-@6.87	209726.5154	172060.4978	216143.5716	163677.9882	273702.7299	244798.4437	198059.7656	183841.1744	249682.7753	136343.8305	289470.2888	185335.6532	152005.0141	172163.7835	217284.8725	170108.9277	289522.9126	141498.0844	113903.4258	263935.3	286135.4482
plasmenyl-PE 36:5; [M-H]-@6.30	25413.91889	26089.64088	25840.79711	8982.477876	40446.97727	37285.63422	44407.76061	30034.36602	24039.41589	17065.49513	37461.23737	16384.10508	31670.06172	36079.80549	50245.89987	51951.37167	37346.28653	10224.49337	7512.230043	35204.92484	53811.97168
plasmenyl-PE 38:1; [M-H]-@8.23	5990.477059	4528.387669	13080.13479	7681.559079	17714.02457	12105.34791	7727.288367	7937.687225	15981.13179	8902.080783	16949.71543	8372.360682	7642.290909	15816.55685	10038.19495	9787.296099	11874.70709	9549.001198	1639.601859	19062.47299	11102.10148
plasmenyl-PE 38:2; [M-H]-@7.87	24969.25392	33658.58018	22596.36736	16338.47282	57655.54796	52260.9117	27989.21749	14781.80439	41673.4541	16405.93397	44513.32637	27945.83196	29003.34398	26798.28803	20952.17127	23261.97355	25639.72546	20417.59931	15770.42306	29936.25936	35740.45404
plasmenyl-PE 38:3; [M-H]-@7.55	143879.768	127662.7951	206558.7625	112347.2672	111290.484	192310.0449	182108.9502	131129.4083	188618.7512	129520.4289	185459.6665	132477.4536	114421.7226	148297.8789	148125.2701	130447.4148	237467.9192	89057.9669	75568.34339	167750.6432	149329.1251
plasmenyl-PE 38:4; [M-H]-@7.21	789975.0135	885304.0979	1096134.936	675853.2145	701236.8956	1024435.225	955530.8852	1189345.128	1030079.536	669793.7062	1143484.283	808992.2186	812074.1423	731794.3994	621294.4334	874639.931	1065387.406	368489.9941	615560.1307	935073.7469	1045252.277
plasmenyl-PE 40:4; [M-H]-@7.75	149570.3184	218361.7341	271583.8628	138767.927	174586.9588	247443.9961	199622.1661	376410.8648	362478.2829	191765.6218	204066.0129	146625.8821	243987.0428	236164.7263	170945.6047	288422.25	274042.7973	119045.8886	134572.5859	280873.0605	230532.3121
plasmenyl-PE 40:5; [M-H]-@7.35	145571.5186	204657.1466	153941.0203	143759.3638	208740.1484	220291.0807	196730.5914	256096.9518	190605.4839	145604.9902	215620.048	144289.7346	146173.7769	181388.1365	172556.813	236363.9256	273052.2846	141834.3996	147425.5683	191732.4033	176412.8873
plasmenyl-PE 40:6; [M-H]-@7.19	116868.7964	111284.1147	137778.5308	98564.78498	121347.3558	250065.6311	116004.0092	95613.26065	115730.5093	95606.35174	156435.5476	194813.5543	126848.3989	170708.7661	79929.38015	106177.0584	122564.5041	60869.28566	60088.01351	120833.5633	133315.9811
