#METABOLOMICS WORKBENCH Tennouji_20150714_9274021_mwtab.txt DATATRACK_ID:353 STUDY_ID:ST000231 ANALYSIS_ID:AN000346 PROJECT_ID:PR000186
VERSION             	1
CREATED_ON          	2016-09-17
#PROJECT
PR:PROJECT_TITLE                 	Comprehensive analysis of transcriptome and metabolome analysis in Intrahepatic
PR:PROJECT_TITLE                 	and Hepatocellular Carcinoma
PR:PROJECT_TYPE                  	Population Genetics for comparison between cholangiocarcinoma and
PR:PROJECT_TYPE                  	carcinoma
PR:PROJECT_SUMMARY               	Intrahepatic cholangiocarcinoma (ICC) and hepatocellular carcinoma (HCC) are
PR:PROJECT_SUMMARY               	originated malignant tumors. The prognosis of ICC is generally worse than that
PR:PROJECT_SUMMARY               	HCC because there is lack of early diagnostic marker for ICC and the
PR:PROJECT_SUMMARY               	mechanism of ICC is not fully understood. So our aim was to perform metabolome
PR:PROJECT_SUMMARY               	transcriptome analysis to reveal the carcinogenetic mechanism and to detect an
PR:PROJECT_SUMMARY               	diagnostic marker for ICC Ten ICC and 6 HCC which were resected surgically,
PR:PROJECT_SUMMARY               	enrolled. miRNA and mRNA expression analysis were performed by microarray on
PR:PROJECT_SUMMARY               	and HCC and their corresponding non-tumor tissues (ICC_NT and HCC_NT). Compound
PR:PROJECT_SUMMARY               	was performed using capillary electrophoresis time-of-flight mass spectrometry
PR:PROJECT_SUMMARY               	Principle component analysis (PCA) revealed that our four sample groups
PR:PROJECT_SUMMARY               	ICC_NT, HCC, and HCC_NT) have 14 compounds, 62 mRNAs and 17 miRNAs with
PR:PROJECT_SUMMARY               	expressive patterns. There were two distinct patterns among the 4 groups; one
PR:PROJECT_SUMMARY               	tumor and non-tumor, the other is ICC and non-ICC. To clarify the biological
PR:PROJECT_SUMMARY               	of individual genes and compounds, we performed pathway analysis. ICC formation
PR:PROJECT_SUMMARY               	related to RNA synthesis, amino acid synthesis, and glucose-lipid synthesis
PR:PROJECT_SUMMARY               	ICC was classified by distinct pattern of compounds with high accuracy
PR:PROJECT_SUMMARY               	PCA revealed that several pathways were associated with the development of
PR:PROJECT_SUMMARY               	and distinguished ICC from other diseases. These findings are a promising step
PR:PROJECT_SUMMARY               	establishing novel biomarkers that can be clinically applicable.
PR:INSTITUTE                     	Osaka City University
PR:DEPARTMENT                    	Department of Hepatology
PR:LAST_NAME                     	Murakami
PR:FIRST_NAME                    	Yoshiki
PR:ADDRESS                       	1-4-3, asahimachi, Abeno-ku, Osaka 545-8585, Osaka Japan
PR:EMAIL                         	m2079633@med.osaka-cu.ac.jp
PR:PHONE                         	81-6-6645-3811
#STUDY
ST:STUDY_TITLE                   	Comprehensive analysis of transcriptome and metabolome in Intrahepatic
ST:STUDY_TITLE                   	and Hepatocellular Carcinoma (part II)
ST:STUDY_TYPE                    	tissue type comparison
ST:STUDY_SUMMARY                 	Cholangiocarcinoma tissue, surrounded non-tumor tissue, Hepatocellular
ST:STUDY_SUMMARY                 	tissue, and surrounded non-tumor tissue were compared via metabolomic analysis.
ST:INSTITUTE                     	Osaka City University
ST:DEPARTMENT                    	Department of Hepatology
ST:LAST_NAME                     	Murakami
ST:FIRST_NAME                    	Yoshiki
ST:ADDRESS                       	1-4-3, asahimachi, Abeno-ku, Osaka 545-8585, Osaka Japan
ST:EMAIL                         	m2079633@med.osaka-cu.ac.jp
ST:PHONE                         	81-6-6645-3811
ST:NUM_GROUPS                    	2
ST:TOTAL_SUBJECTS                	9 samples
#SUBJECT
SU:SUBJECT_TYPE                  	human tissue
SU:SUBJECT_SPECIES               	Homo sapiens
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	-	1	Tissue Type:ICC (Intrahepatic cholangiocarcinoma)	
SUBJECT_SAMPLE_FACTORS           	-	25	Tissue Type:ICC (Intrahepatic cholangiocarcinoma)	
SUBJECT_SAMPLE_FACTORS           	-	27	Tissue Type:ICC (Intrahepatic cholangiocarcinoma)	
SUBJECT_SAMPLE_FACTORS           	-	29	Tissue Type:ICC (Intrahepatic cholangiocarcinoma)	
SUBJECT_SAMPLE_FACTORS           	-	31	Tissue Type:ICC (Intrahepatic cholangiocarcinoma)	
SUBJECT_SAMPLE_FACTORS           	-	26	Tissue Type:ICC-NT (surrounded non tumor of ICC)	
SUBJECT_SAMPLE_FACTORS           	-	28	Tissue Type:ICC-NT (surrounded non tumor of ICC)	
SUBJECT_SAMPLE_FACTORS           	-	30	Tissue Type:ICC-NT (surrounded non tumor of ICC)	
SUBJECT_SAMPLE_FACTORS           	-	32	Tissue Type:ICC-NT (surrounded non tumor of ICC)	
#COLLECTION
CO:COLLECTION_SUMMARY            	-
#TREATMENT
TR:TREATMENT_SUMMARY             	-
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	-
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	-
CH:INSTRUMENT_NAME               	-
CH:COLUMN_NAME                   	-
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:MS_COMMENTS                   	-
MS:INSTRUMENT_NAME               	Agilent 6220 TOF
MS:INSTRUMENT_TYPE               	TOF
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	POSITIVE
