Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Aromatic amino acid metabolism by the anaerobic gut bacterium Clostridium sporogenes (part-II) (Study ST001633)

Reversed phase UNSPECIFIED ION MODE (Analysis AN002669)

Metabolite	Structure	F1	F2	F3	F4
N-(3-Phenylpropionyl)glycine	ME383598	2.47	0.19	0.02	NA
Capryloyl glycine	ME383594	1.93	0.18	1.70	0.15
Isocaproylglycine	ME383552	2.52	0.19	1.20	0.13
Glycolic acid	ME383457	0.56	2.49	0.30	NA
N-(Cinnamoyl)glycine	ME383597	0.62	1.86	NA	0.02
L-Aspartic acid	ME383497	NA	0.60	1.80	0.60
Ethylmalonic Acid	ME383496	NA	1.00	1.00	1.00
4-Pyridoxate	ME383572	NA	NA	1.00	1.00
alpha-Ketoglutaric acid	ME383510	0.27	NA	1.09	1.04
cis-Aconitic acid	ME383553	0.46	0.35	1.14	1.57
Itaconic acid	ME383488	0.59	0.59	0.95	1.36
Vanillic acid	ME383548	1.00	NA	1.00	NA
Maltotriose	ME383633	1.33	NA	1.33	0.67
Xanthosine	ME383624	1.00	NA	1.00	1.00
Alpha-Aminoadipate	ME383541	1.14	2.02	0.84	0.76
Glutarate	ME383495	1.15	1.92	0.87	0.87
2-Methylhippuric acid	ME383588	0.83	1.53	0.66	1.07
Glutamic acid (or isomers)	ME383514	0.83	1.67	0.83	0.83
Proline	ME383474	0.84	1.51	0.89	0.72
Spermidine	ME383520	1.84	0.72	0.59	0.59
N-Acetyl-Dl-Methionine	ME383584	1.72	0.94	0.69	0.74
SN-glycero-3-Phosphocholine	ME383617	1.71	0.76	0.70	0.70
N-Acetyl-L-Leucine	ME383551	1.34	0.90	0.66	0.94
Cytidine	ME383612	1.61	0.92	0.92	0.92
3-Methylhistamine	ME383486	1.42	0.95	0.87	0.81
3-Ureidopropionate	ME383502	1.39	0.83	0.99	0.81
Sebacic acid	ME383593	1.07	0.96	0.85	1.25
2-Hydroxyphenylacetate	ME383526	1.27	0.97	0.92	0.87
5,6-Dihydrouracil	ME383472	1.30	1.01	0.88	0.85
3-(4-Hydroxyphenyl)pyruvic acid	ME383564	1.32	0.88	0.96	0.87
Phenylpyruvic acid	ME383543	1.24	0.90	0.98	0.89
L-Pyroglutamic acid	ME383491	1.18	1.09	0.87	0.90
N-Acetyl-Dl-Serine	ME383513	1.20	1.08	0.88	0.88
D-Glucose (or isomers)	ME383567	1.16	1.06	0.92	0.89
Nicotinamide	ME383483	1.15	1.07	0.89	0.93
2-Aminobutyric acid (or isomers)	ME383460	1.14	0.91	0.91	0.91
N-(2-Furoyl)glycine	ME383549	1.19	0.98	0.91	0.94
4-Acetamidophenol	ME383529	1.17	0.98	0.83	0.94
N-Acetyl-L-Alanine	ME383492	1.23	0.96	0.85	0.92
2,4-Dihydroxybutanoic acid	ME383481	1.04	1.14	0.96	0.89
Riboflavin	ME383632	0.99	1.12	0.98	0.93
Mannitol (or isomers)	ME383575	1.08	1.08	0.91	0.91
4-Imidazoleacetic Acid	ME383487	1.07	1.09	0.99	0.86
Nepsilon,Nepsilon,Nepsilon-Trimethyllysine	ME383580	1.09	1.08	0.98	0.88
1-Methyladenosine	ME383623	1.07	0.96	1.01	0.96
D-Glucono-1,5-Lactone	ME383566	1.06	0.98	0.98	0.98
L-Arginine	ME383559	1.06	0.98	0.98	0.98
Pantothenic acid	ME383601	0.99	1.05	0.98	0.98
2,6-Dihydroxybenzoic acid	ME383530	0.98	1.06	0.98	0.98
Suberic Acid	ME383554	0.98	1.07	0.98	0.98
Allantoin	ME383534	0.99	0.97	1.02	1.01
Uracil	ME383466	1.00	1.00	1.00	1.00
Thymidine	ME383611	1.00	1.00	1.00	1.00
N-Methyl-L-Glutamate (or isomers)	ME383538	1.00	1.00	1.00	1.00
N-Formyl-L-methionine	ME383560	1.00	1.00	1.00	1.00
N-Alpha-Acetyl-L-Asparagine	ME383558	1.00	1.00	1.00	1.00
