#METABOLOMICS WORKBENCH araskind_20170714_081557 DATATRACK_ID:1133 STUDY_ID:ST000819 ANALYSIS_ID:AN001300 PROJECT_ID:PR000557
VERSION             	1
CREATED_ON             	August 1, 2017, 3:02 pm
#PROJECT
PR:PROJECT_TITLE                 	Changes in lipid levels with knock out of ACADM (shACADM) Lipidomics
PR:PROJECT_TYPE                  	MS analysis
PR:PROJECT_SUMMARY               	Looking for changes in lipid levels with knock out of ACADM
PR:INSTITUTE                     	University of Michigan
PR:DEPARTMENT                    	Molecular and Integrative Physiology
PR:LABORATORY                    	Lyssiotis Lab
PR:LAST_NAME                     	Lyssiotis
PR:FIRST_NAME                    	Costas
PR:ADDRESS                       	Ann Arbor, MI
PR:EMAIL                         	clyssiot@umich.edu
PR:PHONE                         	734-615-9133
#STUDY
ST:STUDY_TITLE                   	Looking for changes in lipid levels with knock out of ACADM (shACADM)
ST:STUDY_TYPE                    	MS analysis
ST:STUDY_SUMMARY                 	GSC 8-11 cells (20 million) were transduced with lentivirus coding for shACADM
ST:STUDY_SUMMARY                 	4, 6, or scr (control). ACADM is an enzyme responsible for the metabolism of
ST:STUDY_SUMMARY                 	medium chain fatty acids (C4-C12). A round of selection was performed using
ST:STUDY_SUMMARY                 	puromycin to ensure only cells that had been transduced survived. Knockdown of
ST:STUDY_SUMMARY                 	ACADM was confirmed via western blot. Pellets were collected by centrifuging
ST:STUDY_SUMMARY                 	cells for 10 min at max speed. The pellets were washed and each sample was split
ST:STUDY_SUMMARY                 	into quadruplicate.
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                    	3
ST:TOTAL_SUBJECTS                	3
#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           	SU0014234	S00021731	Transduced with:shACADM4	
SUBJECT_SAMPLE_FACTORS           	SU0014234	S00021732	Transduced with:shACADM4	
SUBJECT_SAMPLE_FACTORS           	SU0014234	S00021733	Transduced with:shACADM4	
SUBJECT_SAMPLE_FACTORS           	SU0014234	S00021734	Transduced with:shACADM4	
SUBJECT_SAMPLE_FACTORS           	SU0014235	S00021735	Transduced with:shACADM6	
SUBJECT_SAMPLE_FACTORS           	SU0014235	S00021736	Transduced with:shACADM6	
SUBJECT_SAMPLE_FACTORS           	SU0014235	S00021737	Transduced with:shACADM6	
SUBJECT_SAMPLE_FACTORS           	SU0014235	S00021738	Transduced with:shACADM6	
SUBJECT_SAMPLE_FACTORS           	SU0014236	S00021739	Transduced with:shACADMscr	
SUBJECT_SAMPLE_FACTORS           	SU0014236	S00021740	Transduced with:shACADMscr	
SUBJECT_SAMPLE_FACTORS           	SU0014236	S00021741	Transduced with:shACADMscr	
SUBJECT_SAMPLE_FACTORS           	SU0014236	S00021742	Transduced with:shACADMscr	
#COLLECTION
CO:COLLECTION_SUMMARY            	-
#TREATMENT
TR:TREATMENT_SUMMARY             	-
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	-
SP:SAMPLEPREP_PROTOCOL_FILENAME  	A004 - Shotgun Lipidomics.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	S00021731	S00021732	S00021733	S00021734	S00021735	S00021736	S00021737	S00021738	S00021739	S00021740	S00021741	S00021742
Factors	Transduced with:shACADM4	Transduced with:shACADM4	Transduced with:shACADM4	Transduced with:shACADM4	Transduced with:shACADM6	Transduced with:shACADM6	Transduced with:shACADM6	Transduced with:shACADM6	Transduced with:shACADMscr	Transduced with:shACADMscr	Transduced with:shACADMscr	Transduced with:shACADMscr
CL 62:1; [M-2H](2-)@5.51	10414	9693	18893	12421	18698	29895	32514	42442	21654	14949	27951	36070
