#METABOLOMICS WORKBENCH araskind_20170802_131805 DATATRACK_ID:1177 STUDY_ID:ST000830 ANALYSIS_ID:AN001323 PROJECT_ID:PR000591
VERSION             	1
CREATED_ON             	August 8, 2017, 12:26 pm
#PROJECT
PR:PROJECT_TITLE                 	CD47 (integrin associated protein) metabolomics
PR:PROJECT_TYPE                  	MS analysis
PR:PROJECT_SUMMARY               	CD47 WT/KO quad/serum (RNAseq mice)
PR:INSTITUTE                     	University of Michigan
PR:DEPARTMENT                    	Metabolism, Endo & Diabetes
PR:LABORATORY                    	Chun Lab
PR:LAST_NAME                     	Chun
PR:FIRST_NAME                    	Taehwa
PR:ADDRESS                       	Ann Arbor, MI
PR:EMAIL                         	taehwa@med.umich.edu
PR:PHONE                         	734-763-3056
#STUDY
ST:STUDY_TITLE                   	CD47 WT/KO muscle and serum acyl-carnitine assay
ST:STUDY_TYPE                    	MS analysis
ST:STUDY_SUMMARY                 	These mice were fed a high-fat diet for 3 weeks, fast for 5 hours, dissected,
ST:STUDY_SUMMARY                 	and quadriceps were snap-frozen in LN2.
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                    	7
ST:TOTAL_SUBJECTS                	9
#SUBJECT
SU:SUBJECT_TYPE                  	MOUSE
SU:SUBJECT_SPECIES               	Mus musculus
SU:TAXONOMY_ID                   	10090
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	SU0013199	S00019644	Sample type:Quadriceps Muscle | Type:WT	
SUBJECT_SAMPLE_FACTORS           	SU0013200	S00019645	Sample type:Quadriceps Muscle | Type:WT	
SUBJECT_SAMPLE_FACTORS           	SU0013201	S00019646	Sample type:Quadriceps Muscle | Type:WT	
SUBJECT_SAMPLE_FACTORS           	SU0013202	S00019647	Sample type:Quadriceps Muscle | Type:WT	
SUBJECT_SAMPLE_FACTORS           	SU0013203	S00019648	Sample type:Quadriceps Muscle | Type:KO	
SUBJECT_SAMPLE_FACTORS           	SU0013204	S00019649	Sample type:Quadriceps Muscle | Type:KO	
SUBJECT_SAMPLE_FACTORS           	SU0013205	S00019650	Sample type:Quadriceps Muscle | Type:KO	
SUBJECT_SAMPLE_FACTORS           	SU0013206	S00019651	Sample type:Quadriceps Muscle | Type:KO	
SUBJECT_SAMPLE_FACTORS           	SU0013199	S00019652	Sample type:Serum | Type:WT	
SUBJECT_SAMPLE_FACTORS           	SU0013200	S00019653	Sample type:Serum | Type:WT	
SUBJECT_SAMPLE_FACTORS           	SU0013201	S00019654	Sample type:Serum | Type:WT	
SUBJECT_SAMPLE_FACTORS           	SU0013202	S00019655	Sample type:Serum | Type:WT	
SUBJECT_SAMPLE_FACTORS           	SU0013203	S00019656	Sample type:Serum | Type:KO	
SUBJECT_SAMPLE_FACTORS           	SU0013204	S00019657	Sample type:Serum | Type:KO	
SUBJECT_SAMPLE_FACTORS           	SU0013205	S00019658	Sample type:Serum | Type:KO	
SUBJECT_SAMPLE_FACTORS           	SU0013206	S00019659	Sample type:Serum | Type:KO	
SUBJECT_SAMPLE_FACTORS           	SU9999996	S00020332	Sample type:Pooled sample | Type:Pooled quadriceps muscle	
SUBJECT_SAMPLE_FACTORS           	SU9999996	S00020333	Sample type:Pooled sample | Type:Pooled serum	
#COLLECTION
CO:COLLECTION_SUMMARY            	-
#TREATMENT
TR:TREATMENT_SUMMARY             	-
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	-
SP:SAMPLEPREP_PROTOCOL_FILENAME  	A008_Acyl_Carnitines.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/mg
MS_METABOLITE_DATA_START
Samples	S00019644	S00019645	S00019646	S00019647	S00019648	S00019649	S00019650	S00019651
Factors	Sample type:Quadriceps Muscle | Type:WT	Sample type:Quadriceps Muscle | Type:WT	Sample type:Quadriceps Muscle | Type:WT	Sample type:Quadriceps Muscle | Type:WT	Sample type:Quadriceps Muscle | Type:KO	Sample type:Quadriceps Muscle | Type:KO	Sample type:Quadriceps Muscle | Type:KO	Sample type:Quadriceps Muscle | Type:KO