plasmenyl-PE 42:4; [M-H]-@8.21	19683.75487	27279.30509	27388.61005	12735.86787	30284.51069	26161.40804	22762.21127	29818.45312	36620.44302	25369.68744	23850.44468	20347.45084	15167.55793	29674.90721	24626.12264	26573.8458	15516.40096	7262.360457	12685.17376	24983.1492	32095.55187
plasmenyl-PE 42:5; [M-H]-@7.86	26406.94741	36995.54815	26212.59779	16804.70161	31598.86854	27319.3159	24015.65648	33669.4466	31667.40346	32550.4204	36337.92799	27213.49858	42486.56037	27338.47544	23561.91518	31758.98351	22549.55937	17033.28625	18200.78318	32661.50251	30802.66732
plasmenyl-PE 42:6; [M-H]-@7.75	15023.57673	19122.89925	15210.77153	7377.605005	35989.28857	31539.94204	23039.68741	17760.15598	25890.59575	25369.20467	27275.03909	26084.24436	17316.91801	38333.4957	13201.26906	13852.76975	12081.30085	12359.19401	6801.694481	18009.01322	32789.14822
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	moverz_quant	ri	ri_type	pubchem_id	inchi_key	kegg_id	other_id	other_id_type
Arachidonic acid				444899
CL 66:1; [M-2H](2-)@6.23		6.23					CL(66:1)	LipidMaps Bulk ID
CL 74:1; [M-2H](2-)@6.79		6.79					CL(74:1)	LipidMaps Bulk ID
CL 76:3; [M-2H](2-)@7.08		7.08					CL(76:3)	LipidMaps Bulk ID
CL 78:1; [M-2H](2-)@7.90		7.9					CL(78:1)	LipidMaps Bulk ID
CL 82:15; [M-2H](2-)@5.89		5.89					CL 82:15	LipidBLAST
CerP 34:1; [M-H]-@5.83		5.83					CerP 34:1	LipidBLAST
FFA(16:0)							FA(16:0)	LipidMaps Bulk ID
FFA(18:0)				5281			LMFA01010018	LipidMaps
FFA(18:1)							FA(18:1)	LipidMaps Bulk ID
FFA(18:2)							FA(18:2)	LipidMaps Bulk ID
FFA(20:0)				10467			LMFA01010020	LipidMaps
FFA(20:1)							FA(20:1)	LipidMaps Bulk ID
FFA(20:2)							FA(20:2)	LipidMaps Bulk ID
FFA(22:0)				8215			LMFA01010022	LipidMaps
FFA(22:1)							FA(22:1)	LipidMaps Bulk ID
FFA(22:2)							FA(22:2)	LipidMaps Bulk ID
FFA(22:3)							FA(22:3)	LipidMaps Bulk ID
FFA(24:0)				11197			LMFA01010024	LipidMaps
FFA(24:1)							FA(24:1)	LipidMaps Bulk ID
FFA(24:2)							FA(24:2)	LipidMaps Bulk ID
FFA(24:3)				52921854			LMFA01030902	LipidMaps
PC 30:0; [M-Ac-H]-@5.96		5.96					PC(30:0)	LipidMaps Bulk ID
PC 30:1; [M-Ac-H]-@5.41		5.41					PC(30:1)	LipidMaps Bulk ID
PC 32:0; [M-Ac-H]-@6.61		6.61					PC(32:0)	LipidMaps Bulk ID
PC 32:1; [M-Ac-H]-@6.06		6.06					PC(32:1)	LipidMaps Bulk ID
PC 32:2; [M-Ac-H]-@5.62		5.62					PC(32:2)	LipidMaps Bulk ID