MS:TUBE_LENS_VOLTAGE             	CATION (POSITIVE)
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS         	Peak area
MS_METABOLITE_DATA_START
Samples	1	25	27	29	31	26	28	30	32
Factors	Tissue Type:ICC (Intrahepatic cholangiocarcinoma)	Tissue Type:ICC (Intrahepatic cholangiocarcinoma)	Tissue Type:ICC (Intrahepatic cholangiocarcinoma)	Tissue Type:ICC (Intrahepatic cholangiocarcinoma)	Tissue Type:ICC (Intrahepatic cholangiocarcinoma)	Tissue Type:ICC-NT (surrounded non tumor of ICC)	Tissue Type:ICC-NT (surrounded non tumor of ICC)	Tissue Type:ICC-NT (surrounded non tumor of ICC)	Tissue Type:ICC-NT (surrounded non tumor of ICC)
1-(5^-Phosphoribosyl)-5-amino-4-(N-succinocarboxamide)-imidazole(-9.33)/	0.0002	0.0000	0.0001	0.0000		0.0000	0.0000		0.0000
1-Aminocyclopentanecarboxylate(2.94)/ N4-Acetylaminobutanal(2.94)/ Vigabatrin(2.94)/ (+)-TACP(2.94)/	0.0006	0.0007	0.0010	0.0012		0.0014	0.0009	0.0009	0.0015
1-Methyl-2-pyrrolidone		0.0014	0.0027	0.0054		0.0028	0.0018	0.0053	
1-Methyl-4-imidazoleacetic acid	0.0003	0.0003	0.0002			0.0004	0.0001		0.0004
1-Methyladenosine	0.0002	0.0001	0.0006	0.0003	0.0002	0.0002	0.0002	0.0003	0.0002
1-Methylhistamine	0.0005	0.0001	0.0007	0.0000	0.0003	0.0002	0.0002	0.0001	0.0001
1-Methylhistidine	0.0049	0.0030	0.0013	0.0011	0.0014	0.0051	0.0016	0.0009	0.0019
1-Methylnicotinamide	0.0077	0.0042	0.0053	0.0048	0.0111	0.0036	0.0052	0.0033	0.0020
2-Aminoadipic acid	0.0014	0.0021	0.0019	0.0006	0.0019	0.0048	0.0015	0.0014	0.0008
2-Aminobutyric acid	0.0321	0.0210	0.0105	0.0094	0.0157	0.0348	0.0229	0.0167	0.0321
2-Methylserine	0.0001					0.0001	0.0001		0.0001
2-Phenylethylamine	0.0004								
3-Aminoisobutyric acid	0.0071	0.0130	0.0018	0.0008	0.0045	0.0178	0.0082	0.0066	0.0101
4-Aminobenzoate(2.48)/ 4-Nitrotoluene(2.48)/	0.0003	0.0005	0.0002			0.0008	0.0007		0.0005
5;6-Dihydrothymine(2.49)/ gamma-Amino-gamma-cyanobutanoate(2.49)/ alpha-Amino-gamma-cyanobutanoate(2.49)/		0.0005	0.0001			0.0008	0.0007		0.0003
5;6-Dihydrothymine(2.73)/ gamma-Amino-gamma-cyanobutanoate(2.73)/ alpha-Amino-gamma-cyanobutanoate(2.73)/	0.0015	0.0064	0.0007	0.0004		0.0096	0.0047	0.0015	0.0059
5-Aminovaleric acid	0.0006	0.0007	0.0004			0.0012	0.0003	0.0004	0.0006
5^-Deoxy-5^-methylthioadenosine	0.0001	0.0001	0.0001	0.0000		0.0002	0.0000		0.0001
5-Hydroxylysine	0.0004	0.0002	0.0008	0.0004	0.0009	0.0002	0.0002	0.0003	0.0001
Acetylcysteine(-2.02)/	0.0005	0.0008	0.0010	0.0003		0.0007	0.0005	0.0008	0.0009
Acetylcysteine(4.29)/	0.0003		0.0004	0.0002		0.0004	0.0002		0.0009
Adenine	0.0007	0.0012	0.0012	0.0002	0.0020	0.0017	0.0012	0.0006	0.0006
Adenosine	0.0323	0.0227	0.0056	0.0096	0.0161	0.0361	0.0504	0.0093	0.0280
ADMA	0.0004	0.0002	0.0015	0.0002	0.0008	0.0002	0.0002	0.0002	0.0003
Ala	0.0098	0.0092	0.0068	0.0040	0.0104	0.0148	0.0148	0.0106	0.0153
Ala-Ala	0.0051	0.0023	0.0014	0.0044	0.0048	0.0036	0.0026	0.0035	0.0028
Ala-Arg/Arg-Ala	0.0005	0.0002	0.0003	0.0002	0.0006	0.0004			0.0003
Ala-Asn/Asn-Ala/Gly-Gln	0.0006	0.0004	0.0002	0.0002		0.0007	0.0004	0.0004	0.0005
Ala-Asp/Asp-Ala	0.0006	0.0002	0.0004	0.0003	0.0013	0.0003	0.0003	0.0005	0.0002
Ala-Gly/Gly-Ala	0.0018	0.0007	0.0013	0.0012	0.0035	0.0009	0.0011	0.0020	0.0008
Ala-Met	0.0002	0.0002	0.0002	0.0002		0.0002	0.0002	0.0002	0.0002
Ala-Ser/Thr-Gly	0.0025	0.0016	0.0012	0.0056	0.0036	0.0024	0.0017	0.0028	0.0018
Ala-Thr/Thr-Ala	0.0018	0.0020	0.0011	0.0010	0.0024	0.0038	0.0022	0.0021	0.0025
Ala-Tyr/Phe-Ser/Tyr-Ala	0.0016	0.0014	0.0016	0.0008	0.0024	0.0018	0.0018	0.0026	0.0013
Anthranilic acid			0.0001						
Arg	0.0074	0.0027	0.0658	0.0337	0.0652	0.0017	0.0023	0.0044	0.0014
Arg-Asn/Asn-Arg	0.0003	0.0001	0.0001	0.0001	0.0006	0.0002	0.0002	0.0002	0.0001
Arg-Gln	0.0002	0.0001	0.0001	0.0001		0.0002	0.0001		0.0002
Arg-Glu/Glu-Arg	0.0002	0.0002	0.0001	0.0001	0.0007	0.0003	0.0002	0.0002	0.0002
Arg-Gly/Gly-Arg	0.0004	0.0004	0.0002	0.0002		0.0008	0.0005	0.0005	0.0005
Arg-Ile/Arg-Leu/Leu-Arg	0.0006	0.0005	0.0004	0.0003	0.0012	0.0009	0.0006	0.0005	0.0006
Argininosuccinic acid	0.0003	0.0002	0.0002	0.0001	0.0003	0.0003	0.0002	0.0001	0.0004
Arg-Ser/Ser-Arg	0.0010	0.0004	0.0003	0.0003	0.0013	0.0007	0.0006	0.0006	0.0006
Arg-Thr	0.0005	0.0003	0.0002	0.0004	0.0006	0.0005	0.0003	0.0005	0.0004
Arg-Tyr/Tyr-Arg	0.0008	0.0006	0.0006	0.0004	0.0007	0.0013	0.0011	0.0020	0.0009
Arg-Val	0.0001	0.0001	0.0001	0.0001	0.0004	0.0002	0.0001	0.0002	0.0001
Asn	0.0361	0.0347	0.0398	0.0155	0.0408	0.0554	0.0406	0.0315	0.0367
Asn-Glu	0.0001	0.0001	0.0000	0.0000	0.0003	0.0001	0.0001	0.0001	0.0001
Asn-Ile/Asn-Leu/Ile-Asn/Leu-Asn/Val-Gln	0.0022	0.0008	0.0010	0.0023	0.0035	0.0013	0.0012	0.0012	0.0009
Asn-Lys/Lys-Asn	0.0002	0.0001	0.0002	0.0000		0.0001	0.0001	0.0001	0.0002
Asn-Thr/Ser-Gln/Thr-Asn	0.0015	0.0019	0.0005	0.0014	0.0022	0.0033	0.0016	0.0016	0.0026
Asn-Val/Val-Asn	0.0005	0.0003	0.0002	0.0002	0.0009	0.0004	0.0004	0.0004	0.0003
Asp	0.0856	0.0597	0.1005	0.0123	0.1782	0.0964	0.0896	0.0417	0.1069
Asp-Lys	0.0003	0.0002	0.0003	0.0001	0.0010	0.0003	0.0002	0.0003	0.0001
Betaine	0.0049	0.0058	0.0027	0.0023	0.0046	0.0084	0.0077	0.0048	0.0063
Betaine aldehyde_+H2O	0.0008	0.0004	0.0004	0.0001		0.0005	0.0016	0.0010	0.0013
Carnitine	0.0089	0.0119	0.0038	0.0058	0.0050	0.0180	0.0156	0.0059	0.0123
Carnosine	0.0016	0.0001	0.0005	0.0028		0.0001	0.0001	0.0001	0.0001
Choline	0.0072	0.0043	0.0069	0.0036	0.0110	0.0065	0.0125	0.0139	0.0106
Citrulline	0.0054	0.0020	0.0186	0.0033	0.0062	0.0032	0.0025	0.0032	0.0053
Creatine	0.0130	0.0195	0.0074	0.0082	0.0074	0.0312	0.0139	0.0057	0.0189
