Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002731)

Reversed phase POSITIVE ION MODE (Analysis AN004428)

Metabolite	Structure	F1	F2	F3	F4
L-Acetylcarnitine	ME705531	0.49	1.34	1.24	0.93
Hypoxanthine	ME705525	0.58	1.43	0.96	1.04
Inosine	ME705529	0.47	1.53	0.94	1.06
2-Pyrrolidinone	ME705480	0.83	1.14	1.03	1.00
Niacinamide	ME705548	0.34	1.70	0.82	1.14
Xanthine	ME705571	0.60	1.03	1.41	0.96
Acetone	ME705490	1.02	0.92	1.00	1.05
ADP	ME705496	0.43	1.54	1.03	1.00
D-Glucurono-6,3-lactone	ME705506	0.71	1.64	0.95	0.71
Glycine	ME705517	0.76	1.27	0.89	1.09
N-Methyl-D-aspartic acid	ME705547	0.77	1.59	0.85	0.78
Trimethylamine N-oxide	ME705570	NA	0.45	0.25	1.62
Adenine	ME705491	0.34	1.65	0.55	1.46
L-Norleucine	ME705535	0.45	1.23	1.16	1.16
Succinylacetone	ME705567	0.94	1.21	0.94	0.91
Glutathione	ME705514	0.54	1.21	0.99	1.26
L-Fucose	ME705533	1.09	0.94	0.96	1.01
Androstenedione	ME705499	0.46	1.16	1.22	1.17
N-Methyl-a-aminoisobutyric acid	ME705546	0.80	1.39	0.88	0.93
Salicin	ME705561	0.44	1.62	0.94	1.00
Sphingosine	ME705565	0.78	2.10	0.65	0.47
Spermine	ME705563	0.11	1.63	1.05	1.21
2-Hydroxyadenine	ME705477	0.74	1.36	1.02	0.88
Galactitol	ME705511	1.14	0.94	0.97	0.95
Benzene	ME705500	0.86	0.35	2.19	0.13
3-Nitrotyrosine	ME705483	0.37	1.58	0.63	0.94
Acetoin	ME705489	0.67	1.44	0.93	0.97
N-Acetyl-L-alanine	ME705544	0.96	1.03	1.02	0.99
Benzocaine	ME705501	0.80	1.13	1.13	0.94
Gamma-Glutamylcysteine	ME705512	0.45	1.50	1.04	1.00
Xanthosine	ME705572	0.48	1.39	1.18	0.94
Methylmalonic acid	ME705542	0.72	1.36	1.01	0.90
PC(18:1(9Z)/18:1(9Z))	ME705552	0.28	1.55	1.04	1.12
2^-Deoxyguanosine 5^-monophosphate	ME705475	0.61	0.90	1.22	1.27
Phosphocreatine	ME705554	0.78	1.87	0.75	0.47
PC(16:0/16:0)	ME705551	0.44	1.12	1.28	1.16
Ethanolamine	ME705509	0.84	0.96	1.22	0.99
Carnosine	ME705503	0.67	1.10	1.02	1.21
Diethanolamine	ME705508	0.65	1.36	1.19	0.81
Glycerol	ME705515	0.37	0.63	1.42	1.58
3,4-Dihydroxyphenylglycol	ME705481	0.82	1.27	0.58	1.34
Phenylacetaldehyde	ME705553	1.00	1.55	0.77	0.67
2-Ethyl-2-hydroxybutyric acid	ME705476	0.85	1.17	1.04	0.95
Beta-Alanine	ME705502	0.44	1.47	0.83	1.26
Adenosine triphosphate	ME705495	0.62	1.35	0.89	1.15
Glycylproline	ME705519	1.04	0.80	1.16	1.00
Chalcone	ME705504	0.60	1.27	1.02	1.11
3a,6b,7b-Trihydroxy-5b-cholanoic acid	ME705485	0.88	1.08	0.99	1.06
Adenosine	ME705492	0.71	1.46	1.10	0.74
Diacetyl	ME705507	0.54	1.50	0.90	1.05