CL 64:1; [M-2H](2-)@9.34	14216	17395	14557	10800	10378	8722	14562	15628	18659	21807	21990	18478
CL 66:1; [M-2H](2-)@9.58	36910	49591	40500	27399	26563	45605	39921	47688	41682	33934	34819	48465
CL 66:2; [M-2H](2-)@9.39	57968	57517	44060	41622	38019	41430	44577	37748	63495	51026	54392	53890
CL 66:3; [M-2H](2-)@5.66	20312	31016	26588	13772	35602	62052	53498	86756	81515	62400	48934	87439
CL 66:3; [M-2H](2-)@9.19	32442	28567	23945	21837	14263	25789	18968	32254	36808	36590	29022	30326
CL 66:4; [M-2H](2-)@8.96	17091	30577	5019	7955	20176	4164	5623	5983	10714	11536	5052	16001
CL 68:1; [M-2H](2-)@9.81	91602	123917	69436	99122	64832	82408	101564	86376	105380	96514	104429	69696
CL 68:2; [M-2H](2-)@9.57	322589	476104	269068	319506	194362	292653	297788	302384	266138	304275	234947	304445
CL 68:3; [M-2H](2-)@9.44	97484	122186	83572	83793	84283	84818	100784	87644	127772	116840	109980	112699
CL 68:4; [M-2H](2-)@9.22	45259	66309	31044	33433	35706	43244	25186	32739	47372	41107	41805	46566
CL 68:5; [M-2H](2-)@9.02	25439	48614	22954	25247	24573	24160	29181	30670	33645	27959	31440	39245
CL 70:1; [M-2H](2-)@6.11	25511	51179	26688	25005	39866	27154	39281	43555	27980	49708	27242	56464
CL 70:2; [M-2H](2-)@9.83	186481	239411	112463	166492	132271	136762	159953	128839	147671	106559	133672	163719
CL 70:3; [M-2H](2-)@9.61	249214	311895	220232	189643	157426	199428	191341	219394	182957	232973	175282	192243
CL 70:4; [M-2H](2-)@9.47	119810	154068	85129	107104	90691	107079	109242	114075	121875	134792	125437	158936
CL 70:5; [M-2H](2-)@9.28	127107	127042	128329	132393	143185	132031	150192	195090	165643	161788	192526	171378
CL 70:6; [M-2H](2-)@9.10	56235	88445	54849	59939	44210	61494	54399	64216	46207	56746	42992	72029
CL 72:2; [M-2H](2-)@10.02	26653	79791	16224	23096	36168	25261	24407	28834	23855	26759	6307	25220
CL 72:3; [M-2H](2-)@9.86	64532	121566	29663	55072	48364	71307	64204	60352	62539	63911	56500	53444
CL 72:4; [M-2H](2-)@9.69	118577	158892	83917	77745	63652	71446	93624	111821	85777	105167	77447	77939
CL 72:5; [M-2H](2-)@9.52	97738	146818	92650	97922	82375	115057	114709	110705	104565	118424	102708	116930
CL 72:6; [M-2H](2-)@9.32	128046	214534	132229	129632	97581	136842	130039	167921	115550	147616	130464	141765
CL 72:7; [M-2H](2-)@9.18	119384	140208	91552	108056	85573	83197	77177	128923	105092	108761	80769	123042
CL 72:8; [M-2H](2-)@8.97	42089	38287	42409	33281	31679	21414	37221	43400	39251	28786	27603	34993
CL 74:1; [M-2H](2-)@6.58	111861	120291	100277	93382	102207	136035	160523	153840	132354	128365	111611	137618
CL 74:11; [M-2H](2-)@5.57	17146	10300	15238	12581	18170	21247	18671	26887	15633	27593	21506	23223
CL 74:5; [M-2H](2-)@9.74	14149	25808	15788	15618	13612	17185	23059	18267	23578	15794	8899	25923
CL 74:6; [M-2H](2-)@9.57	41173	36772	36901	29480	27061	40349	33941	40893	45231	38678	38799	46512
CL 74:7; [M-2H](2-)@9.40	82875	118238	29812	36595	65596	41410	36769	46397	36282	51025	26833	68803
CL 74:7; [M-2H](2-)@6.01	179150	236894	140265	121081	122166	200081	216248	266539	181641	273906	182576	325732
CL 74:9; [M-2H](2-)@5.64	78207	97046	56024	46525	83449	83236	83820	93626	128432	115700	142204	176793
CL 76:8; [M-2H](2-)@9.44	11692	18032	10499	9968	11537	9152	10483	17304	17558	12626	17576	15078
CL 76:9; [M-2H](2-)@9.30	13726	16710	7734	6571	5247	12490	6764	4674	11469	5720	10246	12486
CL 78:11; [M-2H](2-)@9.67	26888	57294	7595	11741	19762	12352	7917	9434	10273	12443	6920	9427
CL 78:13; [M-2H](2-)@5.71	25561	31111	22031	15775	25383	28904	21162	31484	26611	32935	30940	50936
FFA(16:0)	24431390	30381990	19107793	21518084	14864808	21498115	20236253	37986842	24055767	22135400	16218071	23752511