Creatinine	0.0125	0.0110	0.0158	0.0109	0.0150	0.0167	0.0146	0.0096	0.0109
Cys	0.0034	0.0124	0.0031		0.0226	0.0131	0.0175	0.0367	0.0416
Cystathionine	0.0028	0.0037	0.0007		0.0010	0.0056	0.0038	0.0025	0.0071
Cysteine glutathione disulfide	0.0148	0.0021	0.0082	0.0065	0.0118	0.0037	0.0033	0.0073	0.0122
Cystine	0.0026	0.0001	0.0006	0.0016	0.0070	0.0001	0.0002	0.0016	0.0008
Cytidine	0.0018	0.0007	0.0017	0.0010	0.0027	0.0011	0.0008	0.0007	0.0011
Cytosine	0.0001	0.0001	0.0002	0.0000		0.0001	0.0001	0.0001	0.0001
Deoxyguanosine(6.88)/ Neuraminic acid(1.64)/ Zidovudine(6.88)/ Miserotoxin(1.64)/	0.0005	0.0001	0.0004	0.0004	0.0005	0.0001	0.0002	0.0002	0.0002
Dyphylline	0.0035	0.0078	0.0024	0.0006	0.0313	0.0061	0.0092	0.0104	0.0061
Ephedrine(-0.54)/ (+)-Pseudoephedrine(-0.54)/ Hordenine(-0.54)/ Anatoxin a(-0.54)/	0.0018		0.0005	0.0003			0.0005	0.0009	
Ephedrine(6.84)/ (+)-Pseudoephedrine(6.84)/ Hordenine(6.84)/ Anatoxin a(6.84)/	0.0002	0.0002	0.0002	0.0001		0.0003	0.0002	0.0002	0.0001
Ergothioneine	0.0016	0.0145	0.0068	0.0093	0.0107	0.0284	0.0067	0.0206	0.0131
Ethanolamine	0.0344	0.0157	0.0367	0.0243	0.0764	0.0182	0.0306	0.0418	0.0423
GABA	0.0021	0.0066	0.0052	0.0023	0.0032	0.0060	0.0012	0.0043	0.0031
Gln	0.0125	0.0149	0.0065	0.0061	0.0165	0.0229	0.0135	0.0119	0.0150
Gln-Thr/Thr-Gln	0.0003	0.0002	0.0002	0.0004		0.0003	0.0002	0.0003	0.0002
Glu	0.0326	0.0125	0.0250	0.0077	0.0394	0.0172	0.0178	0.0178	0.0166
Gluconolactone	0.0008	0.0026	0.0004	0.0003		0.0033	0.0010	0.0014	0.0016
Glucosamine		0.0002	0.0005			0.0004	0.0003		0.0003
Glu-Glu	0.0002	0.0001	0.0002	0.0001	0.0010	0.0001	0.0001	0.0001	0.0001
Glu-Ile/Glu-Leu/Ile-Glu/Leu-Glu	0.0018	0.0011	0.0014	0.0016	0.0049	0.0015	0.0014	0.0017	0.0010
Glu-Lys/Lys-Glu	0.0005	0.0003	0.0005	0.0005	0.0030	0.0005	0.0004	0.0004	0.0003
Glu-Ser	0.0012	0.0010	0.0011	0.0011	0.0034	0.0011	0.0012	0.0012	0.0006
Glutathione (GSH)	0.0014	0.0371	0.0030		0.0198	0.0478	0.0445	0.0147	0.0325
Glutathione (GSSG)_divalent	0.1183	0.0784	0.0927	0.0349	0.0117	0.1590	0.0966	0.0423	0.1139
Glu-Tyr/Tyr-Glu	0.0003	0.0002	0.0002	0.0001	0.0007	0.0003	0.0003	0.0003	0.0002
Gly	0.0044	0.0031	0.0038	0.0020	0.0053	0.0042	0.0040	0.0041	0.0041
Gly-Asn	0.0004	0.0002	0.0001	0.0001	0.0007	0.0003	0.0002	0.0002	0.0002
Glycerophosphocholine	0.1439	0.3981	0.0977	0.0069	0.0604	0.4468	0.4715	0.1753	0.4346
Gly-Gly	0.0010	0.0008	0.0013	0.0008	0.0017	0.0010	0.0009	0.0010	0.0008
Gly-His/His-Gly	0.0002	0.0002	0.0003	0.0001		0.0003	0.0002	0.0003	0.0002
Gly-Ile/Gly-Leu	0.0151	0.0066	0.0108	0.0488	0.0172	0.0096	0.0094	0.0282	0.0066
Gly-Lys/Lys-Gly	0.0021	0.0010	0.0013	0.0006	0.0027	0.0017	0.0016	0.0016	0.0015
Gly-Met/Met-Gly	0.0004	0.0003	0.0003	0.0002	0.0006	0.0005	0.0004	0.0003	0.0003
Gly-Val	0.0004	0.0002	0.0003	0.0003	0.0016	0.0003	0.0002	0.0003	0.0002
Guanidinosuccinic acid	0.0008	0.0093	0.0004	0.0000	0.0006	0.0183	0.0045	0.0009	0.0110
Guanidoacetic acid	0.0011	0.0010	0.0094	0.0250	0.0017	0.0013	0.0005	0.0007	0.0015
Guanine	0.0004	0.0002	0.0030	0.0001	0.0017	0.0003	0.0003	0.0002	0.0003
Guanosine	0.0068	0.0013	0.0040	0.0024	0.0041	0.0018	0.0034	0.0016	0.0019
His	0.0038	0.0051	0.0033	0.0019	0.0054	0.0081	0.0053	0.0036	0.0060
Histamine	0.0095	0.0034	0.0393	0.0034	0.0430	0.0022	0.0088	0.0027	0.0028
His-Thr/Thr-His	0.0003	0.0005	0.0002	0.0001		0.0007	0.0005	0.0003	0.0006
Homoserine	0.0002		0.0002	0.0001					
Homoserinelactone	0.0002	0.0005	0.0002	0.0001		0.0008	0.0002	0.0001	0.0002
Homospermidine(3.14)/ Aminopropylcadaverine(3.14)/	0.0001	0.0012	0.0001	0.0000	0.0007	0.0009	0.0007	0.0020	0.0010
Hydroxyproline	0.0078	0.0013	0.0042	0.0052	0.0049	0.0028	0.0030	0.0016	0.0037
Hypotaurine	0.0120	0.0044	0.0117	0.0043	0.0064	0.0056	0.0052	0.0024	0.0033
Hypoxanthine	0.0471	0.0269	0.0965	0.0485	0.0528	0.0162	0.0230	0.0412	0.0318
Ile	0.0042	0.0040	0.0074	0.0043	0.0109	0.0051	0.0035	0.0044	0.0028
Ile-Ala	0.0003	0.0003	0.0005	0.0004		0.0005	0.0003	0.0002	0.0005
Ile-Arg_divalent	0.0014	0.0008	0.0008	0.0008	0.0019	0.0015	0.0011	0.0013	0.0011
Ile-Asp/Leu-Asp	0.0005	0.0003	0.0004	0.0003	0.0023	0.0002	0.0004	0.0005	0.0001
Ile-Gln/Leu-Gln	0.0016	0.0009	0.0010	0.0019	0.0028	0.0015	0.0011	0.0014	0.0011
Ile-Lys/Lys-Ile/Lys-Leu/Leu-Lys	0.0015	0.0016	0.0010	0.0010	0.0030	0.0026	0.0019	0.0018	0.0016
Ile-Ser/Ser-Ile/Ser-Leu/Thr-Val/Val-Thr	0.0070	0.0056	0.0041	0.0043	0.0118	0.0093	0.0068	0.0073	0.0067
Ile-Thr/Thr-Ile/Thr-Leu	0.0028	0.0019	0.0031	0.0032	0.0063	0.0023	0.0021	0.0030	0.0014
Ile-Val	0.0080	0.0125	0.0109	0.0049	0.0090	0.0200	0.0101	0.0213	0.0146
Imidazolelactic acid		0.0001	0.0001	0.0000		0.0001	0.0002	0.0001	0.0001
Inosine	0.0540	0.0269	0.0148	0.0075	0.0228	0.0232	0.0506	0.0172	0.0287
Isobutyrylcarnitine/Butyrylcarnitine	0.0038	0.0056	0.0048	0.0094	0.0047	0.0074	0.0086	0.0048	0.0117
Isovalerylcarnitine	0.0010	0.0015	0.0008	0.0005		0.0017	0.0011	0.0008	0.0076
Kynurenine	0.0019	0.0005	0.0027	0.0005	0.0032	0.0005	0.0009	0.0008	0.0008
Leu	0.0114	0.0089	0.0171	0.0089	0.0222	0.0119	0.0090	0.0110	0.0076
Leu-Ala	0.0086	0.0042	0.0063	0.0173	0.0151	0.0062	0.0054	0.0102	0.0033
Leu-His	0.0004	0.0004	0.0003	0.0002	0.0007	0.0005	0.0004	0.0005	0.0003
Leu-Ile/Leu-Leu	0.0031	0.0033	0.0037	0.0031	0.0060	0.0044	0.0034	0.0041	0.0033
Leu-Phe	0.0019	0.0036	0.0012	0.0009		0.0058	0.0026	0.0036	0.0034
Lidocaine	0.0027	0.0012	0.0019	0.0052	0.0062	0.0014	0.0010	0.0019	0.0009
L-Norleucine(4.42)/ 6-Aminohexanoate(4.42)/ (3R)-beta-Leucine(4.42)/ beta-Alaninebetaine(4.42)/ N;N-Diethylglycine(4.42)/	0.0005	0.0037	0.0004	0.0009		0.0053	0.0027	0.0132	0.0027
