Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST003201)

(Analysis AN005251)

Metabolite	Structure	F1	F2	F3	F4	F5
Hematoporphyrin IX	ME835128	0.06	4.43	0.05	6.53	1.29
L-Tyrosine	ME835158	1.93	3.07	0.18	0.19	0.23
Homovanillic acid	ME835131	1.43	NA	0.62	0.11	NA
Taurocholic acid	ME835198	2.28	0.37	1.32	0.27	0.22
Cytidine	ME835108	1.99	0.06	2.16	0.09	0.05
Cytosine	ME835109	1.70	0.14	1.79	0.15	0.08
Deoxycytidine	ME835114	1.43	0.26	1.48	0.14	0.09
7-Dehydrocholesterol	ME835085	0.23	1.69	0.16	0.71	1.87
Elaidic acid	ME835120	0.23	0.74	0.21	1.18	2.49
Nutriacholic acid	ME835174	0.71	0.70	0.49	0.85	2.10
Triamterene	ME835205	0.13	1.12	0.11	1.66	0.42
2-Oxoarginine	ME835071	NA	0.87	NA	1.43	0.57
Tetrahydrocortisone	ME835199	NA	1.00	NA	1.45	0.69
Aldosterone	ME835094	NA	1.57	0.15	1.44	0.89
Acetylcysteine	ME835090	NA	1.55	NA	0.82	0.81
Cholesterol sulfate	ME835103	0.20	1.72	NA	0.87	0.78
7-Ketocholesterol	ME835086	0.07	1.08	0.07	3.04	0.82
D-Lysine	ME835112	0.33	0.99	0.26	2.43	1.46
5-Hydroxy-L-tryptophan	ME835080	0.64	0.93	0.65	2.12	0.85
L-Proline	ME835156	0.59	1.22	0.35	2.39	0.82
Cortisol	ME835106	0.08	1.19	0.54	2.15	0.89
Pyridoxine	ME835185	0.17	0.96	0.16	2.19	0.51
Phenylpropiolic acid	ME835182	1.12	1.08	2.30	1.37	0.24
Guanosine	ME835127	0.68	1.80	0.91	1.71	0.61
Sphinganine	ME835195	0.85	1.46	0.69	1.63	0.68
Pyrrolidonecarboxylic acid	ME835186	0.85	1.73	0.62	1.25	0.88
Anserine	ME835097	1.04	1.89	0.65	1.47	0.43
Urocanic acid	ME835213	1.13	1.75	0.76	1.16	0.53
2-Hydroxyadenine	ME835068	0.65	1.71	1.31	1.17	0.44
Spermine	ME835194	0.99	1.75	1.41	0.55	0.66
Cortexolone	ME835105	0.59	0.39	1.88	0.83	1.03
Adenosine	ME835092	1.19	0.33	1.89	0.77	0.52
2-Methoxyestradiol	ME835070	1.33	0.71	1.23	0.94	0.48
Levoglucosan	ME835160	1.27	0.65	1.63	0.62	0.61
Diaminopimelic acid	ME835115	1.36	0.49	1.47	0.52	0.93
Thyroxine	ME835201	1.38	0.74	1.39	0.47	0.81
5-Methoxytryptophol	ME835082	1.60	0.48	0.72	0.68	1.22
Linoleic acid	ME835161	1.67	0.58	0.92	0.71	0.83
Tryptophanol	ME835207	1.72	0.54	0.84	0.71	0.95
Naringenin	ME835171	1.90	1.17	0.50	0.51	0.93
2,3-Diaminopropionic acid	ME835065	1.99	0.92	0.62	0.67	0.70
Phenylacetaldehyde	ME835181	1.75	1.07	0.63	0.82	0.79
D-Limonene	ME835111	0.52	1.11	1.23	0.76	1.36
3-Indolepropionic acid	ME835074	0.84	1.43	0.43	1.27	1.24
Hippuric acid	ME835130	0.84	1.30	0.17	1.57	1.36
Indolelactic acid	ME835138	0.73	1.40	0.37	1.71	1.10
2-Hydroxyphenethylamine	ME835069	0.76	1.02	0.85	1.55	0.88
Isovalerylcarnitine	ME835141	0.86	0.87	0.70	1.58	1.06
Hydroxyindoleacetic acid	ME835132	0.81	1.13	0.71	1.46	1.04
L-Kynurenine	ME835151	0.89	1.12	0.68	1.42	1.03
Octadecanedioic acid	ME835176	0.98	1.08	0.63	1.57	0.89
