Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST001720)

(Analysis AN002803)

Metabolite	Structure	F1	F2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12	F13
4-Pyridoxic acid	ME400016	0.07	0.04	13.19	0.04	0.09	0.59	0.02	0.09	0.04	0.70	0.17	0.15	0.97
Salicylic acid	ME400192	0.02	0.01	4.63	0.15	0.01	0.01	0.06	0.02	0.02	17.40	0.01	0.03	1.10
5-acetyl-2,6-dimethyl-1,2,3,4-tetrahydropyridin-4-one	ME400018	0.24	0.22	0.25	0.36	0.26	1.02	0.85	0.24	0.26	12.34	0.27	0.26	0.38
Pyridoxine	ME400188	0.04	0.04	1.27	0.18	0.70	0.92	0.35	0.03	0.14	11.02	0.06	0.24	1.09
Phenol	ME400182	0.64	0.28	3.83	0.30	0.33	0.35	0.45	0.02	0.60	11.96	0.34	0.39	0.80
Pseudoephedrine	ME400186	0.11	0.08	4.34	0.13	0.18	0.67	0.10	0.09	0.10	9.18	0.09	0.75	0.50
Cotinine	ME400052	8.11	0.03	0.81	1.65	0.43	0.44	2.31	1.32	1.32	4.55	0.03	0.70	0.78
Oxoamide	ME400175	3.68	0.10	1.53	0.92	0.44	0.42	3.81	1.68	4.36	3.44	0.13	0.92	0.50
L-Cysteine-S-sulfate	ME400131	0.44	1.25	1.40	0.68	0.93	0.85	0.82	5.84	1.09	0.70	0.19	1.30	0.83
Paraxanthine	ME400180	0.28	0.55	0.86	1.01	1.05	1.18	0.76	4.38	0.40	1.21	0.40	0.80	0.85
3-Pyridinol	ME400010	1.85	0.61	0.41	0.50	2.35	1.03	0.71	9.76	0.57	1.46	0.13	0.57	0.66
D-(-)-Quinic acid	ME400058	0.21	0.98	0.48	0.72	1.51	1.26	0.23	7.71	0.34	0.67	0.37	0.67	0.96
Taurochenodeoxycholic acid	ME400202	0.97	0.34	0.20	6.14	0.27	0.44	0.34	0.04	0.09	1.55	0.20	0.25	0.81
3-Hydroxyanthranilic acid	ME400002	1.73	0.24	3.37	0.61	0.47	1.15	0.44	0.73	0.57	3.68	0.26	0.45	0.85
Methyl indole-3-acetate	ME400154	2.16	2.96	0.61	0.46	1.71	0.81	0.22	0.64	0.10	0.88	1.96	1.28	0.95
Adenosine	ME400029	0.53	4.35	1.08	0.57	0.91	0.96	0.31	2.09	0.27	0.48	0.82	1.19	0.95
Inosine	ME400121	0.21	3.27	1.46	0.63	0.71	0.91	0.18	2.59	0.21	0.24	0.55	1.44	1.01
Vanillin	ME400210	0.89	4.42	0.58	0.69	0.54	1.26	0.50	0.64	1.07	0.75	0.42	0.68	1.39
Caffeine	ME400044	0.06	2.47	0.37	0.35	1.18	1.36	0.17	0.86	0.06	0.77	1.19	1.08	0.81
DL-Stachydrine	ME400069	0.56	3.34	1.06	1.02	0.87	1.09	0.31	0.69	0.32	0.30	0.32	1.01	1.12
Methylcysteine	ME400155	0.94	3.39	0.82	0.78	1.57	0.94	0.94	1.23	0.59	0.77	0.97	0.88	0.86
Pipecolic acid	ME400183	0.52	3.43	0.48	0.83	1.07	1.04	0.92	1.07	0.23	0.74	1.47	0.92	0.97
Tenofovir	ME400203	0.17	0.16	0.14	0.15	0.15	2.39	0.14	0.16	0.16	0.16	0.13	0.56	0.75