L-Norleucine(5.11)/ 6-Aminohexanoate(5.11)/ (3R)-beta-Leucine(5.11)/ beta-Alaninebetaine(5.11)/ N;N-Diethylglycine(5.11)/	0.0021	0.0039	0.0003	0.0006		0.0057	0.0007	0.0026	0.0066
Lys	0.0045	0.0034	0.0089	0.0033	0.0082	0.0050	0.0050	0.0052	0.0048
Lys-Ala	0.0011	0.0010	0.0005	0.0004	0.0018	0.0018	0.0012	0.0016	0.0014
Lys-Gln	0.0005	0.0002	0.0002	0.0002	0.0008	0.0004	0.0003	0.0003	0.0004
Lys-Phe/Phe-Lys	0.0004	0.0005	0.0003	0.0002	0.0008	0.0007	0.0004	0.0005	0.0005
Lys-Ser/Ser-Lys	0.0022	0.0014	0.0013	0.0009	0.0028	0.0027	0.0020	0.0026	0.0022
Lys-Tyr/Tyr-Lys	0.0007	0.0003	0.0004	0.0003	0.0010	0.0005	0.0004	0.0006	0.0003
Lys-Val	0.0008	0.0005	0.0004	0.0004	0.0011	0.0009	0.0007	0.0009	0.0005
Malonylcarnitine	0.0001	0.0002		0.0000		0.0003	0.0001	0.0001	0.0002
Met	0.0142	0.0065	0.0391	0.0160	0.0295	0.0087	0.0079	0.0140	0.0069
Met-Gln	0.0002	0.0003	0.0002	0.0001	0.0002	0.0006	0.0003	0.0003	0.0004
Methionine sulfoxide	0.0006	0.0003	0.0010	0.0006	0.0026	0.0005	0.0003	0.0005	0.0002
Methyldopa anhydrous(-3.07)/ Enicoflavine(-3.07)/		0.0001				0.0002	0.0001		0.0000
Metronidazole	0.0001	0.0001				0.0003	0.0001		0.0002
Met-Thr		0.0001		0.0001		0.0002			0.0002
N1-Methyl-4-pyridone-5-carboxamide		0.0004	0.0003	0.0001		0.0008	0.0007	0.0007	0.0014
N5-Ethylglutamine	0.0002	0.0001	0.0002	0.0002		0.0002	0.0002		0.0002
N6-Acetyllysine		0.0002	0.0007	0.0001		0.0003		0.0002	0.0001
N6-Methyllysine	0.0008	0.0034	0.0006	0.0003	0.0005	0.0058	0.0006	0.0004	0.0005
N8-Acetylspermidine	0.0097	0.0020	0.0060	0.0033	0.0071	0.0030	0.0039	0.0031	0.0041
N-Acetylgalactosamine	0.0010	0.0012	0.0059	0.0038	0.0058	0.0013	0.0014	0.0042	0.0012
N-Acetylhistidine		0.0001	0.0001			0.0001	0.0001		0.0002
N-Acetyl-L-citrulline(1.98)/	0.0007	0.0010	0.0003	0.0004	0.0011	0.0015	0.0009	0.0010	0.0011
N-(Acetyloxy)benzenamine(5.75)/ N-Methylanthranilate(5.75)		0.0001				0.0002	0.0001		0.0001
N-Ethylglycine	0.0004	0.0009		0.0001		0.0013	0.0003	0.0009	0.0017
Nicotinamide	0.0350	0.0366	0.0302	0.0070	0.0373	0.0470	0.0442	0.0452	0.0477
NMN	0.0002	0.0003	0.0000	0.0002		0.0005	0.0004	0.0003	0.0004
N;N-Dimethylglycine	0.0036	0.0044	0.0009	0.0009	0.0027	0.0057	0.0046	0.0026	0.0088
Noradrenaline		0.0012	0.0001			0.0019	0.0008	0.0004	0.0006
O-Acetylcarnitine	0.0572	0.0197	0.0356	0.0711	0.0539	0.0220	0.0315	0.0371	0.0406
Octanoylcarnitine	0.0004	0.0002	0.0002	0.0004		0.0003	0.0002	0.0002	0.0004
Ophthalmic acid	0.0135	0.0135	0.0011	0.0007	0.0018	0.0185	0.0089	0.0048	0.0117
Ornithine	0.0474	0.0313	0.0261	0.0114	0.0320	0.0385	0.0558	0.0549	0.0259
Pantetheine 4^-phosphate(-1.53)/	0.0002	0.0002	0.0001	0.0000		0.0003	0.0003	0.0001	0.0003
Phe	0.0644	0.0524	0.1127	0.0516	0.1019	0.0834	0.0427	0.0540	0.0524
Phe-Arg_divalent	0.0003	0.0003	0.0001	0.0001	0.0003	0.0006	0.0002	0.0003	0.0004
Phe-Asn	0.0007	0.0006	0.0015	0.0007	0.0012	0.0009	0.0010	0.0012	0.0007
Phe-Gln	0.0007	0.0010	0.0004	0.0005	0.0010	0.0016	0.0010	0.0012	0.0010
Phe-Thr	0.0014	0.0039	0.0010	0.0006	0.0013	0.0044	0.0024	0.0029	0.0026
Phe-Val	0.0007	0.0010	0.0006	0.0005	0.0011	0.0013	0.0009	0.0009	0.0008
Phosphorylcholine	0.1110	0.0769	0.1661	0.0910	0.0409	0.1171	0.0786	0.0613	0.0882
Pipecolic acid	0.0013	0.0008	0.0004	0.0005		0.0017	0.0021	0.0011	0.0023
Prenyl-L-cysteine(6.29)/	0.0002		0.0003			0.0002	0.0001	0.0002	0.0001
Pro	0.0168	0.0038	0.0073	0.0054	0.0119	0.0062	0.0057	0.0049	0.0056
Pro-Ala	0.0002	0.0003		0.0002		0.0004	0.0002	0.0003	
Pro-Arg_divalent	0.0001	0.0001	0.0001	0.0000	0.0002	0.0002	0.0001	0.0002	0.0001
Pro-Ser		0.0002	0.0004	0.0002		0.0003			0.0002
Pro-Val	0.0004	0.0004	0.0005			0.0006		0.0005	0.0003
Putrescine	0.0095	0.0057	0.0034	0.0020	0.0059	0.0076	0.0089	0.0045	0.0079
Pyridoxamine 5^-phosphate	0.0006	0.0018	0.0002	0.0000		0.0025	0.0021	0.0017	0.0023
(R)-1-Aminopropan-2-ol(-4.26)/ 1-Aminopropan-2-ol(-4.26)/	0.0003	0.0007	0.0003	0.0002	0.0009	0.0006	0.0004	0.0007	0.0009
Ranitidine			0.0007				0.0001		
Saccharopine	0.0003	0.0004	0.0001	0.0000		0.0007	0.0002	0.0002	0.0002
S-Adenosylhomocysteine	0.0010	0.0017	0.0005	0.0001	0.0004	0.0021	0.0014	0.0006	0.0027
S-Adenosylmethionine	0.0011	0.0025	0.0011	0.0005	0.0016	0.0048	0.0012	0.0004	0.0011
Sarcosine	0.0023	0.0032	0.0008	0.0006	0.0019	0.0050	0.0047	0.0022	0.0050
SDMA	0.0004	0.0007	0.0005	0.0002		0.0012	0.0005	0.0003	0.0009
Ser	0.0697	0.0311	0.0911	0.0286	0.0849	0.0698	0.0630	0.0309	0.0877
Ser-Asn	0.0007	0.0003	0.0002	0.0003	0.0009	0.0005	0.0004	0.0005	0.0004
Ser-Gly/Gly-Ser	0.0012	0.0010	0.0008	0.0006	0.0017	0.0013	0.0010	0.0013	0.0009
Ser-His	0.0004	0.0002	0.0003	0.0002	0.0008	0.0004	0.0003	0.0004	0.0003
Ser-Ser	0.0011	0.0010	0.0006	0.0007	0.0016	0.0015	0.0012	0.0011	0.0010
Ser-Thr	0.0015	0.0010	0.0008	0.0008	0.0024	0.0015	0.0013	0.0014	0.0012
S-Methylglutathione	0.0019	0.0041	0.0003	0.0000	0.0006	0.0080	0.0058	0.0011	0.0046
Spermidine	0.0033	0.0118	0.0068	0.0008	0.0669	0.0072	0.0075	0.0114	0.0059
Spermine	0.0001	0.0012	0.0001	0.0001	0.0222	0.0010	0.0010	0.0028	0.0011
Stachydrine	0.0029	0.0007	0.0023	0.0034		0.0011	0.0037	0.0036	0.0022
Taurine	0.0687	0.0156	0.0615	0.0629	0.2823	0.0141	0.0363	0.0335	0.0132
Thiamine	0.0001	0.0003	0.0001	0.0000	0.0002	0.0003	0.0002	0.0002	0.0002
Thiaproline	0.0251	0.0203	0.0093	0.0034		0.0107	0.0086	0.0119	0.0187
Thr	0.0991	0.0618	0.1051	0.0677	0.0962	0.0910	0.0591	0.0673	0.0638
Thr-Asp/Asp-Thr/Ser-Glu	0.0003	0.0001	0.0001	0.0002		0.0002	0.0002	0.0002	0.0002