FFA(18:0)	21312358	26610725	16196968	17723230	12568533	18640464	17093995	32887768	20027272	18957250	14517942	19670951
FFA(18:1)	1396055	2475538	1380738	1386559	1262937	1658537	1803915	1828382	1768278	1805225	1608444	2024540
FFA(18:2)	292105	502035	298619	293858	230869	293462	366926	327128	283431	323782	255150	310650
FFA(20:0)	423347	601071	359464	407524	311393	447057	421676	687446	456341	454211	312996	467300
FFA(20:1)	145634	238670	159941	144863	116441	176168	188109	176475	189802	187874	177498	230974
FFA(20:2)	185549	357962	223614	200297	165165	181851	230510	208055	207618	252540	190695	286346
FFA(20:4) Arachidonic acid	274918	491253	268500	245951	213666	169391	276423	252754	391959	363874	354817	484933
FFA(22:0)	184603	212398	135628	176143	147430	205705	226884	289630	197204	203833	154606	194980
FFA(22:1)	108839	225562	142110	95460	98195	116363	148449	132614	99528	134735	134721	148194
FFA(22:2)	61369	86567	63608	57264	49339	65718	68114	54548	72237	63260	65535	102950
FFA(22:3)	153223	247304	163486	131393	145489	181243	216238	228395	217015	204986	206446	255461
FFA(24:0)	359687	371515	296415	273615	219744	288382	321097	296833	282277	254115	216704	293519
FFA(24:1)	184753	245786	187567	168778	152718	165442	222045	186420	198773	198827	202575	243067
FFA(24:2)	44599	75017	51830	33706	19391	34077	30355	30737	38396	28867	44378	43129
FFA(24:3)	20454	25215	20404	13076	9269	12219	17523	23018	26531	21545	14842	23803
PE 32:0; [M-H]-@6.67	55796	46568	39174	35338	42116	53559	67109	52076	66750	68790	76809	90740
PE 32:0; [M-H]-@5.86	12490	28587	11998	14407	12131	9404	3877	19162	15236	14401	11952	16052
PE 33:0; [M-H]-@6.96	12717	6439	8394	11727	4958	13195	10888	12747	8253	8320	11534	11119
PE 33:1; [M-H]-@6.51	34623	37774	22802	28042	38528	42359	46810	54640	45688	54959	30490	52696
PE 34:3; [M-H]-@5.91	35732	49294	34075	38813	53849	73280	81147	83124	69949	68222	69300	78121
PE 34:4; [M-H]-@5.67	11061	17988	14304	16784	31184	37488	47068	51929	31667	35801	31938	22897
PE 35:0; [M-H]-@7.44	13474	8202	7497	2986	20123	15440	8964	10064	6960	20259	5807	8131
PE 35:3; [M-H]-@6.14	5867	7584	1433	3653	6449	6879	5206	11298	4777	6448	2097	11421
PE 36:0; [M-H]-@7.77	41812	28087	39637	36483	35087	36358	35808	42342	24936	27954	23580	39337
PE 36:1; [M-H]-@7.35	1322984	1856901	1246704	971456	1362522	1853500	1848964	2063882	1418396	1489104	1347522	1793869
PE 36:6; [M-H]-@5.47	20898	19822	19347	18719	24340	30320	22708	29013	28347	36133	29214	28583
PE 37:1; [M-H]-@7.46	13692	21434	8819	7094	10093	11927	28277	13574	5062	22686	14641	15365
PE 37:3; [M-H]-@6.90	12746	20236	15177	8634	10038	13533	14934	14904	12215	14257	17290	13286
PE 37:4; [M-H]-@6.63	35282	31329	28156	31448	24866	38483	49726	50268	35437	42372	34045	26908
PE 38:2; [M-H]-@7.44	172936	238336	141354	120488	224761	261931	192117	282639	196391	157610	151199	168348
PE 38:3; [M-H]-@7.17	637216	840652	548304	558950	782462	884029	799285	919030	904198	774037	792404	933396
PE 38:7; [M-H]-@5.69	37759	42778	32605	30495	32140	42456	33874	28685	33185	49736	39927	68261
PE 39:3; [M-H]-@7.28	26152	34892	9517	32549	15122	16828	26828	33191	18233	39658	14936	15855
PE 39:4; [M-H]-@6.99	43457	30687	88199	29526	36899	94612	60629	48654	42734	58481	33899	33426
PE 39:5; [M-H]-@6.60	38646	41318	30466	37332	29355	26076	45088	31649	25736	48801	20271	75998
PE 39:6; [M-H]-@6.54	15975	24335	12369	22909	15864	17448	22500	24453	13872	17574	21140	34143
PE 40:4; [M-H]-@7.27	789404	1327803	811136	728636	678392	868003	855390	898299	703268	801679	702958	877027
PE 40:8; [M-H]-@5.85	27584	44307	21429	13831	34448	33106	36232	35350	19420	24651	24811	48727
PE 42:4; [M-H]-@7.73	109767	110409	78729	82319	105826	60441	123060	94648	94401	203994	110624	45795