Glycerophosphocholine	ME705516	1.27	0.65	0.92	1.16
Mevalonic acid	ME705543	0.63	1.18	0.99	1.21
3-Phenylbutyric acid	ME705484	1.07	1.53	0.76	0.64
5-Methoxytryptophol	ME705487	0.91	0.92	1.30	0.87
2-Phenylbutyric acid	ME705479	1.08	1.52	0.75	0.66
Trimethylamine	ME705569	0.54	1.31	1.17	0.98
Indole	ME705526	0.45	1.73	0.83	0.99
Ethyl malonate	ME705510	0.64	1.16	1.28	0.91
Hydroxyisocaproic acid	ME705523	1.06	1.53	0.77	0.63
Isovalerylcarnitine	ME705530	0.69	0.96	1.50	0.85
Adenosine monophosphate	ME705494	0.60	1.64	0.92	0.84
Gluconolactone	ME705513	0.63	1.08	1.02	1.27
Alpha-N-phenylacetyl-L-glutamine	ME705497	0.53	1.93	0.83	0.71
Glycocholic acid	ME705518	1.01	1.39	0.85	0.74
N-Acetylserotonin	ME705545	0.97	1.09	0.94	1.00
L-Phenylalanine	ME705536	0.41	1.82	0.92	0.85
Melatonin	ME705541	1.05	1.29	0.81	0.84
Pantothenic acid	ME705550	0.61	1.29	0.96	1.15
L-Homoserine	ME705534	1.07	1.07	0.87	0.99
Indoleacrylic acid	ME705528	0.47	1.57	0.92	1.04
Guanosine	ME705521	0.57	1.36	1.03	1.04
Adenosine 3^,5^-diphosphate	ME705493	0.90	0.69	1.58	0.82
Cytosine	ME705505	0.72	1.09	0.93	1.26
Threonic acid	ME705568	0.58	1.55	0.99	0.89
Medroxyprogesterone	ME705540	1.45	0.73	1.08	0.74
Leucinic acid	ME705538	0.91	1.26	0.93	0.90
Maltitol	ME705539	1.10	0.98	0.97	0.96
Pyridoxal	ME705557	1.45	0.65	1.05	0.84
17-Hydroxyprogesterone	ME705474	0.87	1.16	0.91	1.05
Aminopterin	ME705498	0.39	1.88	0.88	0.85
Indole-3-carbinol	ME705527	0.61	1.47	1.02	0.90
Nutriacholic acid	ME705549	1.22	0.89	1.19	0.70
Pyridine	ME705556	0.89	1.32	0.87	0.92
Propionic acid	ME705555	0.42	1.21	1.20	1.17
Pyridoxal 5^-phosphate	ME705558	1.21	0.20	1.84	0.24
2-Phenylaminoadenosine	ME705478	0.83	1.55	0.87	0.75
Guanine	ME705520	0.48	1.33	1.05	1.14
Pyruvaldehyde	ME705560	1.00	1.10	0.99	0.91
5^-Methylthioadenosine	ME705486	0.39	1.54	0.62	1.46
7,8-Dihydrobiopterin	ME705488	0.75	1.30	0.97	0.98
L-Dopa	ME705532	1.37	0.81	0.75	1.08
L-Tryptophan	ME705537	0.50	1.59	0.90	1.01
Stearic acid	ME705566	0.95	1.00	0.93	1.13
Hyodeoxycholic acid	ME705524	1.47	0.70	1.16	0.67
Guanosine 5^-diphosphate	ME705522	0.76	1.33	0.90	1.01
3,5-Diiodo-L-tyrosine	ME705482	0.85	0.31	1.52	1.27
Sphinganine	ME705564	0.64	2.24	0.55	0.38
Pyrrolidonecarboxylic acid	ME705559	0.66	1.90	0.81	0.63
Sebacic acid	ME705562	1.00	1.58	0.77	0.65

Factors:

F1	Group:Combined
F2	Group:Control
F3	Group:Dox
F4	Group:MGB4

Data matrix