Thr-Glu	0.0003	0.0003	0.0003	0.0002	0.0010	0.0004	0.0003	0.0003	0.0003
Thr-Lys	0.0011	0.0005	0.0006	0.0004	0.0018	0.0007	0.0006	0.0007	0.0006
Thr-Thr	0.0005	0.0003	0.0003	0.0004	0.0008	0.0005	0.0005	0.0005	0.0004
Thr-Tyr/Tyr-Thr	0.0006	0.0015	0.0006	0.0003	0.0006	0.0020	0.0010	0.0011	0.0010
Thymidine				0.0001	0.0018		0.0003	0.0003	0.0001
Thymine	0.0124	0.0325	0.0050	0.0021	0.0352	0.0297	0.0181	0.0174	0.0180
trans-Glutaconic acid	0.0004	0.0002	0.0006	0.0003		0.0003			0.0004
Trigonelline	0.0002	0.0056	0.0003	0.0001		0.0081	0.0010	0.0001	0.0004
Trimethylamine		0.0002			0.0017				
Trimethylamine N-oxide	0.0014	0.0001	0.0014	0.0020	0.0018	0.0002	0.0008	0.0009	0.0008
Trp	0.0089	0.0091	0.0166	0.0108	0.0146	0.0129	0.0087	0.0106	0.0054
Tyr	0.0306	0.0209	0.0616	0.0280	0.0395	0.0357	0.0211	0.0255	0.0230
Tyramine			0.0001			0.0000			0.0000
Tyr-Arg_divalent	0.0011	0.0008	0.0007	0.0004	0.0005	0.0017	0.0014	0.0040	0.0011
Tyr-Gln	0.0008	0.0007	0.0005	0.0008	0.0015	0.0010	0.0009	0.0010	0.0006
Tyr-Gly	0.0004	0.0002	0.0003	0.0002		0.0003	0.0003	0.0004	0.0002
Tyr-His	0.0009	0.0007	0.0005	0.0003	0.0003	0.0017	0.0012	0.0046	0.0015
Uracil	0.0025	0.0043	0.0084	0.0026	0.0052	0.0037	0.0031	0.0041	0.0043
Urea	0.2571	0.2176	0.2665	0.1826	0.4234	0.3137	0.2695	0.1924	0.2352
Uridine	0.0066	0.0088	0.0030	0.0009	0.0063	0.0096	0.0065	0.0039	0.0174
Urocanic acid	0.0005	0.0003	0.0002	0.0001	0.0011	0.0001			0.0001
Val	0.1275	0.1017	0.1842	0.1170	0.2309	0.1370	0.1068	0.1337	0.0846
Val-Arg_divalent	0.0006	0.0003	0.0003	0.0004	0.0011	0.0005	0.0005	0.0006	0.0003
Val-Asp	0.0006	0.0004		0.0006	0.0010	0.0006	0.0006	0.0004	0.0003
Val-Glu	0.0008	0.0003	0.0003	0.0005	0.0010	0.0006	0.0005	0.0005	0.0004
Val-Gly	0.0020	0.0009	0.0009	0.0010	0.0033	0.0018	0.0014	0.0013	0.0013
Val-His	0.0006	0.0004	0.0006	0.0004	0.0008	0.0007	0.0005	0.0008	0.0004
Val-Lys	0.0007	0.0006	0.0005	0.0002	0.0008	0.0010	0.0007	0.0006	0.0007
Xanthurenic acid(1.8)/ 6-Hydroxykynurenate(1.8)/ 6-Hydroxykynurenic acid(1.8)/	0.0002	0.0001	0.0016	0.0001		0.0001	0.0001	0.0001	0.0001
XC0003	0.0004	0.0009	0.0003	0.0001	0.0015	0.0003	0.0002	0.0002	0.0002
XC0007	0.0014	0.0014	0.0006	0.0005	0.0020	0.0023	0.0017	0.0012	0.0018
XC0014	0.0007	0.0003	0.0005	0.0002	0.0006	0.0005	0.0004	0.0003	0.0003
XC0016	0.0055	0.0362	0.0144	0.0030	0.0032	0.0535	0.0372	0.0033	0.0113
XC0018	0.0023	0.0016	0.0023	0.0027	0.0043	0.0027	0.0018	0.0021	0.0019
XC0019	0.0003	0.0003	0.0002	0.0002	0.0003	0.0005	0.0003	0.0003	0.0004
XC0023	0.0001	0.0001	0.0001			0.0002	0.0001	0.0001	0.0001
XC0025	0.0003	0.0000	0.0003	0.0001	0.0002	0.0001	0.0001	0.0002	0.0004
XC0026	0.0004	0.0002	0.0004	0.0002	0.0018	0.0003	0.0002	0.0002	0.0002
XC0029	0.0004	0.0016	0.0001			0.0025	0.0005	0.0001	0.0004
XC0030	0.0002	0.0002	0.0001	0.0002	0.0002	0.0003	0.0002	0.0001	0.0003
XC0032	0.0014	0.0006	0.0027	0.0005		0.0025	0.0010	0.0013	0.0041
XC0033	0.0007	0.0010	0.0004	0.0004		0.0016	0.0007	0.0004	0.0007
XC0041	0.0005	0.0004	0.0007	0.0002		0.0005	0.0008	0.0005	0.0008
XC0044	0.0002	0.0001		0.0001		0.0002	0.0002	0.0001	0.0001
XC0046	0.0008	0.0008	0.0005	0.0003		0.0014	0.0011	0.0007	0.0011
XC0047	0.0002	0.0001	0.0004	0.0002		0.0001			0.0002
XC0049	0.0006	0.0012	0.0004	0.0002	0.0006	0.0023	0.0009	0.0005	0.0016
XC0052	0.0002	0.0006	0.0000			0.0011	0.0009	0.0002	0.0006
XC0054	0.0001	0.0002	0.0001	0.0001		0.0002	0.0002	0.0001	0.0002
XC0055	0.0009	0.0002	0.0002			0.0003	0.0002	0.0004	0.0008
XC0061	0.0168	0.0394	0.0047	0.0008	0.0082	0.1024	0.0413	0.0092	0.1435
XC0062	0.0016	0.0004	0.0004	0.0000		0.0007	0.0006	0.0010	0.0021
XC0063		0.0002	0.0001	0.0001		0.0002			0.0002
XC0064	0.0004	0.0005	0.0002	0.0002		0.0009	0.0005	0.0003	0.0006
XC0071	0.0001	0.0003	0.0002	0.0001		0.0004	0.0003	0.0003	0.0003
XC0073	0.0005	0.0002	0.0002	0.0001		0.0004	0.0003	0.0002	0.0007
XC0075	0.0006	0.0006	0.0009	0.0006	0.0038	0.0007	0.0007	0.0007	0.0008
XC0080		0.0001	0.0001			0.0001		0.0001	0.0002
XC0082	0.0001	0.0002	0.0001	0.0001		0.0003	0.0002	0.0001	0.0002
XC0083	0.0030	0.0041	0.0026	0.0033	0.0036	0.0058	0.0011	0.0009	0.0019
XC0084	0.0003	0.0003	0.0002	0.0001		0.0006	0.0004	0.0003	0.0005
XC0085	0.0002	0.0001	0.0001	0.0000		0.0002			0.0002
XC0086	0.0002	0.0005	0.0002	0.0001		0.0008	0.0004	0.0004	0.0012
XC0089	0.0003	0.0002		0.0002		0.0001	0.0001	0.0007	0.0002
XC0096	0.0002	0.0001	0.0002	0.0001		0.0002		0.0002	0.0003
XC0097	0.0005	0.0002	0.0003	0.0001		0.0004	0.0003	0.0003	0.0004
XC0098	0.0004	0.0026	0.0002	0.0000		0.0030	0.0009	0.0002	0.0014
XC0101	0.0003	0.0006	0.0002	0.0002		0.0012	0.0004	0.0001	0.0011
XC0102	0.0003	0.0003	0.0002	0.0001	0.0005	0.0006	0.0004	0.0002	0.0004
XC0106	0.0001	0.0001	0.0001	0.0001		0.0002	0.0001	0.0001	0.0002
XC0107	0.0080	0.0017	0.0010	0.0002	0.0010	0.0036	0.0020	0.0040	0.0070
XC0109	0.0049	0.0006	0.0018	0.0001		0.0014	0.0007	0.0009	0.0026
XC0110	0.0035	0.0012	0.0027	0.0009	0.0005	0.0036	0.0018	0.0011	0.0015
XC0112		0.0002				0.0002			0.0001
XC0113	0.0003	0.0001	0.0002	0.0003		0.0002	0.0001	0.0002	0.0002
XC0114	0.0002	0.0001	0.0001			0.0001	0.0001	0.0001	0.0002
XC0115	0.0001	0.0002	0.0002			0.0007	0.0003	0.0001	0.0004
XC0116	0.0008	0.0011	0.0002	0.0001	0.0006	0.0016	0.0016	0.0006	0.0015
XC0117	0.0001	0.0002				0.0003	0.0001		0.0002
XC0121	0.0001	0.0002	0.0002	0.0001	0.0003	0.0003	0.0002	0.0002	0.0003
XC0123	0.0001	0.0001	0.0001	0.0000		0.0004	0.0002	0.0000	0.0002
XC0125	0.0001	0.0005				0.0008	0.0002		0.0005
XC0126	0.0003	0.0005	0.0001	0.0000		0.0008	0.0004	0.0001	0.0006