PE 42:7; [M-H]-@6.69	65504	86079	67751	56195	61010	63392	85678	77744	52932	86889	56206	86110
PE 44:4; [M-H]-@8.49	20224	50942	35652	15564	16602	12357	7752	14008	17788	21742	18126	38047
PG 32:0; [M-H]-@5.80	30526	51135	30599	25729	30508	33330	22457	21819	46589	30932	30341	35927
PG 32:1; [M-H]-@5.23	45684	72283	28947	31178	35179	35180	36651	48922	34780	49483	78024	56703
PG 33:0; [M-H]-@6.12	15894	48881	7848	8328	22166	7615	13277	15374	15991	15338	13994	13502
PG 33:1; [M-H]-@5.62	6421	19893	13280	5651	9419	7605	4858	9004	11417	15157	11143	13604
PG 34:1; [M-H]-@5.84	842946	1204060	792875	677205	577366	835089	802423	924956	908660	925379	824802	963883
PG 34:2; [M-H]-@5.25	163432	191434	149149	163430	116868	156327	168128	200745	139332	148639	124411	297228
PG 34:3; [M-H]-@4.78	37862	58039	30564	61696	41152	61051	51725	33647	41828	79464	67159	49976
PG 36:0; [M-H]-@6.95	555798	633235	476591	448807	449102	527302	584435	544116	566145	503149	513474	601838
PG 36:1; [M-H]-@6.50	320353	388612	314625	266289	355215	377557	528468	421537	485612	758459	396893	467814
PG 36:2; [M-H]-@5.70	311386	444982	614073	277826	274658	318569	824149	664985	671575	655363	594590	400584
PG 36:3; [M-H]-@5.28	347295	503256	190521	215176	230619	293370	146841	172705	237449	239853	278380	198847
PG 36:4; [M-H]-@4.89	168972	351361	220170	167448	137224	144485	163694	147669	111051	112672	171590	207611
PG 36:5; [M-H]-@4.52	51499	54933	57350	40891	45302	42971	24414	59519	45575	57186	68944	66635
PG 38:2; [M-H]-@6.63	42685	53936	39618	31965	41009	40318	47097	67864	75451	51702	34604	76465
PG 38:3; [M-H]-@5.87	214786	318231	179563	145625	149083	189926	188902	181501	207879	184979	198464	182453
PG 38:4; [M-H]-@5.53	389588	377524	272065	370483	352831	424456	317645	592816	419479	427254	366770	458193
PG 38:5; [M-H]-@5.11	256221	383109	223581	213840	184563	200161	215123	233143	214106	244719	221582	257204
PG 38:6; [M-H]-@4.81	133521	198896	135654	137041	70560	93575	124024	126666	103337	127935	133210	144189
PG 38:7; [M-H]-@4.48	32369	46461	25826	25162	19457	28264	24078	20609	32798	27565	28725	35993
PG 40:5; [M-H]-@5.62	304043	534284	126942	164288	143905	110484	117584	121260	119897	167306	71098	197274
PG 40:6; [M-H]-@5.35	199147	326260	103130	191616	110917	80638	149843	176371	154949	92531	169780	89313
PG 40:7; [M-H]-@5.05	162608	213642	155394	154717	121311	172670	181733	173711	209032	219803	205861	255185
PG 40:8; [M-H]-@4.72	101324	147791	128663	83378	74321	77515	66204	92595	70075	78718	78263	99525
PG 42:10; [M-H]-@4.63	35828	60407	32728	30673	25839	27866	30225	33755	32810	47727	38293	38984
PG 42:7; [M-H]-@5.48	47497	78437	56628	67951	27987	31190	42444	28495	99247	61498	57224	65393
PG 42:8; [M-H]-@5.32	54207	79246	51812	51996	29442	42008	33262	29149	41697	48053	45843	61363
PG 42:9; [M-H]-@4.90	58526	68911	45241	51292	40424	51713	69856	53080	56578	62553	58021	84699
PG 44:10; [M-H]-@5.16	21148	30450	14759	18581	6417	11501	8772	10005	10808	17571	12877	21892
PG 44:11; [M-H]-@4.92	31922	49079	34435	25197	10565	14235	17139	11453	19421	27561	32858	28522
PG 44:12; [M-H]-@4.58	26128	35912	18110	20860	13050	20751	26728	24156	23269	24973	22400	26754
PG 44:9; [M-H]-@5.42	150725	260611	110582	183273	78542	93370	126899	127648	114643	149769	97564	107032
PI 32:0; [M-H]-@5.63	28222	44661	57362	39076	24953	35671	37162	69447	53361	45816	48229	39610
PI 32:1; [M-H]-@5.15	51815	64452	40631	52553	49456	76203	68436	77848	85857	96107	91279	106506
PI 34:1; [M-H]-@5.73	513737	916600	534547	549178	463128	576804	646762	737136	605130	610001	672894	664663
PI 34:2; [M-H]-@5.31	90673	117339	66855	81320	92861	111768	118616	153087	92506	113397	102087	126048