N-Acetylneuraminate	ME383626	1.00	1.00	1.00	1.00
Methylsuccinic acid	ME383494	1.00	1.00	1.00	1.00
Methyl Indole-3-Acetate	ME383583	1.00	1.00	1.00	1.00
Indole-3-Acetate	ME383561	1.00	1.00	1.00	1.00
Glutamine	ME383512	1.00	1.00	1.00	1.00
D-Gulonic Acid Gama-Lactone	ME383562	1.00	1.00	1.00	1.00
D-Glucose 6-Phosphate	ME383618	1.00	1.00	1.00	1.00
Deoxyuridine	ME383609	1.00	1.00	1.00	1.00
Cytidine 2^,3^-Cyclic Mono-Phos-Phate	ME383625	1.00	1.00	1.00	1.00
Creatinine	ME383469	1.00	1.00	1.00	1.00
Beta-N-Acetylglucosamine (or isomers)	ME383606	1.00	1.00	1.00	1.00
Alpha-D-Glucose 1-Phosphate (or isomers)	ME383620	1.00	1.00	1.00	1.00
Adenosine 3^,5^-Cyclic Monophosphate	ME383627	1.00	1.00	1.00	1.00
5-Hydroxy-L-Tryptophan	ME383604	1.00	1.00	1.00	1.00
3,5-Dihydroxybenzoic acid	ME383531	1.00	1.00	1.00	1.00
4-Acetamidobutanoate	ME383517	1.00	1.00	1.00	1.00
5-Hydroxymethyl-2-furancarboxylic acid	ME383506	1.04	0.96	0.96	1.04
beta-Pseudouridine	ME383613	1.03	0.98	0.98	1.01
Homovanillic acid	ME383574	0.91	0.99	1.08	1.00
Lactic acid	ME383459	0.92	0.99	1.12	0.95
Adenosine	ME383622	1.03	0.98	1.07	0.91
D-Ribose (or isomers)	ME383524	1.00	1.02	1.05	0.94
Taurine	ME383484	0.96	0.94	1.11	0.96
Stachyose (or isomers)	ME383634	0.95	0.95	1.04	0.95
Deoxycarnitine	ME383519	0.99	0.97	1.07	0.95
Guanidinoacetate	ME383479	0.98	0.98	1.07	0.96
D-Galactonic acid (or isomers)	ME383590	0.93	0.93	1.03	1.08
N-alpha-Acetyl-L-Lysine	ME383578	0.89	0.97	1.03	1.08
Kynurenic acid	ME383581	0.93	0.90	0.99	1.15
2-Hydroxy-2-methylbutanoic acid	ME383477	0.92	0.92	0.92	1.15
Cytosine	ME383467	0.95	0.95	0.95	1.16
N-Isobutyrylglycine/butyrylglycine (coelute)	ME383509	0.77	1.00	1.06	1.14
Methyl Beta-D-Galactoside	ME383586	0.84	1.05	0.99	1.10
N-Acetylglycine	ME383473	0.86	1.10	0.96	1.08
Adipic acid	ME383511	0.86	1.15	1.06	0.94
N-Butyrylglycine	ME383516	0.89	1.22	0.90	1.03
Acetyl-L-carnitine	ME383595	1.01	1.16	0.87	1.00
Cystathionine	ME383607	0.93	1.10	0.87	1.05
Fumarate	ME383470	1.02	0.70	0.99	1.09
3,4-Dihydroxyhydrocinnamic acid	ME383569	1.11	0.87	1.00	1.00
4-Hydroxyphenylacetate	ME383527	1.11	0.83	1.06	1.00
Syringic acid	ME383592	1.08	0.86	1.15	0.94
Turanose (or isomers)	ME383630	1.14	0.85	1.11	0.85
Dihydro-5-methyl-2,4(1H,3H)-pyrimidinedione	ME383490	0.83	1.03	1.24	1.24
Erucamide	ME383628	0.66	1.11	1.17	1.03
Suberylglycine	ME383610	0.83	0.83	1.07	0.83
2-Hydroxy-3-methylbutyric acid	ME383478	0.86	0.99	1.36	0.97
Hypotaurine	ME383465	1.00	0.94	1.25	0.90
N-Acetyl-L-aspartic acid	ME383555	0.92	0.92	1.23	0.92
2-Hydroxyethanesulfonic acid	ME383485	0.73	0.73	1.30	1.15
D-Galacturonic acid (or isomers)	ME383585	0.82	0.77	1.17	1.16
3-Hydroxy-3-Methylglutarate	ME383540	0.80	0.80	1.07	1.07
L-Carnitine	ME383542	0.80	0.90	1.14	1.11
Pimelic acid	ME383537	0.90	0.91	1.13	1.03
Homovanillic acid sulfate	ME383619	1.00	0.82	1.12	1.02
3-(4-Hydroxyphenyl)Lactate	ME383570	0.99	0.84	1.20	1.12