3-Phosphoglyceric acid	ME400009	2.33	1.22	1.08	1.09	0.77	0.99	1.38	0.12	2.15	1.96	1.77	0.59	0.87
Benzoic acid	ME400041	2.11	1.73	0.96	1.13	1.37	0.94	1.76	0.40	1.98	1.05	1.51	0.71	0.41
(2R)-2,3-Dihydroxypropanoic acid	ME399988	2.03	0.28	1.34	1.09	1.20	0.78	1.99	0.02	4.28	1.24	1.16	0.68	1.11
Glycylproline	ME400091	2.41	0.81	0.96	1.48	1.55	0.64	1.78	0.00	2.97	2.09	0.11	0.82	0.82
N-(2-hydroxyphenyl)acetamide	ME400159	0.01	0.06	0.01	0.01	1.31	1.54	1.44	0.01	0.01	3.34	0.01	0.41	1.52
Guvacoline	ME400093	0.43	0.66	0.99	0.30	1.08	0.94	0.46	0.83	0.35	2.41	0.30	1.58	0.84
Ecgonine	ME400080	0.47	0.44	0.90	0.69	0.70	0.86	0.90	0.53	1.01	4.25	0.49	1.18	0.91
Methylimidazoleacetic acid	ME400156	0.83	0.17	0.91	1.02	0.51	1.08	0.55	0.16	0.25	4.12	0.54	0.90	0.94
4-Hydroxyproline	ME400014	1.04	0.34	0.66	1.20	1.04	0.85	1.89	0.51	0.56	2.47	0.88	0.85	1.06
4-Methylphenol	ME400015	0.40	0.60	0.78	1.04	0.79	0.84	1.03	0.39	0.06	3.14	0.73	1.20	0.97
N-Phenylacetylglutamine	ME400169	0.78	0.36	0.81	0.75	0.85	0.91	1.51	0.22	0.13	3.30	0.41	1.19	0.79
3-Hydroxybutyric acid	ME400003	0.24	0.71	0.80	0.92	0.43	1.12	4.15	0.43	0.50	0.60	0.61	0.64	0.89
2-Hydroxy-3-methylbutyric acid	ME399998	0.77	1.28	0.62	1.40	0.84	0.67	3.59	0.62	0.57	0.62	0.57	0.99	1.01
2-Hydroxy-3-methylbutyric acid_2	ME399999	0.74	1.21	0.57	1.79	0.76	0.72	2.96	0.74	0.49	0.60	0.97	0.93	0.89
Adenosine monophosphate	ME400030	0.70	0.76	1.08	0.56	1.49	0.89	3.47	0.17	0.27	2.05	0.58	0.56	1.06
ADP	ME400032	0.98	0.58	1.94	0.71	1.71	0.95	2.17	0.14	0.61	2.33	0.34	0.38	1.05
D-Mannose	ME400071	0.71	0.44	0.35	1.73	0.66	1.10	1.33	0.03	0.59	0.48	1.87	0.55	1.68
D-Ribono-1,4-lactone	ME400076	0.06	0.04	0.07	1.98	0.66	1.36	1.28	0.01	0.04	0.02	2.02	0.64	0.83
Shikimic acid	ME400194	0.30	0.13	0.17	1.40	0.87	1.33	0.89	0.11	0.18	0.21	1.88	0.57	1.64
3-Furoic acid	ME400001	0.16	0.10	0.12	1.63	0.80	1.22	1.06	0.09	0.17	0.11	2.34	0.59	1.66
Citric acid	ME400050	0.17	0.11	0.13	1.71	0.85	1.23	1.09	0.09	0.18	0.12	2.07	0.56	1.60
Gluconic acid	ME400084	0.34	0.21	0.30	1.44	0.71	1.31	1.35	0.18	0.25	0.38	1.70	0.60	1.34
Malonic acid	ME400152	0.21	0.11	0.10	1.41	0.81	1.34	1.65	0.06	0.14	0.24	1.70	0.59	1.27
β-D-Glucopyranuronic acid	ME400212	0.12	0.06	0.09	1.42	0.75	1.37	1.59	0.03	0.05	0.14	1.46	0.60	1.37