PI 36:1; [M-H]-@6.35	147154	152718	140031	147284	160891	178975	249737	216725	183606	164820	174281	186885
PI 36:2; [M-H]-@5.91	346900	616321	336462	368857	309195	335848	285197	301671	256313	293528	342089	325706
PI 36:3; [M-H]-@5.51	435360	670042	298473	386255	415631	458002	488234	527811	490831	626423	530250	625536
PI 36:4; [M-H]-@5.28	581937	808754	470134	474529	385897	448219	594714	596168	667794	738440	763663	793498
PI 38:3; [M-H]-@6.15	2475489	3768204	2434590	2554338	2092097	2933708	3306690	3279165	2489708	3411100	2486565	2790882
PI 38:4; [M-H]-@5.81	7014593	12193837	7862138	7347781	8247033	8119272	10230541	11446491	7062243	8778574	11352720	10392226
PI 38:5; [M-H]-@5.46	529005	654968	463824	463671	446192	539898	620193	668341	643360	802873	650956	701870
PI 38:6; [M-H]-@5.14	45431	72830	39313	60058	51461	42077	61884	66730	88734	78720	92842	114005
PI 40:4; [M-H]-@6.34	155101	171151	140688	140204	120850	138786	164040	148848	207451	201074	211616	221622
PI 40:5; [M-H]-@5.98	674525	1164742	744377	803345	844214	746927	782348	1184398	698781	837248	852697	920316
PI 40:6; [M-H]-@5.82	153905	274533	132197	115844	129106	140639	201957	230800	146235	167092	122839	149132
PS 32:1; [M-H]-@5.25	8613	17237	7891	4286	9150	17462	16914	11732	15568	14491	15651	18271
PS 34:1; [M-H]-@5.89	180605	247083	154945	155499	248483	278442	297211	273570	225178	259927	252825	289059
PS 34:2; [M-H]-@5.41	26442	21523	20530	13681	22996	24370	32018	21154	14123	25088	10924	24995
PS 36:1; [M-H]-@6.43	1052254	1304498	912554	822220	1162405	1254376	1415395	1479538	1175897	1386625	1202304	1284940
PS 36:2; [M-H]-@5.93	328502	495405	329669	247307	332148	358571	415155	490340	300802	406249	314429	357689
PS 36:3; [M-H]-@5.65	52190	116021	22624	17510	54665	34953	47373	54171	26658	61541	12668	55308
PS 36:4; [M-H]-@5.38	2291	21045	14164	17637	9557	13523	7366	15318	18392	13032	25725	12794
PS 38:2; [M-H]-@6.56	171778	188276	169263	175367	219525	205082	268981	307540	205936	240514	214505	276599
PS 38:3; [M-H]-@6.24	531461	553491	486905	457505	574230	609019	663169	724037	519923	622369	461210	615553
PS 38:4; [M-H]-@5.94	248405	382110	279350	198128	378803	373013	355587	678501	329096	392715	383147	413122
PS 38:5; [M-H]-@5.48	37732	27345	15887	24674	21466	19749	25184	28118	23944	38095	20080	24364
PS 38:6; [M-H]-@5.28	17227	19432	16954	13063	24256	16566	24142	23211	15259	20579	17894	14609
PS 40:1; [M-H]-@7.52	105400	90653	98007	52738	79735	149188	121222	118655	119433	108832	67057	97347
PS 40:2; [M-H]-@7.04	44224	71097	65508	33815	41983	43025	57603	60500	64656	40224	48699	68271
PS 40:4; [M-H]-@6.44	619143	836106	574668	538881	473581	741775	643167	685574	601078	657910	611609	696816
PS 40:5; [M-H]-@6.08	757792	1460465	837093	680395	612759	904090	943050	1064946	743583	1030855	1097965	992130
PS 40:6; [M-H]-@5.89	539213	739736	549641	560619	700309	765071	735941	1073071	768777	773127	728549	893076
PS 42:1; [M-H]-@8.04	49290	56819	37049	35822	41229	55378	28498	26151	76460	59989	70882	53382
lysoPE 18:0; [M-H]-@2.40	83981	111044	70529	82894	168819	186892	221498	194350	102956	114139	115236	141905
lysoPE 20:4; [M-H]-@1.29	56853	89112	20141	27501	45601	31917	29148	40672	25908	45126	14329	59913
lysoPE 20:5; [M-H]-@1.08	7615	3996	1536	1976	4846	2863	2107	2353	2599	3567	2192	8077
lysoPE 22:5; [M-H]-@1.48	34827	30600	30307	36879	21950	20174	27614	21217	24385	22720	28029	28808
lysoPE 22:6; [M-H]-@1.24	9947	25860	14347	19912	10121	12788	13087	16446	12513	14225	10699	12055
plasmenyl-PE 30:0; [M-H]-@6.40	27163	38800	28665	26620	18054	25054	22852	30622	21331	26543	13567	22281
plasmenyl-PE 31:0; [M-H]-@6.62	12463	15053	13454	11119	9838	11481	14716	12541	8885	10559	14054	9059
