#METABOLOMICS WORKBENCH araskind_20170714_081557 DATATRACK_ID:1133 STUDY_ID:ST000819 ANALYSIS_ID:AN001302 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
CH:INSTRUMENT_NAME               	Agilent
CH:COLUMN_NAME                   	Waters Xbridge BEH C18 (50 x 1mm, 3.5um)
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:ANALYSIS_PROTOCOL_FILE        	A008 - Acyl Carnitines.pdf
#MS
MS:MS_COMMENTS                   	-
MS:INSTRUMENT_NAME               	Agilent 6490A QQQ
MS:INSTRUMENT_TYPE               	Triple quadrupole
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	POSITIVE
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS         	pmol/ug protein
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
ACETYL-DL-CARNITINE	15.20546067	18.07056182	11.24574751	11.99804636	12.28310183	14.26191246	13.37886282	14.17667391	14.88614288	13.55534447	15.24164069	16.65295116
DECANOYLCARNITINE	.019825831	.023556327	.017296331	.015469811	.019865695	.023137137	.029889508	.027207317	.032477726	.026342887	.026964221	.033380675
LAUROYLCARNITINE	.076009032	.079841127	.063232398	.057745946	.061003535	.077116223	.099731885	.115633126	.104729034	.07721505	.083590866	.110709395
L-PALMITOYLCARNITINE	1.652673647	2.116380703	1.558703454	1.343585015	1.264035074	2.118303482	1.96669206	2.044392507	2.950571025	2.220557337	2.681129048	3.544717052
O-OCTANOYLCARNITINE	.029410786	.035269988	.025815132	.02362421	.026478902	.02914819	.035556273	.034548634	.034140647	.034516108	.029422466	.036698479
BUTYRYLCARNITINE	4.198895116	5.97455274	1.736132372	1.925018177	1.773224924	3.997991689	3.752709994	4.276347313	2.123717138	1.996315714	2.982466414	4.422392566
DL-CARNITINE	39.04638787	35.90193865	28.62596415	22.69878065	25.66590397	28.05625304	35.57130629	28.54777973	26.38395205	27.70516827	26.51128093	43.23183794
AC1MIY4G	.223359713	.235742671	.152971439	.156842788	.149714063	.170986063	.173926083	.200902628	.17339216	.201690186	.130788128	.197626479
ARACHIDONYL CARNITINE	.178152598	.285635074	.201952603	.165244515	.117392046	.257568796	.288207225	.231830006	.538386682	.297795456	.397421743	.547055516
ARACHIDYL CARNITINE	.001262277	.001838382	.001392142	.000993326	.001924772	.00190596	.002735157	.001880514	.004201177	.00522658	.003439934	.004260206
LINOELAIDYL CARNITINE	.284375381	.444721223	.315570023	.255897991	.268474417	.447359409	.475507873	.48480516	.708065132	.438848592	.552463604	.779834283
18:3 CARNITINE	.122876233	.23643141	.14472722	.121376077	.148936081	.230763844	.270103852	.257197543	.461766132	.294976408	.379355094	.42267782
CIS-4-DECENOYL CARNITINE	.000900918	.001158032	.000956743	.000955765	.000717847	.00098573	.001489242	.001174315	.001386959	.001404463	.001453604	.001499192
ISOVALERYLCARNITINE	2.652254125	2.937415265	2.117797375	2.004763588	1.860942903	2.417168977	2.502310528	2.49530889	2.170679638	2.264237426	1.980162821	2.505542768
MYRISTOYLCARNITINE	.588138591	.780201822	.672898195	.490404598	.400745385	.578588376	.793121634	.823334224	1.29512326	.899480792	.998553208	1.33046501