PC 32:3; [M-Ac-H]-@5.15		5.15					PC(32:3)	LipidMaps Bulk ID
PC 33:0; [M-Ac-H]-@6.81		6.81					PC(33:0)	LipidMaps Bulk ID
PC 33:1; [M-Ac-H]-@6.43		6.43					PC(33:1)	LipidMaps Bulk ID
PC 33:2; [M-Ac-H]-@5.96		5.96					PC(33:2)	LipidMaps Bulk ID
PC 34:2; [M-Ac-H]-@6.21		6.21					PC(34:2)	LipidMaps Bulk ID
PC 34:3; [M-Ac-H]-@5.80		5.8					PC(34:3)	LipidMaps Bulk ID
PC 35:1; [M-Ac-H]-@7.03		7.03					PC(35:1)	LipidMaps Bulk ID
PC 35:2; [M-Ac-H]-@6.56		6.56					PC(35:2)	LipidMaps Bulk ID
PC 35:3; [M-Ac-H]-@6.08		6.08					PC(35:3)	LipidMaps Bulk ID
PC 35:4; [M-Ac-H]-@5.93		5.93					PC(35:4)	LipidMaps Bulk ID
PC 36:1; [M-Ac-H]-@7.30		7.3					PC(36:1)	LipidMaps Bulk ID
PC 36:4; [M-Ac-H]-@6.06		6.06					PC(36:4)	LipidMaps Bulk ID
PC 36:5; [M-Ac-H]-@5.71		5.71					PC(36:5)	LipidMaps Bulk ID
PC 36:6; [M-Ac-H]-@5.46		5.46					PC(36:6)	LipidMaps Bulk ID
PC 37:2; [M-Ac-H]-@7.22		7.22					PC(37:2)	LipidMaps Bulk ID
PC 37:3; [M-Ac-H]-@6.71		6.71					PC(37:3)	LipidMaps Bulk ID
PC 37:6; [M-Ac-H]-@5.80		5.8					PC(37:6)	LipidMaps Bulk ID
PC 38:2; [M-Ac-H]-@7.45		7.45					PC(38:2)	LipidMaps Bulk ID
PC 38:3; [M-Ac-H]-@7.08		7.08					PC(38:3)	LipidMaps Bulk ID
PC 38:5; [M-Ac-H]-@6.38		6.38					PC(38:5)	LipidMaps Bulk ID
PC 40:4; [M-Ac-H]-@7.32		7.32					PC(40:4)	LipidMaps Bulk ID
PC 40:5; [M-Ac-H]-@7.01		7.01					PC(40:5)	LipidMaps Bulk ID
PC 40:6; [M-Ac-H]-@6.72		6.72					PC(40:6)	LipidMaps Bulk ID
PC 40:7; [M-Ac-H]-@6.23		6.23					PC(40:7)	LipidMaps Bulk ID
PE 30:0; [M-H]-@6.07		6.07					PE(30:0)	LipidMaps Bulk ID
PE 32:1; [M-H]-@6.22		6.22					PE(32:1)	LipidMaps Bulk ID
PE 33:2; [M-H]-@6.07		6.07					PE(33:2)	LipidMaps Bulk ID
PE 35:1; [M-H]-@7.10		7.1					PE(35:1)	LipidMaps Bulk ID
PE 35:2; [M-H]-@6.68		6.68					PE(35:2)	LipidMaps Bulk ID
PE 35:4; [M-H]-@6.04		6.04					PE(35:4)	LipidMaps Bulk ID
PE 36:0; [M-H]-@7.84		7.84					PE(36:0)	LipidMaps Bulk ID
PE 36:5; [M-H]-@6.00		6					PE(36:5)	LipidMaps Bulk ID
PE 37:4; [M-H]-@6.66		6.66					PE(37:4)	LipidMaps Bulk ID
PE 37:6; [M-H]-@5.90		5.9					PE(37:6)	LipidMaps Bulk ID
PE 38:1; [M-H]-@7.92		7.92					PE(38:1)	LipidMaps Bulk ID
PE 38:2; [M-H]-@6.88		6.88					PE(38:2)	LipidMaps Bulk ID
PE 40:4; [M-H]-@7.42		7.42					PE(40:4)	LipidMaps Bulk ID
PE 40:7; [M-H]-@6.39		6.39					PE(40:7)	LipidMaps Bulk ID
PE 40:8; [M-H]-@5.95		5.95					PE(40:8)	LipidMaps Bulk ID
PE 42:9; [M-H]-@6.04		6.04					PE(42:9)	LipidMaps Bulk ID
