#METABOLOMICS WORKBENCH araskind_20150608_9705991_mwtab.txt DATATRACK_ID:290 STUDY_ID:ST000191 ANALYSIS_ID:AN000293 PROJECT_ID:PR000162
VERSION             	1
CREATED_ON          	2016-09-17
#PROJECT
PR:PROJECT_TITLE                 	Neurogenic Hypertension
PR:PROJECT_SUMMARY               	Role of neuroinflammation and microbiome in drug-resistant hypertension
PR:INSTITUTE                     	University of Florida
PR:DEPARTMENT                    	Physiology & Functional Genomics
PR:LABORATORY                    	Raizada Lab
PR:LAST_NAME                     	Raizada
PR:FIRST_NAME                    	Mohan
PR:ADDRESS                       	Gainesville, FL
PR:EMAIL                         	mraizada@ufl.edu
PR:PHONE                         	352-392-9299
#STUDY
ST:STUDY_TITLE                   	SCFA in Hypertension
ST:STUDY_TYPE                    	Samples 4-34 are sera and feces from an experiment to determine the effects of
ST:STUDY_TYPE                    	on SCFA in Ang II-induced hypertension. Samples 35-59 are plasma samples fron
ST:STUDY_TYPE                    	experiment to determine the effects of ACE2 activator, DIZE on SCFA in
ST:STUDY_TYPE                    	pulmonary hypertension. Plasma samples were collected using heparin
ST:STUDY_SUMMARY                 	Samples 4-34 are sera and feces from an experiment to determine the effects of
ST:STUDY_SUMMARY                 	on SCFA in Ang II-induced hypertension. Samples 35-59 are plasma samples fron
ST:STUDY_SUMMARY                 	experiment to determine the effects of ACE2 activator, DIZE on SCFA in
ST:STUDY_SUMMARY                 	pulmonary hypertension. Plasma samples were collected using heparin
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@umich.edu
ST:PHONE                         	-
ST:NUM_GROUPS                    	7
ST:TOTAL_SUBJECTS                	56
#SUBJECT
SU:SUBJECT_TYPE                  	-
SU:SUBJECT_SPECIES               	Rattus norvegicus
SU:TAXONOMY_ID                   	10114
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015896	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015897	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015898	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015899	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015912	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015913	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015914	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015915	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015928	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015929	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015930	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015931	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015932	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004856	S00015933	Ang II:N | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004862	S00015946	Ang II:N | Mino:N | MCT:N | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004862	S00015947	Ang II:N | Mino:N | MCT:N | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004862	S00015948	Ang II:N | Mino:N | MCT:N | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004862	S00015949	Ang II:N | Mino:N | MCT:N | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004862	S00015950	Ang II:N | Mino:N | MCT:N | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004862	S00015951	Ang II:N | Mino:N | MCT:N | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004860	S00015934	Ang II:N | Mino:N | MCT:Y | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004860	S00015935	Ang II:N | Mino:N | MCT:Y | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004860	S00015936	Ang II:N | Mino:N | MCT:Y | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004860	S00015937	Ang II:N | Mino:N | MCT:Y | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004860	S00015938	Ang II:N | Mino:N | MCT:Y | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004860	S00015939	Ang II:N | Mino:N | MCT:Y | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004861	S00015940	Ang II:N | Mino:N | MCT:Y | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004861	S00015941	Ang II:N | Mino:N | MCT:Y | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004861	S00015942	Ang II:N | Mino:N | MCT:Y | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004861	S00015943	Ang II:N | Mino:N | MCT:Y | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004861	S00015944	Ang II:N | Mino:N | MCT:Y | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004861	S00015945	Ang II:N | Mino:N | MCT:Y | DIZE:Y	