STEAROYLCARNITINE	.156742723	.237115312	.140397438	.154720961	.195263194	.273613444	.284990738	.288709887	.572525419	.346542636	.693505162	.639366341
OLEOYLCARNITINE	.96764442	1.358441396	1.040343445	.936244733	1.174851185	1.941606779	2.037052701	2.004514605	2.73733414	2.033944686	2.534700612	3.115771646
GLUTARYLCARNITINE	.030756535	.034013945	.023240727	.022134714	.023577981	.029096595	.027767981	.032645462	.02437852	.024295223	.023508632	.027784331
11-CIS-ICOSENEOYLCARNITINE	.009066514	.015546614	.009366663	.00803587	.014136043	.017048793	.020769615	.022517112	.035595748	.02144162	.040072832	.038860346
(11Z,14Z)-ICOSADIENOYLCARNITINE	.040319131	.065835285	.049416112	.043469882	.060185672	.094802412	.102017102	.099171672	.189938176	.112813376	.187150516	.227406054
3-HYDROXYLAUROYLCARNITINE	.00638321	.006719879	.005990168	.004816496	.005306895	.006180265	.008422667	.0090673	.015488324	.008961206	.013576891	.016789917
3-HYDROXYMYRISTOYLCARNITINE	.014853983	.017344924	.013999634	.010885017	.007930294	.008740426	.010724994	.013502193	.021963737	.016019515	.02138328	.025181908
3-HYDROXYPALMITOYLCARNITINE	.031141264	.038381422	.034258577	.027028691	.032376225	.044669943	.04910566	.049214047	.066844467	.04832983	.056728447	.070087951
3-HYDROXYLINOLEYLCARNITINE	.009090149	.011036852	.010030736	.008849648	.010700174	.018475314	.023838276	.020362177	.039894842	.018842113	.039443391	.048301783
16:1 CARNITINE	.483084065	.688101889	.494762955	.419472318	.616721529	.944364128	1.002222948	1.019592279	1.83798215	1.278923267	1.600873438	1.940727011
8:1 CARNITINE	.007483505	.006849324	.006784219	.00620255	.006308905	.007256629	.008469802	.008592152	.007122784	.006198747	.005889251	.007274132
14:2 CARNITINE	.033464124	.043729134	.04364662	.032244228	.033680233	.043864069	.066290765	.068443206	.07928557	.052135792	.063624376	.070751383
12:1 CARNITINE	.011001841	.013126047	.011665139	.009820332	.013256599	.015920587	.024833216	.02597028	.030529773	.019342797	.030556723	.032240898
14:1 CARNITINE	.133452099	.192421467	.17530569	.141625931	.176187928	.259304473	.362029268	.335685018	.583522222	.345251589	.464835723	.482767334
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
ACETYL-DL-CARNITINE				1
DECANOYLCARNITINE				10245190
LAUROYLCARNITINE				10427569
L-PALMITOYLCARNITINE				11953816
O-OCTANOYLCARNITINE				123701
BUTYRYLCARNITINE				213144
DL-CARNITINE				288
AC1MIY4G				3082079
ARACHIDONYL CARNITINE				53477832
ARACHIDYL CARNITINE				53477833
LINOELAIDYL CARNITINE				53477834
18:3 CARNITINE				54500892
CIS-4-DECENOYL CARNITINE				57357170
ISOVALERYLCARNITINE				6426851
MYRISTOYLCARNITINE				6426854
STEAROYLCARNITINE				6426855
OLEOYLCARNITINE				6441392
GLUTARYLCARNITINE				71317118
11-CIS-ICOSENEOYLCARNITINE				71464507
(11Z,14Z)-ICOSADIENOYLCARNITINE				71464509
3-HYDROXYLAUROYLCARNITINE				71464535
3-HYDROXYMYRISTOYLCARNITINE				71464541
3-HYDROXYPALMITOYLCARNITINE				71464553
3-HYDROXYLINOLEYLCARNITINE				71464556
16:1 CARNITINE				76040365
8:1 CARNITINE				77908888
14:2 CARNITINE				87087940
12:1 CARNITINE				87087953
14:1 CARNITINE				87088002
METABOLITES_END
#END