XC0132	0.0014	0.0008	0.0021	0.0013	0.0021	0.0012	0.0013	0.0008	0.0009
XC0136	0.0005	0.0045	0.0002		0.0020	0.0015	0.0019	0.0007	0.0005
XC0138	0.0008	0.0005	0.0007	0.0006	0.0019	0.0008	0.0007	0.0005	0.0008
XC0139	0.0010	0.0024	0.0004	0.0001	0.0003	0.0037	0.0028	0.0012	0.0025
XC0140	0.0004	0.0004	0.0002	0.0000		0.0020	0.0004	0.0002	0.0012
XC0141	0.0002	0.0005	0.0001	0.0001		0.0010	0.0005	0.0003	0.0007
XC0143	0.0000	0.0008	0.0000		0.0000	0.0022	0.0007	0.0002	0.0012
β-Ala	0.0250	0.0330	0.0128	0.0041	0.0154	0.0395	0.0283	0.0296	0.0224
γ-Butyrobetaine	0.0093	0.0042	0.0059	0.0058	0.0052	0.0062	0.0087	0.0031	0.0028
γ-Glu-Cys	0.0002	0.0045	0.0006		0.0009	0.0069	0.0053	0.0022	0.0027
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
1-(5'-Phosphoribosyl)-5-amino-4-(N-succinocarboxamide)-imidazole(-9.33)/						C04823;		Osaka_City_University_ID
1-Aminocyclopentanecarboxylate(2.94)/ N4-Acetylaminobutanal(2.94)/ Vigabatrin(2.94)/ (+)-TACP(2.94)/						C03969; C05936; C07500; C13696;		Osaka_City_University_ID
1-Methyl-2-pyrrolidone						C11118		Osaka_City_University_ID
1-Methyl-4-imidazoleacetic acid						C05828		Osaka_City_University_ID
1-Methyladenosine						C02494		Osaka_City_University_ID
1-Methylhistamine						C05127		Osaka_City_University_ID
1-Methylhistidine								Osaka_City_University_ID
1-Methylnicotinamide						C02918		Osaka_City_University_ID
2-Aminoadipic acid						C00956		Osaka_City_University_ID
2-Aminobutyric acid						C02261;C02356		Osaka_City_University_ID
2-Methylserine						C02115		Osaka_City_University_ID
2-Phenylethylamine						C05332		Osaka_City_University_ID
3-Aminoisobutyric acid						C03284;C05145		Osaka_City_University_ID
4-Aminobenzoate(2.48)/ 4-Nitrotoluene(2.48)/						C00568; C14394;		Osaka_City_University_ID
5;6-Dihydrothymine(2.49)/ gamma-Amino-gamma-cyanobutanoate(2.49)/ alpha-Amino-gamma-cyanobutanoate(2.49)/						C00906; C05715; C05717;		Osaka_City_University_ID
5;6-Dihydrothymine(2.73)/ gamma-Amino-gamma-cyanobutanoate(2.73)/ alpha-Amino-gamma-cyanobutanoate(2.73)/						C00906; C05715; C05717;		Osaka_City_University_ID
5-Aminovaleric acid						C00431		Osaka_City_University_ID
5'-Deoxy-5'-methylthioadenosine						C00170		Osaka_City_University_ID
5-Hydroxylysine						C16741		Osaka_City_University_ID
Acetylcysteine(-2.02)/						C06809;		Osaka_City_University_ID
Acetylcysteine(4.29)/						C06809;		Osaka_City_University_ID
Adenine						C00147		Osaka_City_University_ID
Adenosine						C00212		Osaka_City_University_ID
ADMA						C03626		Osaka_City_University_ID
Ala						C00041;C00133;C01401		Osaka_City_University_ID
Ala-Ala						C00993		Osaka_City_University_ID
Ala-Arg/Arg-Ala								Osaka_City_University_ID
Ala-Asn/Asn-Ala/Gly-Gln								Osaka_City_University_ID
Ala-Asp/Asp-Ala								Osaka_City_University_ID
Ala-Gly/Gly-Ala								Osaka_City_University_ID
Ala-Met								Osaka_City_University_ID
Ala-Ser/Thr-Gly								Osaka_City_University_ID
Ala-Thr/Thr-Ala								Osaka_City_University_ID
Ala-Tyr/Phe-Ser/Tyr-Ala								Osaka_City_University_ID
Anthranilic acid						C00108		Osaka_City_University_ID
Arg						C00062;C00792		Osaka_City_University_ID
Arg-Asn/Asn-Arg								Osaka_City_University_ID
Arg-Gln								Osaka_City_University_ID
Arg-Glu/Glu-Arg								Osaka_City_University_ID
Arg-Gly/Gly-Arg								Osaka_City_University_ID
Arg-Ile/Arg-Leu/Leu-Arg								Osaka_City_University_ID
Argininosuccinic acid						C03406		Osaka_City_University_ID
Arg-Ser/Ser-Arg								Osaka_City_University_ID
Arg-Thr								Osaka_City_University_ID
Arg-Tyr/Tyr-Arg								Osaka_City_University_ID
Arg-Val								Osaka_City_University_ID
Asn						C00152;C01905;C16438		Osaka_City_University_ID
Asn-Glu								Osaka_City_University_ID
Asn-Ile/Asn-Leu/Ile-Asn/Leu-Asn/Val-Gln								Osaka_City_University_ID
Asn-Lys/Lys-Asn								Osaka_City_University_ID
Asn-Thr/Ser-Gln/Thr-Asn								Osaka_City_University_ID
Asn-Val/Val-Asn								Osaka_City_University_ID
Asp						C00049;C00402;C16433		Osaka_City_University_ID
Asp-Lys								Osaka_City_University_ID
Betaine						C00719		Osaka_City_University_ID
Betaine aldehyde_+H2O						C00576		Osaka_City_University_ID
Carnitine						C00318;C00487;C15025		Osaka_City_University_ID
Carnosine						C00386		Osaka_City_University_ID
Choline						C00114		Osaka_City_University_ID
Citrulline						C00327		Osaka_City_University_ID
Creatine						C00300		Osaka_City_University_ID
Creatinine						C00791		Osaka_City_University_ID
Cys						C00097;C00736;C00793		Osaka_City_University_ID
Cystathionine						C00542;C02291		Osaka_City_University_ID
Cysteine glutathione disulfide						C05526		Osaka_City_University_ID
Cystine						C00491;C01420		Osaka_City_University_ID
Cytidine						C00475		Osaka_City_University_ID
Cytosine						C00380		Osaka_City_University_ID
Deoxyguanosine(6.88)/ Neuraminic acid(1.64)/ Zidovudine(6.88)/ Miserotoxin(1.64)/						C00330; C06469; C07210; C08507;		Osaka_City_University_ID
Dyphylline						C07819		Osaka_City_University_ID
Ephedrine(-0.54)/ (+)-Pseudoephedrine(-0.54)/ Hordenine(-0.54)/ Anatoxin a(-0.54)/						C01575; C02765; C06199; C10841;		Osaka_City_University_ID
Ephedrine(6.84)/ (+)-Pseudoephedrine(6.84)/ Hordenine(6.84)/ Anatoxin a(6.84)/						C01575; C02765; C06199; C10841;		Osaka_City_University_ID
Ergothioneine						C05570		Osaka_City_University_ID
Ethanolamine						C00189		Osaka_City_University_ID
GABA						C00334		Osaka_City_University_ID
Gln						C00064;C00303;C00819		Osaka_City_University_ID