2-Ketoisovaleric acid	ME383471	0.89	0.79	1.19	1.07
4-Methyl-2-Oxovaleric Acid	ME383489	0.92	0.81	1.11	1.11
Indole-3-Carboxaldehyde	ME383515	0.81	0.82	1.04	1.27
Succinic acid	ME383476	0.80	0.80	0.89	1.15
D-Mannosamine (or isomers)	ME383568	1.28	1.18	0.81	0.81
N-Acetyl-Dl-Glutamic Acid	ME383582	1.22	1.24	0.79	0.83
Pipecolate	ME383493	1.37	1.23	0.71	0.79
Trigonelline	ME383505	1.29	1.28	0.75	0.78
4-Guanidino butanoate	ME383518	1.39	1.36	0.67	0.71
Phenylacetylglycine	ME383589	1.42	1.22	0.77	0.69
3-Phenyllactic acid	ME383545	0.95	1.19	1.02	0.68
Creatine	ME383498	1.00	1.23	1.04	0.77
O-Acetyl-L-Serine (or isomers)	ME383523	0.91	1.24	0.82	0.82
Isoleucine	ME383500	1.04	1.31	0.95	0.77
L-Phenylalanine	ME383547	1.07	1.28	0.95	0.77
L-Serine	ME383464	0.93	1.23	1.00	0.88
Azelaic Acid	ME383576	1.05	1.27	0.87	0.87
Lysine	ME383522	0.95	1.27	0.94	0.88
3-Methyl-L-Histidine	ME383550	1.01	1.26	0.91	0.86
D-Arabitol (or isomers)	ME383528	1.00	1.25	0.95	0.86
Indole-3-lactic acid	ME383599	1.15	1.30	0.79	0.72
L-Homoarginine	ME383579	1.14	1.25	0.69	0.69
D-Sorbitol (or isomers)	ME383571	1.20	1.18	0.93	0.76
Leucine	ME383499	1.16	1.21	0.91	0.78
Tyrosine	ME383573	1.25	1.15	0.93	0.74
Valine	ME383480	1.26	1.21	0.89	0.76
D-Pantothenic Acid	ME383603	1.16	1.16	0.91	0.83
L-Asparagine	ME383501	1.12	1.17	0.90	0.86
Tryptophan	ME383596	1.08	1.18	0.93	0.86
L-Glutamine	ME383521	1.18	1.22	0.85	0.83
L-Threonine (or isomers)	ME383482	1.13	1.23	0.87	0.84
2-Hydroxybutyric Acid	ME383461	1.18	1.29	0.86	0.86
Orotic acid	ME383533	1.12	1.30	0.86	0.84
Tiglyl glycine	ME383535	1.12	1.69	0.55	0.79
2-Methylbutyrylglycine	ME383536	1.03	1.39	0.72	0.95
N-Isovaleroylglycine	ME383539	1.16	1.41	0.70	0.84
Erucic Acid	ME383629	1.16	1.47	0.81	0.68
N,N-Dimethylglycine (or isomers)	ME383463	1.25	1.56	0.69	0.65
Glycine	ME383456	1.00	1.00	1.00	NA
Uridine	ME383614	1.00	1.00	1.00	NA
Histamine	ME383468	1.94	1.22	1.22	0.46
Ferulate	ME383591	1.23	0.75	1.44	0.56
N-Caproylglycine	ME383557	1.63	0.50	1.41	0.44
Hippurate	ME383563	1.96	2.40	0.04	0.04
Trimethylamine N-oxide	ME383458	1.96	1.79	0.13	0.11
4-Hydroxyhippuric acid	ME383587	1.40	2.00	0.42	0.41
4-Hydroxybenzoic acid	ME383504	1.55	1.50	0.53	0.53
L-Methionine	ME383525	1.67	1.35	0.56	0.60
Cadaverine	ME383462	0.92	1.11	NA	0.92
Homocitrulline	ME383577	1.00	1.00	NA	1.00
3-(4-Hydroxyphenyl)propionic acid	ME383546	1.41	0.55	NA	NA
5-Aminovaleric acid	ME383475	0.90	1.11	NA	NA
N-(3-Indolylacetyl)-L-alanine	ME383616	0.97	1.04	NA	NA
N-Acetyltryptophan	ME383615	0.99	1.01	NA	NA
3-Aminosalicylic acid	ME383532	1.00	1.00	NA	NA
Valproic acid	ME383508	1.00	1.00	NA	NA
N-Acetyl-L-tyrosine	ME383608	1.30	0.94	0.02	0.02
4-Hydroxyphenylpropionylglycine	ME383605	1.17	0.81	NA	NA
p-Coumaric acid	ME383544	1.11	0.88	NA	NA

Factors:

F1	Mouse_Genotype:MCAD-/- \| Treatment:Cs
F2	Mouse_Genotype:MCAD+/+ \| Treatment:Cs
F3	Mouse_Genotype:MCAD-/- \| Treatment:GF
F4	Mouse_Genotype:MCAD+/+ \| Treatment:GF

Data matrix