Pantothenic acid	ME835179	0.99	1.03	0.69	1.45	0.95
Saccharopine	ME835190	0.65	1.00	0.69	1.39	1.50
Uracil	ME835209	0.82	1.17	0.78	1.18	1.17
All-trans-retinoic acid	ME835095	0.86	1.00	0.54	1.31	1.35
Kynurenic acid	ME835142	0.83	1.11	0.62	1.19	1.33
Daidzein	ME835113	1.13	0.89	0.51	0.87	1.09
Genistein	ME835123	0.96	0.89	0.45	1.01	1.15
p-Octopamine	ME835178	1.33	1.10	0.68	0.81	1.17
Trans-Cinnamic acid	ME835203	1.43	1.04	0.35	0.64	1.08
Creatine	ME835107	1.25	0.99	0.78	1.64	0.46
Trimethylamine	ME835206	1.04	0.84	1.07	1.37	0.69
Pyridine	ME835184	1.22	0.92	0.95	1.44	0.56
3-Hexenedioic acid	ME835073	1.12	0.93	0.92	1.39	0.69
L-Acetylcarnitine	ME835143	1.11	0.92	0.89	1.44	0.69
Methylhippuric acid	ME835164	1.29	1.17	0.67	1.40	0.64
Sphingosine	ME835196	1.11	1.32	0.81	1.36	0.60
N-Methylhydantoin	ME835168	0.83	1.17	1.06	1.25	0.81
L-Fucose	ME835149	1.03	1.30	0.95	1.13	0.74
Trans-Aconitic acid	ME835202	1.12	1.17	0.80	1.26	0.78
Uridine	ME835212	0.95	1.12	0.91	1.40	0.74
Cis-Aconitic acid	ME835104	0.89	0.61	1.04	1.33	1.00
Xanthosine	ME835214	1.10	0.44	1.21	0.92	1.08
Dimethylmalonic acid	ME835116	1.29	0.42	1.26	0.84	0.95
Oxypurinol	ME835177	1.16	0.40	1.37	0.83	0.96
Glutathione	ME835124	1.10	0.73	1.22	0.71	1.04
Heptadecanoic acid	ME835129	0.91	0.88	1.37	0.68	1.05
5^-Methylthioadenosine	ME835078	1.02	0.79	1.23	1.10	0.80
Pipecolic acid	ME835183	0.87	0.79	1.29	1.22	0.78
Hypoxanthine	ME835134	0.98	0.59	1.42	0.88	0.94
Adenine	ME835091	1.02	0.78	1.33	0.94	0.82
Inosine	ME835139	1.02	0.81	1.26	0.89	0.89
Serotonin	ME835193	1.10	1.16	1.15	0.45	1.10
Succinylacetone	ME835197	1.01	1.27	1.21	0.39	1.10
L-Glutamine	ME835150	1.16	1.21	0.92	0.75	0.99
5-Methylcytidine	ME835083	1.02	1.10	1.08	0.71	1.07
Glycerophosphocholine	ME835125	1.02	1.08	1.08	0.66	1.12
4-Aminohippuric acid	ME835076	1.09	1.21	1.10	0.62	0.95
Epicatechin	ME835121	1.14	1.16	1.01	0.63	1.07
5-Methoxysalicylic acid	ME835081	1.32	0.70	0.82	1.09	0.95
N1-Acetylspermine	ME835169	1.42	0.73	0.99	0.81	0.88
L-Norleucine	ME835154	1.32	0.76	0.80	0.91	1.10
Aspartame	ME835098	1.29	0.76	0.94	0.87	1.01
Benzocaine	ME835099	1.32	0.74	0.94	0.80	1.06
L-Valine	ME835159	1.26	0.79	0.93	0.81	1.10
Traumatic acid	ME835204	1.14	0.77	1.02	0.97	0.99
m-Coumaric acid	ME835162	1.13	0.93	0.98	0.79	1.09
Normetanephrine	ME835173	1.17	0.82	0.94	0.87	1.11
o-Tyrosine	ME835175	1.13	0.82	0.99	0.83	1.12
Niacinamide	ME835172	1.19	0.88	1.16	1.03	0.69
Canavanine	ME835102	1.19	0.86	1.00	1.04	0.84
3,4,5-Trimethoxycinnamic acid	ME835072	1.18	0.86	1.11	0.98	0.81
Urea	ME835210	1.18	0.78	1.10	1.07	0.79
Salbutamol	ME835191	1.26	0.72	1.10	1.19	0.70