Gln-Thr/Thr-Gln								Osaka_City_University_ID
Glu						C00025;C00217;C00302		Osaka_City_University_ID
Gluconolactone						C00198		Osaka_City_University_ID
Glucosamine						C00329		Osaka_City_University_ID
Glu-Glu						C01425		Osaka_City_University_ID
Glu-Ile/Glu-Leu/Ile-Glu/Leu-Glu								Osaka_City_University_ID
Glu-Lys/Lys-Glu								Osaka_City_University_ID
Glu-Ser								Osaka_City_University_ID
Glutathione (GSH)						C00051		Osaka_City_University_ID
Glutathione (GSSG)_divalent						C00127		Osaka_City_University_ID
Glu-Tyr/Tyr-Glu								Osaka_City_University_ID
Gly						C00037		Osaka_City_University_ID
Gly-Asn								Osaka_City_University_ID
Glycerophosphocholine						C00670		Osaka_City_University_ID
Gly-Gly						C02037		Osaka_City_University_ID
Gly-His/His-Gly								Osaka_City_University_ID
Gly-Ile/Gly-Leu								Osaka_City_University_ID
Gly-Lys/Lys-Gly								Osaka_City_University_ID
Gly-Met/Met-Gly								Osaka_City_University_ID
Gly-Val								Osaka_City_University_ID
Guanidinosuccinic acid						C03139		Osaka_City_University_ID
Guanidoacetic acid						C00581		Osaka_City_University_ID
Guanine						C00242		Osaka_City_University_ID
Guanosine						C00387		Osaka_City_University_ID
His						C00135;C00768;C06419		Osaka_City_University_ID
Histamine						C00388		Osaka_City_University_ID
His-Thr/Thr-His								Osaka_City_University_ID
Homoserine						C00263		Osaka_City_University_ID
Homoserinelactone								Osaka_City_University_ID
Homospermidine(3.14)/ Aminopropylcadaverine(3.14)/						C06366; C16565;		Osaka_City_University_ID
Hydroxyproline						C01157		Osaka_City_University_ID
Hypotaurine						C00519		Osaka_City_University_ID
Hypoxanthine						C00262		Osaka_City_University_ID
Ile						C00407;C06418;C16434		Osaka_City_University_ID
Ile-Ala								Osaka_City_University_ID
Ile-Arg_divalent								Osaka_City_University_ID
Ile-Asp/Leu-Asp								Osaka_City_University_ID
Ile-Gln/Leu-Gln								Osaka_City_University_ID
Ile-Lys/Lys-Ile/Lys-Leu/Leu-Lys								Osaka_City_University_ID
Ile-Ser/Ser-Ile/Ser-Leu/Thr-Val/Val-Thr								Osaka_City_University_ID
Ile-Thr/Thr-Ile/Thr-Leu								Osaka_City_University_ID
Ile-Val								Osaka_City_University_ID
Imidazolelactic acid						C05568		Osaka_City_University_ID
Inosine						C00294		Osaka_City_University_ID
Isobutyrylcarnitine/Butyrylcarnitine						C02862		Osaka_City_University_ID
Isovalerylcarnitine								Osaka_City_University_ID
Kynurenine						C00328;C01718		Osaka_City_University_ID
Leu						C00123;C01570;C16439		Osaka_City_University_ID
Leu-Ala								Osaka_City_University_ID
Leu-His								Osaka_City_University_ID
Leu-Ile/Leu-Leu								Osaka_City_University_ID
Leu-Phe								Osaka_City_University_ID
Lidocaine						C07073		Osaka_City_University_ID
L-Norleucine(4.42)/ 6-Aminohexanoate(4.42)/ (3R)-beta-Leucine(4.42)/ beta-Alaninebetaine(4.42)/ N;N-Diethylglycine(4.42)/						C01933; C02378; C02486; C08263; C16647;		Osaka_City_University_ID
L-Norleucine(5.11)/ 6-Aminohexanoate(5.11)/ (3R)-beta-Leucine(5.11)/ beta-Alaninebetaine(5.11)/ N;N-Diethylglycine(5.11)/						C01933; C02378; C02486; C08263; C16647;		Osaka_City_University_ID
Lys						C00047;C00739;C16440		Osaka_City_University_ID
Lys-Ala								Osaka_City_University_ID
Lys-Gln								Osaka_City_University_ID
Lys-Phe/Phe-Lys								Osaka_City_University_ID
Lys-Ser/Ser-Lys								Osaka_City_University_ID
Lys-Tyr/Tyr-Lys								Osaka_City_University_ID
Lys-Val								Osaka_City_University_ID
Malonylcarnitine								Osaka_City_University_ID
Met						C00073;C00855;C01733		Osaka_City_University_ID
Met-Gln								Osaka_City_University_ID
Methionine sulfoxide						C02989		Osaka_City_University_ID
Methyldopa anhydrous(-3.07)/ Enicoflavine(-3.07)/						C07194; C09946;		Osaka_City_University_ID
Metronidazole						C07203		Osaka_City_University_ID
Met-Thr								Osaka_City_University_ID
N1-Methyl-4-pyridone-5-carboxamide						C05843		Osaka_City_University_ID
N5-Ethylglutamine						C01047		Osaka_City_University_ID
N6-Acetyllysine						C02727		Osaka_City_University_ID
N6-Methyllysine						C02728		Osaka_City_University_ID
N8-Acetylspermidine						C01029		Osaka_City_University_ID
N-Acetylgalactosamine						C01132		Osaka_City_University_ID
N-Acetylhistidine						C02997		Osaka_City_University_ID
N-Acetyl-L-citrulline(1.98)/						C15532;		Osaka_City_University_ID
N-(Acetyloxy)benzenamine(5.75)/ N-Methylanthranilate(5.75)						C02709; C03005		Osaka_City_University_ID
N-Ethylglycine						C11735		Osaka_City_University_ID
Nicotinamide						C00153		Osaka_City_University_ID
NMN						C00455		Osaka_City_University_ID
N;N-Dimethylglycine						C01026		Osaka_City_University_ID
Noradrenaline						C00547		Osaka_City_University_ID
O-Acetylcarnitine						C02571		Osaka_City_University_ID
Octanoylcarnitine						C02838		Osaka_City_University_ID
Ophthalmic acid								Osaka_City_University_ID
Ornithine						C00077;C00515;C01602		Osaka_City_University_ID
Pantetheine 4'-phosphate(-1.53)/						C01134;		Osaka_City_University_ID
Phe						C00079;C02057;C02265		Osaka_City_University_ID
Phe-Arg_divalent								Osaka_City_University_ID
Phe-Asn								Osaka_City_University_ID
Phe-Gln								Osaka_City_University_ID
Phe-Thr								Osaka_City_University_ID
Phe-Val								Osaka_City_University_ID
Phosphorylcholine						C00588		Osaka_City_University_ID
Pipecolic acid						C00408		Osaka_City_University_ID
Prenyl-L-cysteine(6.29)/						C06751;		Osaka_City_University_ID