SUBJECT_SAMPLE_FACTORS           	SU0004859	S00015908	Ang II:N | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004859	S00015909	Ang II:N | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004859	S00015910	Ang II:N | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004859	S00015911	Ang II:N | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004859	S00015924	Ang II:N | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004859	S00015925	Ang II:N | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004859	S00015926	Ang II:N | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004859	S00015927	Ang II:N | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004857	S00015900	Ang II:Y | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004857	S00015901	Ang II:Y | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004857	S00015902	Ang II:Y | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004857	S00015903	Ang II:Y | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004857	S00015916	Ang II:Y | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004857	S00015917	Ang II:Y | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004857	S00015918	Ang II:Y | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004857	S00015919	Ang II:Y | Mino:N | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004858	S00015904	Ang II:Y | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004858	S00015905	Ang II:Y | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004858	S00015906	Ang II:Y | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004858	S00015907	Ang II:Y | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004858	S00015920	Ang II:Y | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004858	S00015921	Ang II:Y | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004858	S00015922	Ang II:Y | Mino:Y | MCT:N | DIZE:N	
SUBJECT_SAMPLE_FACTORS           	SU0004858	S00015923	Ang II:Y | Mino:Y | MCT:N | DIZE:N	
#COLLECTION
CO:COLLECTION_SUMMARY            	-
CO:SAMPLE_TYPE                   	Serum
#TREATMENT
TR:TREATMENT_SUMMARY             	-
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	-
SP:SAMPLEPREP_PROTOCOL_FILENAME  	SCFA_analysis_protocol-2015-03-10.docx
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	GC
CH:INSTRUMENT_NAME               	-
CH:COLUMN_NAME                   	Phenomenex Zebron ZB-WAXplus (30m x 0.25mm, 0.25um)
CH:METHODS_ID                    	AQM030
CH:METHODS_FILENAME              	WAXPLUS_100-200C_2_SIM.txt
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:LABORATORY_NAME               	MRC2 (University of Michigan)
AN:ACQUISITION_PARAMETERS_FILE   	WAXPLUS_100-200C_2_SIM.txt
AN:PROCESSING_PARAMETERS_FILE    	EX00350-SCFA-Quant-methods-plasma.m.zip
#MS
MS:MS_COMMENTS                   	-
MS:INSTRUMENT_NAME               	Agilent 5975C
MS:INSTRUMENT_TYPE               	Single quadrupole
MS:MS_TYPE                       	EI
MS:ION_MODE                      	POSITIVE
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS         	pmol/mg sample
MS_METABOLITE_DATA_START
Samples	S00015912	S00015913	S00015914	S00015915	S00015924	S00015925	S00015926	S00015927	S00015916	S00015917	S00015918	S00015919	S00015920	S00015921	S00015922	S00015923
Factors	Ang II:N | Mino:N | MCT:N | DIZE:N	Ang II:N | Mino:N | MCT:N | DIZE:N	Ang II:N | Mino:N | MCT:N | DIZE:N	Ang II:N | Mino:N | MCT:N | DIZE:N	Ang II:N | Mino:Y | MCT:N | DIZE:N	Ang II:N | Mino:Y | MCT:N | DIZE:N	Ang II:N | Mino:Y | MCT:N | DIZE:N	Ang II:N | Mino:Y | MCT:N | DIZE:N	Ang II:Y | Mino:N | MCT:N | DIZE:N	Ang II:Y | Mino:N | MCT:N | DIZE:N	Ang II:Y | Mino:N | MCT:N | DIZE:N	Ang II:Y | Mino:N | MCT:N | DIZE:N	Ang II:Y | Mino:Y | MCT:N | DIZE:N	Ang II:Y | Mino:Y | MCT:N | DIZE:N	Ang II:Y | Mino:Y | MCT:N | DIZE:N	Ang II:Y | Mino:Y | MCT:N | DIZE:N
aceticacid	9670.4680	27676.4560	10650.6960	12842.0180	6834.3830	3483.8260	135.7560	551.9060	9281.4160	9142.5730	16704.1060	7789.5520	9440.9310	7754.2400	10059.1710	14831.4040
butyricacid	9147.4690	9043.4340	17616.4000	21983.3100	4670.5050	18116.9990	2905.5530	1475.3960	16392.4080	5807.7600	9913.1420	12044.0480	1802.1990	8620.9060	11003.2970	10452.5680
hexanoicacid	21.8680	21.6780	22.7170	1420.2370	14.7520	15.5250	10.8720	5.8760	50.0710	19.5920	425.9030	21.0250	0.0000	20.2700	39.8100	23.9030
iso-butyricacid	533.6300	300.6870	467.5590	807.1930	400.0370	786.3830	215.5700	157.8210	443.0000	449.6510	495.6440	264.0620	55.5200	272.9260	723.5280	758.1930
isovalericacid	615.4020	196.1300	486.1400	763.8810	379.5920	674.7490	221.3150	143.7320	351.7400	380.2220	231.5830	264.2630	58.4280	272.2000	510.5560	697.8440
propionic acid	3431.9930	5560.5580	4874.8990	4072.0130	3724.2510	7094.9150	3371.1580	3474.9910	3788.1600	2035.7540	5337.4930	1990.9590	2682.4610	3069.4800	3820.8580	4101.4260
valericacid	1748.2140	370.6530	1534.3530	1808.3970	993.1450	2747.0810	726.0250	185.1560	475.4910	959.9700	889.0730	1169.0280	421.7970	1129.5980	1109.5650	1907.0970
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
aceticacid				176			Acetate	UM_Target_ID
butyricacid				20975673			Butyrate	UM_Target_ID
hexanoicacid				8892			Hexanoate	UM_Target_ID
iso-butyricacid				6590			iso-butyrate	UM_Target_ID
isovalericacid				10430			Isovalerate	UM_Target_ID
propionic acid				1032			Propionate	UM_Target_ID
valericacid				7991			Valerate	UM_Target_ID
METABOLITES_END
#END