2,5-Furandicarboxylic acid	ME835067	1.34	0.70	1.12	1.00	0.72
L-Alanine	ME835144	1.35	0.83	0.99	1.07	0.71
4-Hydroxyproline	ME835077	1.16	1.05	1.07	0.90	0.82
5-Aminolevulinic acid	ME835079	1.21	1.09	1.01	0.95	0.77
L-Dopa	ME835148	1.22	1.00	1.24	0.77	0.70
D-Glucurono-6,3-lactone	ME835110	1.18	0.82	1.28	0.78	0.80
Metoprolol	ME835165	1.20	0.83	1.14	0.87	0.86
Thymine	ME835200	1.21	0.97	1.20	0.71	0.84
Ribothymidine	ME835189	1.21	0.88	1.16	0.76	0.89
Tyramine	ME835208	1.20	0.94	1.14	0.80	0.84
2,4-Diaminobutyric acid	ME835066	1.02	1.14	0.83	1.10	1.00
Riboflavin	ME835188	1.04	1.14	0.82	1.18	0.92
7-Methylguanine	ME835087	1.07	1.02	0.82	1.12	1.00
Indole-3-carboxylic acid	ME835136	1.11	1.05	0.84	1.09	0.95
Isocitric acid	ME835140	1.15	1.03	0.87	1.15	0.85
Phenol	ME835180	1.06	1.02	0.89	1.19	0.91
L-Arginine	ME835145	1.12	0.83	0.77	1.16	1.04
3-Methylindole	ME835075	1.02	0.98	0.89	1.02	1.07
Indoleacrylic acid	ME835137	1.01	0.98	0.93	1.03	1.04
Indole	ME835135	1.04	0.95	0.85	1.05	1.09
L-Tryptophan	ME835157	1.06	0.94	0.89	1.05	1.04
Dodecanedioic acid	ME835118	0.99	0.95	0.90	1.01	1.15
Glycine	ME835126	0.99	0.88	0.96	1.01	1.12
L-Methionine	ME835153	1.04	0.97	0.97	1.05	0.96
N-Acetyl-L-phenylalanine	ME835167	1.16	0.91	0.92	1.08	0.91
Alpha-Aspartyl-lysine	ME835096	1.13	0.89	0.92	1.01	0.99
Betaine	ME835101	1.07	0.87	0.93	1.05	1.03
L-Phenylalanine	ME835155	1.10	0.93	0.90	1.06	0.99
m-Cresol	ME835163	1.10	0.89	0.88	1.10	1.01
L-Leucine	ME835152	0.95	0.88	0.85	1.32	0.99
Benzoic acid	ME835100	0.93	0.92	0.97	1.20	1.01
Adenosine monophosphate	ME835093	0.96	0.96	0.97	1.20	0.93
DL-2-aminooctanoic acid	ME835117	0.95	1.02	0.96	1.18	0.94
Acetone	ME835089	0.87	0.97	1.10	1.09	0.98
Pyruvaldehyde	ME835187	0.97	0.89	1.05	1.10	0.98
Scopolamine	ME835192	1.00	1.10	1.01	1.03	0.91
Acetoin	ME835088	0.96	1.15	1.01	0.92	1.01
L-Carnitine	ME835147	0.98	1.07	1.06	0.92	0.98
1-Methyladenosine	ME835063	0.89	1.00	1.05	0.88	1.13
DUMP	ME835119	0.84	1.00	1.05	0.99	1.13
11a-Hydroxyprogesterone	ME835064	0.94	0.80	1.20	0.88	1.08
Uric acid	ME835211	1.00	0.93	1.10	0.81	1.09
Hydroxyisocaproic acid	ME835133	0.94	0.92	1.13	0.96	0.98
L-Aspartyl-L-phenylalanine	ME835146	1.05	0.88	1.07	0.91	1.01
6-Phosphogluconic acid	ME835084	0.95	1.34	0.75	0.95	1.14
Naproxen	ME835170	1.05	1.19	0.81	0.99	1.06
Ethanolamine	ME835122	0.82	1.14	0.81	0.87	1.38
Myristic acid	ME835166	0.99	0.94	0.86	0.94	1.23

Factors:

F1	Sample source:Blood Serum \| Group:Negative Control
F2	Sample source:Blood Serum \| Group:Nonresponders
F3	Sample source:Blood Serum \| Group:Positive Control
F4	Sample source:Blood Serum \| Group:Responders
F5	Sample source:Blood Serum \| Group:Vehicle Control

Data matrix