Pro						C00148;C00763;C16435		Osaka_City_University_ID
Pro-Ala								Osaka_City_University_ID
Pro-Arg_divalent								Osaka_City_University_ID
Pro-Ser								Osaka_City_University_ID
Pro-Val								Osaka_City_University_ID
Putrescine						C00134		Osaka_City_University_ID
Pyridoxamine 5'-phosphate						C00647		Osaka_City_University_ID
(R)-1-Aminopropan-2-ol(-4.26)/ 1-Aminopropan-2-ol(-4.26)/						C03194; C05771;		Osaka_City_University_ID
Ranitidine						C07233		Osaka_City_University_ID
Saccharopine						C00449		Osaka_City_University_ID
S-Adenosylhomocysteine						C00021		Osaka_City_University_ID
S-Adenosylmethionine						C00019		Osaka_City_University_ID
Sarcosine						C00213		Osaka_City_University_ID
SDMA								Osaka_City_University_ID
Ser						C00065;C00716;C00740		Osaka_City_University_ID
Ser-Asn								Osaka_City_University_ID
Ser-Gly/Gly-Ser								Osaka_City_University_ID
Ser-His								Osaka_City_University_ID
Ser-Ser								Osaka_City_University_ID
Ser-Thr								Osaka_City_University_ID
S-Methylglutathione						C11347		Osaka_City_University_ID
Spermidine						C00315		Osaka_City_University_ID
Spermine						C00750		Osaka_City_University_ID
Stachydrine						C10172		Osaka_City_University_ID
Taurine						C00245		Osaka_City_University_ID
Thiamine						C00378		Osaka_City_University_ID
Thiaproline								Osaka_City_University_ID
Thr						C00188;C00820		Osaka_City_University_ID
Thr-Asp/Asp-Thr/Ser-Glu								Osaka_City_University_ID
Thr-Glu								Osaka_City_University_ID
Thr-Lys								Osaka_City_University_ID
Thr-Thr								Osaka_City_University_ID
Thr-Tyr/Tyr-Thr								Osaka_City_University_ID
Thymidine						C00214		Osaka_City_University_ID
Thymine						C00178		Osaka_City_University_ID
trans-Glutaconic acid						C02214		Osaka_City_University_ID
Trigonelline						C01004		Osaka_City_University_ID
Trimethylamine						C00565		Osaka_City_University_ID
Trimethylamine N-oxide						C01104		Osaka_City_University_ID
Trp						C00078;C00525;C00806		Osaka_City_University_ID
Tyr						C00082;C01536;C06420		Osaka_City_University_ID
Tyramine						C00483		Osaka_City_University_ID
Tyr-Arg_divalent								Osaka_City_University_ID
Tyr-Gln								Osaka_City_University_ID
Tyr-Gly								Osaka_City_University_ID
Tyr-His								Osaka_City_University_ID
Uracil						C00106		Osaka_City_University_ID
Urea						C00086		Osaka_City_University_ID
Uridine						C00299		Osaka_City_University_ID
Urocanic acid						C00785		Osaka_City_University_ID
Val						C00183;C06417;C16436		Osaka_City_University_ID
Val-Arg_divalent								Osaka_City_University_ID
Val-Asp								Osaka_City_University_ID
Val-Glu								Osaka_City_University_ID
Val-Gly								Osaka_City_University_ID
Val-His								Osaka_City_University_ID
Val-Lys								Osaka_City_University_ID
Xanthurenic acid(1.8)/ 6-Hydroxykynurenate(1.8)/ 6-Hydroxykynurenic acid(1.8)/						C02470; C05663; C08480;		Osaka_City_University_ID
XC0003								Osaka_City_University_ID
XC0007								Osaka_City_University_ID
XC0014								Osaka_City_University_ID
XC0016								Osaka_City_University_ID
XC0018								Osaka_City_University_ID
XC0019								Osaka_City_University_ID
XC0023								Osaka_City_University_ID
XC0025								Osaka_City_University_ID
XC0026								Osaka_City_University_ID
XC0029								Osaka_City_University_ID
XC0030								Osaka_City_University_ID
XC0032								Osaka_City_University_ID
XC0033								Osaka_City_University_ID
XC0041								Osaka_City_University_ID
XC0044								Osaka_City_University_ID
XC0046								Osaka_City_University_ID
XC0047								Osaka_City_University_ID
XC0049								Osaka_City_University_ID
XC0052								Osaka_City_University_ID
XC0054								Osaka_City_University_ID
XC0055								Osaka_City_University_ID
XC0061								Osaka_City_University_ID
XC0062								Osaka_City_University_ID
XC0063								Osaka_City_University_ID
XC0064								Osaka_City_University_ID
XC0071								Osaka_City_University_ID
XC0073								Osaka_City_University_ID
XC0075								Osaka_City_University_ID
XC0080								Osaka_City_University_ID
XC0082								Osaka_City_University_ID
XC0083								Osaka_City_University_ID
XC0084								Osaka_City_University_ID
XC0085								Osaka_City_University_ID
XC0086								Osaka_City_University_ID
XC0089								Osaka_City_University_ID
XC0096								Osaka_City_University_ID
XC0097								Osaka_City_University_ID
XC0098								Osaka_City_University_ID
XC0101								Osaka_City_University_ID
XC0102								Osaka_City_University_ID
XC0106								Osaka_City_University_ID
XC0107								Osaka_City_University_ID
XC0109								Osaka_City_University_ID
XC0110								Osaka_City_University_ID
XC0112								Osaka_City_University_ID
XC0113								Osaka_City_University_ID
XC0114								Osaka_City_University_ID
XC0115								Osaka_City_University_ID
XC0116								Osaka_City_University_ID
XC0117								Osaka_City_University_ID
XC0121								Osaka_City_University_ID
XC0123								Osaka_City_University_ID
XC0125								Osaka_City_University_ID
XC0126								Osaka_City_University_ID
XC0132								Osaka_City_University_ID
XC0136								Osaka_City_University_ID
XC0138								Osaka_City_University_ID
XC0139								Osaka_City_University_ID
XC0140								Osaka_City_University_ID
XC0141								Osaka_City_University_ID
XC0143								Osaka_City_University_ID
β-Ala						C00099		Osaka_City_University_ID
γ-Butyrobetaine						C01181		Osaka_City_University_ID
γ-Glu-Cys						C00669		Osaka_City_University_ID
METABOLITES_END
#END