plasmenyl-PE 33:0; [M-H]-@7.17	61734	105639	55462	57092	42523	45101	61343	73244	54191	55746	56495	52826
plasmenyl-PE 36:0; [M-H]-@8.08	61912	102004	69600	59426	67653	67774	85414	79710	83978	74534	82884	54999
plasmenyl-PE 36:2; [M-H]-@7.24	462854	637500	389256	412662	481939	548406	602216	563733	535125	495015	506087	566169
plasmenyl-PE 38:0; [M-H]-@8.50	21121	45908	25473	34677	51933	48295	48063	56747	40867	55552	34320	45303
plasmenyl-PE 38:1; [M-H]-@8.11	209208	239539	165247	170201	211359	247770	269475	242733	228256	185550	178073	237662
plasmenyl-PE 38:2; [M-H]-@7.74	208288	264281	200760	188610	307099	265664	281745	245718	239008	244710	294498	367325
plasmenyl-PE 38:3; [M-H]-@7.44	934831	1321884	892525	798240	782721	1002774	933152	1108269	797158	965285	827633	897327
plasmenyl-PE 38:4; [M-H]-@7.17	3247037	3962278	2863493	2654016	3178214	3418104	3097666	4276488	3515073	3732818	3324039	4027756
plasmenyl-PE 38:5; [M-H]-@6.70	1811267	2796288	1864741	1559345	1120470	1432869	1687677	1788410	1635083	1985876	1640316	1856322
plasmenyl-PE 38:6; [M-H]-@6.50	605822	760705	541488	506389	349622	369082	486943	421784	515063	613691	588103	627931
plasmenyl-PE 40:1; [M-H]-@8.54	80652	93962	56887	69928	77614	88922	108652	94289	87800	87972	102386	111467
plasmenyl-PE 40:4; [M-H]-@7.60	1078605	1181697	990303	926834	967428	1213902	1379831	1157296	1229072	1179268	1111439	1266452
plasmenyl-PE 40:6; [M-H]-@7.12	318817	396232	600532	528521	505168	582834	281256	659943	664905	640164	302089	742497
plasmenyl-PE 42:4; [M-H]-@8.00	221027	367119	255465	227828	181959	265395	245718	259903	218483	238082	189224	244486
plasmenyl-PE 42:5; [M-H]-@7.81	284307	423182	238942	257837	218248	306452	304670	355037	210139	269540	233528	273483
plasmenyl-PE 42:6; [M-H]-@7.69	162321	262126	162140	143074	159368	245175	189844	231798	162708	178425	151827	193377
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
CL 62:1; [M-2H](2-)@5.51		5.51					CL 62:1	LipidBLAST
CL 64:1; [M-2H](2-)@9.34		9.34					CL 64:1	LipidBLAST
CL 66:1; [M-2H](2-)@9.58		9.58					CL(66:1)	LipidMaps Bulk ID
CL 66:2; [M-2H](2-)@9.39		9.39					CL(66:2)	LipidMaps Bulk ID
CL 66:3; [M-2H](2-)@5.66		9.19					CL 66:3	LipidBLAST
CL 66:3; [M-2H](2-)@9.19		9.19					CL 66:3	LipidBLAST
CL 66:4; [M-2H](2-)@8.96		8.96					CL 66:4	LipidBLAST
CL 68:1; [M-2H](2-)@9.81		9.81					CL(68:1)	LipidMaps Bulk ID
CL 68:2; [M-2H](2-)@9.57		9.57					CL(68:2)	LipidMaps Bulk ID
CL 68:3; [M-2H](2-)@9.44		9.44					CL(68:3)	LipidMaps Bulk ID
CL 68:4; [M-2H](2-)@9.22		9.22					CL(68:4)	LipidMaps Bulk ID
CL 68:5; [M-2H](2-)@9.02		9.02					CL 68:5	LipidBLAST
CL 70:1; [M-2H](2-)@6.11		6.11					CL(70:1)	LipidMaps Bulk ID
CL 70:2; [M-2H](2-)@9.83		9.83					CL(70:2)	LipidMaps Bulk ID
CL 70:3; [M-2H](2-)@9.61		9.61					CL(70:3)	LipidMaps Bulk ID
CL 70:4; [M-2H](2-)@9.47		9.47					CL(70:4)	LipidMaps Bulk ID
CL 70:5; [M-2H](2-)@9.28		9.28					CL(70:5)	LipidMaps Bulk ID
CL 70:6; [M-2H](2-)@9.10		9.1					CL(70:6)	LipidMaps Bulk ID
CL 72:2; [M-2H](2-)@10.02		10.02					CL(72:2)	LipidMaps Bulk ID
CL 72:3; [M-2H](2-)@9.86		9.86					CL(72:3)	LipidMaps Bulk ID
CL 72:4; [M-2H](2-)@9.69		9.69					CL(72:4)	LipidMaps Bulk ID
CL 72:5; [M-2H](2-)@9.52		9.52					CL(72:5)	LipidMaps Bulk ID
CL 72:6; [M-2H](2-)@9.32		9.32					CL(72:6)	LipidMaps Bulk ID
CL 72:7; [M-2H](2-)@9.18		9.18					CL(72:7)	LipidMaps Bulk ID
CL 72:8; [M-2H](2-)@8.97		8.97					CL(72:8)	LipidMaps Bulk ID
CL 74:1; [M-2H](2-)@6.58		6.58					CL(74:1)	LipidMaps Bulk ID
CL 74:11; [M-2H](2-)@5.57		5.57					CL 74:11	LipidBLAST
CL 74:5; [M-2H](2-)@9.74		9.74					CL(74:5)	LipidMaps Bulk ID
CL 74:6; [M-2H](2-)@9.57		9.57					CL(74:6)	LipidMaps Bulk ID
CL 74:7; [M-2H](2-)@9.40		9.4					CL(74:7)	LipidMaps Bulk ID