cis-Aconitic acid	ME400047	0.63	0.41	0.38	1.21	0.80	1.19	0.85	0.17	0.66	0.52	3.45	0.61	1.44
Ascorbic acid	ME400040	0.13	0.21	0.12	2.09	1.01	1.13	0.83	0.06	0.22	0.13	3.01	0.82	0.65
Sorbic acid	ME400196	0.19	0.17	0.17	1.64	0.52	1.17	0.95	0.13	0.22	0.20	4.00	0.90	0.85
1-Methylnicotinamide	ME399993	2.75	0.24	1.51	0.45	0.42	1.70	0.31	0.91	0.42	2.23	0.26	0.34	0.88
2,4-Dihydroxybenzoic acid	ME399996	3.07	0.87	0.77	0.55	0.53	1.11	0.72	1.97	0.59	1.47	0.90	1.16	0.94
Adenosine triphosphate	ME400031	1.69	1.00	2.10	0.92	2.69	0.78	0.97	0.18	1.19	1.47	1.60	0.39	0.87
D-Fructose	ME400063	1.61	0.70	1.98	0.71	1.71	0.84	0.22	0.29	0.17	2.46	0.26	0.94	1.17
Piperine	ME400184	0.13	0.50	0.11	2.23	0.58	1.06	0.63	0.27	0.44	1.19	0.35	1.10	0.78
Glycocholic acid	ME400088	1.93	0.57	0.32	2.91	0.71	0.95	1.09	0.05	0.20	1.45	0.50	0.51	0.91
Glycoursodeoxycholic acid	ME400090	0.61	0.67	0.48	2.40	0.64	0.99	1.09	0.04	0.18	2.10	0.79	0.59	0.94
Methionine sulfoxide	ME400153	1.24	0.71	0.86	2.35	0.49	0.82	0.83	0.36	0.43	1.29	0.76	0.93	1.08
2-Furoylglycine	ME399997	0.14	0.39	0.47	0.86	2.53	1.61	0.07	0.19	0.06	0.44	0.18	0.39	0.83
13,14-Dihydro-15-keto Prostaglandin A2	ME399991	0.36	0.46	0.30	0.87	1.82	1.42	0.26	0.81	0.46	0.66	0.50	0.80	0.81
Testosterone sulfate	ME400204	0.26	0.27	0.79	0.77	1.36	1.16	0.69	1.39	0.28	0.31	0.38	1.22	0.97
16-Hydroxyhexadecanoic acid	ME399992	0.60	2.79	0.98	0.70	0.96	0.96	1.45	1.70	2.36	0.54	1.14	0.89	0.94
Decanoylcarnitine	ME400060	0.35	1.90	1.29	0.94	0.81	0.77	2.86	1.42	1.59	0.88	0.51	0.93	0.91
Hexanoylcarnitine	ME400113	0.60	1.46	1.16	0.85	0.88	0.86	1.96	1.79	1.70	0.91	0.85	0.98	0.98
Hippuric acid	ME400114	0.37	0.55	2.88	0.84	0.81	0.79	0.41	1.71	0.37	1.01	0.69	1.29	1.00
Pantothenic acid	ME400179	0.41	0.46	2.26	0.40	0.74	1.26	0.36	0.97	0.83	1.35	1.52	0.86	0.86
9-Methyluric acid	ME400025	0.78	0.43	0.96	0.78	0.87	1.31	0.28	2.69	0.65	2.77	0.33	0.69	0.78
7-Methylxanthine	ME400022	0.99	0.56	0.78	0.67	0.71	1.41	0.18	1.69	0.90	1.84	0.32	0.86	0.90
1,7-Dimethyluric acid	ME399990	0.22	0.80	0.86	0.59	0.91	1.43	0.39	1.86	0.43	1.27	0.44	0.87	0.84
3-Methoxyphenylacetic acid	ME400005	0.34	0.31	0.51	0.45	1.49	1.56	0.47	1.80	0.56	1.20	0.64	0.63	0.81
Xanthine	ME400211	1.03	2.04	1.03	0.73	1.03	0.92	1.10	2.48	1.32	0.79	0.83	1.09	0.90