ACETYL-DL-CARNITINE	100.1845889	88.89034357	108.6445271	94.95456292	88.98944383	70.5243596	99.19418335	85.5627241
DECANOYLCARNITINE	.048276551	.109965466	.031680243	.086284882	.071837737	.025869545	.030327067	.120671478
LAUROYLCARNITINE	.081031375	.112393223	.127238362	.380282312	.13245207	.060733732	.066425032	.161027968
PROPIONYLCARNITINE	.465134419	.457731749	.547240375	.515997925	.435563539	.296942577	.501431381	.452836435
L-PALMITOYLCARNITINE	4.438895528	3.015354165	3.459593952	10.62553752	5.979844825	2.997603677	2.713993866	10.59481246
O-OCTANOYLCARNITINE	.094045746	.117527333	.100771828	.133407254	.09269257	.047878558	.074026698	.140133335
BUTYRYLCARNITINE	1.259050856	1.151712143	1.755467524	1.801555114	1.137185399	.666081085	1.101565025	1.378448756
DL-CARNITINE	99.16711982	60.6031901	88.11087428	87.65716226	116.5196146	67.57761943	95.8765137	93.57531817
AC1MIY4G	.306812804	.350631833	.391545513	.747510453	.33602549	.133367454	.253839935	.350910428
ARACHIDONYL CARNITINE	.097667482	.030327067	.062325704	.341477994	.205523585	.081508966	.072912318	.241581751
LINOELAIDYL CARNITINE	1.517069717	1.063516895	1.319744788	6.934470835	2.422901785	1.821613961	.938467494	4.218327807
18:3 CARNITINE	.026187939	.021093629	.020775235	.088036052	.043540434	.019660854	.016636107	.052933069
CIS-4-DECENOYL CARNITINE	.009273237	.02045684	.0056913	.041630068	.021252826	.007920061	.009472233	.023043795
ISOVALERYLCARNITINE	.161386162	.101727011	.102403599	.146063431	.152073125	.100254437	.222159693	.129188528
MYRISTOYLCARNITINE	.938945086	.787309753	.921990584	2.774130608	1.153503112	.547200576	.643355685	1.564908476
STEAROYLCARNITINE	.391943506	.312902097	.413673924	1.322849133	.620152693	.340602409	.261242605	.937910304
OLEOYLCARNITINE	6.761264281	5.844288409	7.455841665	23.45969739	10.58613621	9.210194809	5.009856285	21.6960312
GLUTARYLCARNITINE	.092971165	.090583207	.118960108	.17396274	.075937064	.075777867	.064713662	.073429709
(11Z,14Z)-ICOSADIENOYLCARNITINE	.341875987	.250257998	.390829126	1.248663238	.278117508	.140252733	.095040728	.606700529
3-HYDROXYLAUROYLCARNITINE	.016914703	.013531762	.05400765	.111079846	.024516369	.027103323	.024396971	.022367207
3-HYDROXYMYRISTOYLCARNITINE	.051102301	.047440766	.150839347	.298096757	.075738068	.067380215	.057868182	.070086567
3-HYDROXYPALMITOYLCARNITINE	.116134357	.06710162	.191195837	.478626382	.236169046	.116930343	.119318301	.200668071
3-HYDROXYLINOLEYLCARNITINE	.227333602	.190957041	.605904543	1.507995477	.83920804	.59189519	.258775049	.621107876
16:1 CARNITINE	.73572986	.532833028	.879723727	2.611311672	1.180526837	.7789519	.588870443	1.938146311
8:1 CARNITINE	.008954843	.008954843	.010308019	.012934773	.010347818	.005731099	.007840462	.007920061
14:2 CARNITINE	.024237774	.045729396	.019501657	.094085545	.038605321	.017591291	.014367547	.044495617
12:1 CARNITINE	.006964878	.015601326	.013173568	.062683898	.017153498	.00907424	.007840462	.022407006
14:1 CARNITINE	.27517236	.344821135	.313976678	.939621674	.43269799	.207752346	.206478768	.573866107
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
PROPIONYLCARNITINE				107738
L-PALMITOYLCARNITINE				11953816
O-OCTANOYLCARNITINE				123701
BUTYRYLCARNITINE				213144
DL-CARNITINE				288
AC1MIY4G				3082079
ARACHIDONYL CARNITINE				53477832
LINOELAIDYL CARNITINE				53477834
18:3 CARNITINE				54500892
CIS-4-DECENOYL CARNITINE				57357170
ISOVALERYLCARNITINE				6426851
MYRISTOYLCARNITINE				6426854
STEAROYLCARNITINE				6426855
OLEOYLCARNITINE				6441392
GLUTARYLCARNITINE				71317118
(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