CL 74:7; [M-2H](2-)@6.01		9.4					CL(74:7)	LipidMaps Bulk ID
CL 74:9; [M-2H](2-)@5.64		5.64					CL(74:9)	LipidMaps Bulk ID
CL 76:8; [M-2H](2-)@9.44		9.44					CL(76:8)	LipidMaps Bulk ID
CL 76:9; [M-2H](2-)@9.30		9.3					CL(76:9)	LipidMaps Bulk ID
CL 78:11; [M-2H](2-)@9.67		9.67					CL 78:11	LipidBLAST
CL 78:13; [M-2H](2-)@5.71		5.71					CL(78:13)	LipidMaps Bulk ID
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(20:4) Arachidonic acid							FA(20:4)	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
PE 32:0; [M-H]-@6.67		6.67					PE(32:0)	LipidMaps Bulk ID
PE 32:0; [M-H]-@5.86		6.67					PE(32:0)	LipidMaps Bulk ID
PE 33:0; [M-H]-@6.96		6.96					PE(33:0)	LipidMaps Bulk ID
PE 33:1; [M-H]-@6.51		6.51					PE(33:1)	LipidMaps Bulk ID
PE 34:3; [M-H]-@5.91		5.91					PE(34:3)	LipidMaps Bulk ID
PE 34:4; [M-H]-@5.67		5.67					PE(34:4)	LipidMaps Bulk ID
PE 35:0; [M-H]-@7.44		7.44					PE(35:0)	LipidMaps Bulk ID
PE 35:3; [M-H]-@6.14		6.14					PE(35:3)	LipidMaps Bulk ID
PE 36:0; [M-H]-@7.77		7.77					PE(36:0)	LipidMaps Bulk ID
PE 36:1; [M-H]-@7.35		7.35					PE(36:1)	LipidMaps Bulk ID
PE 36:6; [M-H]-@5.47		5.47					PE(36:6)	LipidMaps Bulk ID
PE 37:1; [M-H]-@7.46		7.46					PE(37:1)	LipidMaps Bulk ID
PE 37:3; [M-H]-@6.90		6.9					PE(37:3)	LipidMaps Bulk ID
PE 37:4; [M-H]-@6.63		6.63					PE(37:4)	LipidMaps Bulk ID
PE 38:2; [M-H]-@7.44		7.44					PE(38:2)	LipidMaps Bulk ID
PE 38:3; [M-H]-@7.17		7.17					PE(38:3)	LipidMaps Bulk ID
PE 38:7; [M-H]-@5.69		5.69					PE(38:7)	LipidMaps Bulk ID
PE 39:3; [M-H]-@7.28		7.28					PE(39:3)	LipidMaps Bulk ID
PE 39:4; [M-H]-@6.99		6.99					PE(39:4)	LipidMaps Bulk ID
PE 39:5; [M-H]-@6.60		6.6					PE(39:5)	LipidMaps Bulk ID
PE 39:6; [M-H]-@6.54		6.54					PE(39:6)	LipidMaps Bulk ID
PE 40:4; [M-H]-@7.27		7.27					PE(40:4)	LipidMaps Bulk ID
PE 40:8; [M-H]-@5.85		5.85					PE(40:8)	LipidMaps Bulk ID
PE 42:4; [M-H]-@7.73		7.73					PE(42:4)	LipidMaps Bulk ID
PE 42:7; [M-H]-@6.69		6.69					PE(42:7)	LipidMaps Bulk ID
PE 44:4; [M-H]-@8.49		8.49					PE(44:4)	LipidMaps Bulk ID
PG 32:0; [M-H]-@5.80		5.8					PG(32:0)	LipidMaps Bulk ID
PG 32:1; [M-H]-@5.23		5.23					PG(32:1)	LipidMaps Bulk ID
PG 33:0; [M-H]-@6.12		6.12					PG(33:0)	LipidMaps Bulk ID
PG 33:1; [M-H]-@5.62		5.62					PG(33:1)	LipidMaps Bulk ID
PG 34:1; [M-H]-@5.84		5.84					PG(34:1)	LipidMaps Bulk ID
PG 34:2; [M-H]-@5.25		5.25					PG(34:2)	LipidMaps Bulk ID
PG 34:3; [M-H]-@4.78		4.78					PG(34:3)	LipidMaps Bulk ID
PG 36:0; [M-H]-@6.95		6.95					PG(36:0)	LipidMaps Bulk ID
PG 36:1; [M-H]-@6.50		6.5					PG(36:1)	LipidMaps Bulk ID
PG 36:2; [M-H]-@5.70		5.7					PG(36:2)	LipidMaps Bulk ID
PG 36:3; [M-H]-@5.28		5.28					PG(36:3)	LipidMaps Bulk ID
PG 36:4; [M-H]-@4.89		4.89					PG(36:4)	LipidMaps Bulk ID
PG 36:5; [M-H]-@4.52		4.52					PG(36:5)	LipidMaps Bulk ID
PG 38:2; [M-H]-@6.63		6.63					PG(38:2)	LipidMaps Bulk ID
PG 38:3; [M-H]-@5.87		5.87					PG(38:3)	LipidMaps Bulk ID
PG 38:4; [M-H]-@5.53		5.53					PG(38:4)	LipidMaps Bulk ID
PG 38:5; [M-H]-@5.11		5.11					PG(38:5)	LipidMaps Bulk ID
PG 38:6; [M-H]-@4.81		4.81					PG(38:6)	LipidMaps Bulk ID
PG 38:7; [M-H]-@4.48		4.48					PG(38:7)	LipidMaps Bulk ID
PG 40:5; [M-H]-@5.62		5.62					PG(40:5)	LipidMaps Bulk ID
PG 40:6; [M-H]-@5.35		5.35					PG(40:6)	LipidMaps Bulk ID
PG 40:7; [M-H]-@5.05		5.05					PG(40:7)	LipidMaps Bulk ID
PG 40:8; [M-H]-@4.72		4.72					PG(40:8)	LipidMaps Bulk ID
PG 42:10; [M-H]-@4.63		4.63					PG(42:10)	LipidMaps Bulk ID
PG 42:7; [M-H]-@5.48		5.48					PG(42:7)	LipidMaps Bulk ID
PG 42:8; [M-H]-@5.32		5.32					PG(42:8)	LipidMaps Bulk ID
PG 42:9; [M-H]-@4.90		4.9					PG(42:9)	LipidMaps Bulk ID
PG 44:10; [M-H]-@5.16		5.16					PG(44:10)	LipidMaps Bulk ID