Hypoxanthine	ME400116	0.22	1.79	1.47	0.81	1.03	0.85	0.65	2.03	1.20	0.64	0.71	1.33	0.88
Orotic acid	ME400174	0.64	1.42	1.66	0.67	1.00	1.04	0.81	1.61	1.43	1.18	0.40	0.97	0.91
L-Cystine	ME400132	0.95	1.48	1.59	0.85	0.79	1.07	0.75	2.73	0.37	0.73	0.27	1.18	0.53
Heavy Cystine	ME400096	0.67	0.99	1.44	0.76	0.88	0.90	0.97	1.85	0.81	0.64	1.17	1.45	0.52
Heavy Aspartic Acid	ME400095	0.55	1.15	1.21	0.89	0.89	1.00	0.88	1.94	0.58	0.40	1.53	1.36	0.42
Heavy Serine	ME400105	0.52	0.97	1.15	0.89	0.91	0.98	0.97	1.82	0.67	0.46	1.46	1.37	0.46
Heavy N-Acetylaspartic acid	ME400101	0.67	1.56	1.31	0.69	1.06	0.93	0.69	2.14	0.92	0.68	0.91	1.44	0.47
L-Asparagine	ME400128	0.80	1.15	1.24	0.91	0.94	0.98	0.94	1.86	0.72	0.71	0.72	1.24	0.68
L-Serine	ME400146	0.66	1.29	1.15	0.82	0.88	0.96	0.90	1.98	0.54	0.75	0.80	1.41	0.54
Aminoadipic acid	ME400036	0.38	0.85	0.97	0.70	1.04	1.23	0.56	2.59	0.59	0.54	1.12	1.13	0.56
Glycerol 3-phosphate	ME400085	0.35	1.34	1.27	0.63	0.85	0.99	0.51	2.24	0.43	0.21	1.02	1.75	0.25
Gamma-Aminobutyric acid	ME400083	0.53	1.77	0.88	0.72	0.89	1.11	0.42	2.94	0.48	0.64	0.79	1.32	0.53
L-Aspartic acid	ME400129	0.41	1.66	1.23	0.71	0.75	1.03	0.58	2.56	0.62	0.73	0.72	1.48	0.36
N2-Methylguanosine	ME400160	1.05	1.25	1.51	0.82	1.28	0.83	1.12	3.24	1.91	0.71	0.25	1.10	0.83
Quinolinic acid	ME400191	1.54	1.15	1.82	0.77	0.90	0.89	0.79	3.38	0.68	1.05	1.10	1.18	0.53
Capric acid	ME400045	0.40	1.84	1.18	0.64	0.49	1.35	0.77	0.46	0.65	0.29	0.72	0.92	1.10
Dodecanoic acid	ME400075	0.28	0.96	2.09	0.37	0.57	1.57	0.78	0.48	0.64	0.28	0.65	0.63	0.98
Trigonelline	ME400206	0.51	1.08	0.71	1.31	1.11	1.27	0.18	0.98	0.31	1.58	0.85	0.61	1.00
3-Methylhistidine	ME400007	0.98	0.14	0.77	1.02	0.73	1.23	0.46	0.15	0.16	1.20	0.49	1.12	1.08
Trimethylamine N-oxide	ME400207	0.60	0.29	0.83	1.29	0.94	1.17	0.63	0.28	0.21	1.92	0.46	0.85	1.00
Argininosuccinic acid	ME400039	0.54	0.49	1.45	1.82	0.63	0.92	1.05	0.59	0.33	0.50	0.99	1.02	0.92
Jasmone	ME400123	1.20	0.52	0.82	1.47	0.64	0.88	0.98	0.31	0.71	0.88	0.55	0.96	1.87
L-Acetylcarnitine	ME400124	0.95	0.96	1.33	0.89	1.01	0.99	1.44	1.09	2.05	1.27	0.84	0.86	0.83
Palmitoyl sphingomyelin	ME400178	1.45	0.99	1.47	1.21	1.16	0.88	1.53	0.75	2.20	1.21	0.78	0.83	0.67
9-Oxo-10(E),12(E)-octadecadienoic acid	ME400026	1.32	1.94	0.83	1.53	0.87	0.77	1.94	0.24	2.29	1.47	0.53	0.89	0.72