PG 33:0; [M-H]-@6.05		6.05					PG(33:0)	LipidMaps Bulk ID
PG 36:0; [M-H]-@6.87		6.87					PG(36:0)	LipidMaps Bulk ID
PG 36:2; [M-H]-@6.07		6.07					PG(36:2)	LipidMaps Bulk ID
PG 36:3; [M-H]-@5.28		5.28					PG(36:3)	LipidMaps Bulk ID
PG 38:4; [M-H]-@6.06		6.06					PG(38:4)	LipidMaps Bulk ID
PI 34:1; [M-H]-@5.68		5.68					PI(34:1)	LipidMaps Bulk ID
PI 34:2; [M-H]-@5.24		5.24					PI(34:2)	LipidMaps Bulk ID
PI 36:1; [M-H]-@6.31		6.31					PI(36:1)	LipidMaps Bulk ID
PI 36:2; [M-H]-@5.89		5.89					PI(36:2)	LipidMaps Bulk ID
PI 36:3; [M-H]-@5.46		5.46					PI(36:3)	LipidMaps Bulk ID
PI 36:4; [M-H]-@5.22		5.22					PI(36:4)	LipidMaps Bulk ID
PI 37:4; [M-H]-@5.57		5.57					PI(37:4)	LipidMaps Bulk ID
PI 38:3; [M-H]-@6.07		6.07					PI(38:3)	LipidMaps Bulk ID
PI 38:4; [M-H]-@5.87		5.87					PI(38:4)	LipidMaps Bulk ID
PI 38:5; [M-H]-@5.35		5.35					PI(38:5)	LipidMaps Bulk ID
PI 40:5; [M-H]-@5.96		5.96					PI(40:5)	LipidMaps Bulk ID
PI 40:6; [M-H]-@5.79		5.79					PI(40:6)	LipidMaps Bulk ID
PS 36:1; [M-H]-@6.40		6.4					PS(36:1)	LipidMaps Bulk ID
PS 38:4; [M-H]-@5.98		5.98					PS(38:4)	LipidMaps Bulk ID
lysoPE 18:2; [M-H]-@1.36		1.36					LPE(18:2)	LipidMaps Bulk ID
lysoPE 20:3; [M-H]-@1.64		1.64					LPE(20:3)	LipidMaps Bulk ID
lysoPE 22:6; [M-H]-@1.29		1.29					LPE(22:6)	LipidMaps Bulk ID
plasmenyl-PE 34:1; [M-H]-@7.17		7.17					PE(P-34:1)	LipidMaps Bulk ID
plasmenyl-PE 34:2; [M-H]-@6.71		6.71					PE(P-34:2)	LipidMaps Bulk ID
plasmenyl-PE 36:1; [M-H]-@7.72		7.72					PE(P-36:1)	LipidMaps Bulk ID
plasmenyl-PE 36:2; [M-H]-@7.31		7.31					PE(P-36:2)	LipidMaps Bulk ID
plasmenyl-PE 36:3; [M-H]-@6.87		6.87					PE(P-36:3)	LipidMaps Bulk ID
plasmenyl-PE 36:5; [M-H]-@6.30		6.3					PE(P-36:5)	LipidMaps Bulk ID
plasmenyl-PE 38:1; [M-H]-@8.23		8.23					PE(P-38:1)	LipidMaps Bulk ID
plasmenyl-PE 38:2; [M-H]-@7.87		7.87					PE(P-38:2)	LipidMaps Bulk ID
plasmenyl-PE 38:3; [M-H]-@7.55		7.55					PE(P-38:3)	LipidMaps Bulk ID
plasmenyl-PE 38:4; [M-H]-@7.21		7.21					PE(P-38:4)	LipidMaps Bulk ID
plasmenyl-PE 40:4; [M-H]-@7.75		7.75					PE(P-40:4)	LipidMaps Bulk ID
plasmenyl-PE 40:5; [M-H]-@7.35		7.35					PE(P-40:5)	LipidMaps Bulk ID
plasmenyl-PE 40:6; [M-H]-@7.19		7.19					PE(P-40:6)	LipidMaps Bulk ID
plasmenyl-PE 42:4; [M-H]-@8.21		8.21					PE(P-42:4)	LipidMaps Bulk ID
plasmenyl-PE 42:5; [M-H]-@7.86		7.86					plasmenyl-PE 42:5	LipidBLAST
plasmenyl-PE 42:6; [M-H]-@7.75		7.75					PE(P-42:6)	LipidMaps Bulk ID
METABOLITES_END
#END