PG 44:11; [M-H]-@4.92		4.92					PG 44:11	LipidBLAST
PG 44:12; [M-H]-@4.58		4.58		52927240			LMGP04010977	LipidMaps
PG 44:9; [M-H]-@5.42		5.42					PG 44:9	LipidBLAST
PI 32:0; [M-H]-@5.63		5.63					PI(32:0)	LipidMaps Bulk ID
PI 32:1; [M-H]-@5.15		5.15					PI(32:1)	LipidMaps Bulk ID
PI 34:1; [M-H]-@5.73		5.73					PI(34:1)	LipidMaps Bulk ID
PI 34:2; [M-H]-@5.31		5.31					PI(34:2)	LipidMaps Bulk ID
PI 36:1; [M-H]-@6.35		6.35					PI(36:1)	LipidMaps Bulk ID
PI 36:2; [M-H]-@5.91		5.91					PI(36:2)	LipidMaps Bulk ID
PI 36:3; [M-H]-@5.51		5.51					PI(36:3)	LipidMaps Bulk ID
PI 36:4; [M-H]-@5.28		5.28					PI(36:4)	LipidMaps Bulk ID
PI 38:3; [M-H]-@6.15		6.15					PI(38:3)	LipidMaps Bulk ID
PI 38:4; [M-H]-@5.81		5.81					PI(38:4)	LipidMaps Bulk ID
PI 38:5; [M-H]-@5.46		5.46					PI(38:5)	LipidMaps Bulk ID
PI 38:6; [M-H]-@5.14		5.14					PI(38:6)	LipidMaps Bulk ID
PI 40:4; [M-H]-@6.34		6.34					PI(40:4)	LipidMaps Bulk ID
PI 40:5; [M-H]-@5.98		5.98					PI(40:5)	LipidMaps Bulk ID
PI 40:6; [M-H]-@5.82		5.82					PI(40:6)	LipidMaps Bulk ID
PS 32:1; [M-H]-@5.25		5.25					PS(32:1)	LipidMaps Bulk ID
PS 34:1; [M-H]-@5.89		5.89					PS(34:1)	LipidMaps Bulk ID
PS 34:2; [M-H]-@5.41		5.41					PS(34:2)	LipidMaps Bulk ID
PS 36:1; [M-H]-@6.43		6.43					PS(36:1)	LipidMaps Bulk ID
PS 36:2; [M-H]-@5.93		5.93					PS(36:2)	LipidMaps Bulk ID
PS 36:3; [M-H]-@5.65		5.65					PS(36:3)	LipidMaps Bulk ID
PS 36:4; [M-H]-@5.38		5.38					PS(36:4)	LipidMaps Bulk ID
PS 38:2; [M-H]-@6.56		6.56					PS(38:2)	LipidMaps Bulk ID
PS 38:3; [M-H]-@6.24		6.24					PS(38:3)	LipidMaps Bulk ID
PS 38:4; [M-H]-@5.94		5.94					PS(38:4)	LipidMaps Bulk ID
PS 38:5; [M-H]-@5.48		5.48					PS(38:5)	LipidMaps Bulk ID
PS 38:6; [M-H]-@5.28		5.28					PS(38:6)	LipidMaps Bulk ID
PS 40:1; [M-H]-@7.52		7.52					PS(40:1)	LipidMaps Bulk ID
PS 40:2; [M-H]-@7.04		7.04					PS(40:2)	LipidMaps Bulk ID
PS 40:4; [M-H]-@6.44		6.44					PS(40:4)	LipidMaps Bulk ID
PS 40:5; [M-H]-@6.08		6.08					PS(40:5)	LipidMaps Bulk ID
PS 40:6; [M-H]-@5.89		5.89					PS(40:6)	LipidMaps Bulk ID
PS 42:1; [M-H]-@8.04		8.04					PS(42:1)	LipidMaps Bulk ID
lysoPE 18:0; [M-H]-@2.40		2.4					LPE(18:0)	LipidMaps Bulk ID
lysoPE 20:4; [M-H]-@1.29		1.29					LPE(20:4)	LipidMaps Bulk ID
lysoPE 20:5; [M-H]-@1.08		1.08					LPE(20:5)	LipidMaps Bulk ID
lysoPE 22:5; [M-H]-@1.48		1.48					LPE(22:5)	LipidMaps Bulk ID
lysoPE 22:6; [M-H]-@1.24		1.24					LPE(22:6)	LipidMaps Bulk ID
plasmenyl-PE 30:0; [M-H]-@6.40		6.4					PE(P-30:0)	LipidMaps Bulk ID
plasmenyl-PE 31:0; [M-H]-@6.62		6.62					PE(P-31:0)	LipidMaps Bulk ID
plasmenyl-PE 33:0; [M-H]-@7.17		7.17					PE(P-33:0)	LipidMaps Bulk ID
plasmenyl-PE 36:0; [M-H]-@8.08		8.08					PE(P-36:0)	LipidMaps Bulk ID
plasmenyl-PE 36:2; [M-H]-@7.24		7.24					PE(P-36:2)	LipidMaps Bulk ID
plasmenyl-PE 38:0; [M-H]-@8.50		8.5					PE(P-38:0)	LipidMaps Bulk ID
plasmenyl-PE 38:1; [M-H]-@8.11		8.11					PE(P-38:1)	LipidMaps Bulk ID
plasmenyl-PE 38:2; [M-H]-@7.74		7.74					PE(P-38:2)	LipidMaps Bulk ID
plasmenyl-PE 38:3; [M-H]-@7.44		7.44					PE(P-38:3)	LipidMaps Bulk ID
plasmenyl-PE 38:4; [M-H]-@7.17		7.17					PE(P-38:4)	LipidMaps Bulk ID
plasmenyl-PE 38:5; [M-H]-@6.70		6.7					PE(P-38:5)	LipidMaps Bulk ID
plasmenyl-PE 38:6; [M-H]-@6.50		6.5					PE(P-38:6)	LipidMaps Bulk ID
plasmenyl-PE 40:1; [M-H]-@8.54		8.54					PE(P-40:1)	LipidMaps Bulk ID
plasmenyl-PE 40:4; [M-H]-@7.60		7.6					PE(P-40:4)	LipidMaps Bulk ID
plasmenyl-PE 40:6; [M-H]-@7.12		7.12					PE(P-40:6)	LipidMaps Bulk ID
plasmenyl-PE 42:4; [M-H]-@8.00		8					PE(P-42:4)	LipidMaps Bulk ID
plasmenyl-PE 42:5; [M-H]-@7.81		7.81					plasmenyl-PE 42:5	LipidBLAST
plasmenyl-PE 42:6; [M-H]-@7.69		7.69					PE(P-42:6)	LipidMaps Bulk ID
METABOLITES_END
#END