Stearidonic Acid	ME400198	1.05	1.61	0.79	1.52	0.88	0.86	1.32	0.46	1.90	1.20	1.02	0.92	0.80
3-methylphenylacetic acid	ME400008	0.52	0.63	0.45	1.00	0.88	1.02	0.73	0.51	0.43	0.71	1.66	1.37	0.93
2,2-Dimethylsuccinic acid	ME399995	0.74	0.27	0.35	1.11	1.19	1.29	0.76	0.22	0.43	0.82	1.21	0.89	0.88
D-Ribose 5-phosphate	ME400077	0.43	0.56	0.46	1.22	1.26	1.52	0.44	0.31	0.50	0.47	1.44	0.63	0.54
Sarcosine	ME400193	1.55	0.68	0.87	1.05	1.67	0.97	0.86	0.45	0.77	1.15	1.73	0.80	0.93
Ethylmalonic acid	ME400082	0.77	0.97	0.54	1.27	0.88	1.07	1.57	0.26	0.52	1.48	1.31	0.73	1.02
D-Glucose	ME400064	1.12	0.66	0.67	1.31	1.01	1.08	1.13	0.70	0.72	1.10	1.48	0.77	0.97
Crotonic acid	ME400056	0.67	0.61	0.55	1.48	1.12	1.08	1.04	0.46	0.62	0.96	1.67	0.71	1.06
Acrylic acid	ME400028	0.83	0.71	0.61	1.26	1.03	1.14	1.13	0.54	0.72	1.10	1.59	0.68	1.01
Glyoxylic acid	ME400092	0.85	0.61	0.61	1.32	1.01	1.10	1.02	0.47	0.66	1.19	1.54	0.71	1.14
D-Saccharic acid	ME400078	0.48	0.64	0.47	1.01	0.72	1.33	1.37	0.12	1.14	0.66	1.05	0.67	1.24
Hydroxyisocaproic acid	ME400115	0.76	1.03	0.59	1.19	1.00	0.89	2.08	0.70	1.00	0.72	0.81	1.01	1.01
Eicosapentaenoic Acid	ME400081	0.26	0.71	0.91	0.83	1.39	0.92	0.86	0.75	2.27	0.78	1.59	1.12	0.96
Docosahexaenoic Acid	ME400072	0.28	1.21	1.05	1.25	1.38	0.87	1.23	0.76	1.14	0.53	2.04	0.90	0.93
Pentadecanoic acid	ME400181	0.40	1.42	1.17	0.64	0.72	1.18	0.79	1.80	1.28	0.40	1.45	1.02	0.90
Arachidonic acid	ME400038	0.49	1.06	0.92	1.01	1.22	0.98	1.34	1.03	1.67	0.77	1.30	0.88	0.96
8,11,14-Eicosatrienoic acid	ME400023	0.48	1.45	1.23	0.90	1.16	0.97	1.00	1.32	1.62	0.60	1.75	0.93	0.92
Oleic Acid	ME400171	0.45	1.59	1.20	0.84	0.84	0.99	1.36	1.44	1.68	0.66	1.48	0.93	0.95
Myristic Acid	ME400158	0.55	1.72	1.07	0.69	0.92	1.09	1.05	1.30	1.36	0.64	1.32	0.95	0.96
Palmitic Acid	ME400177	0.63	1.90	1.14	0.89	1.01	0.99	1.34	1.32	1.46	0.66	1.20	0.83	1.03
Adrenic acid	ME400033	0.52	1.81	0.79	1.05	1.02	1.03	1.44	1.39	1.48	0.70	1.46	0.79	0.85
Docosapentaenoic Acid	ME400073	0.30	1.51	0.84	1.04	1.27	0.90	1.32	1.45	1.69	0.54	1.54	1.00	0.84
Deoxycholic acid	ME400061	2.33	0.53	1.22	0.88	1.22	1.08	1.25	0.87	0.34	0.75	0.67	0.88	0.91
Glycolic acid	ME400089	1.42	0.90	1.09	1.03	1.07	0.99	0.94	0.64	0.01	0.91	1.17	1.05	0.94
Nicotinamide 1-oxide	ME400168	1.54	0.51	0.89	0.84	0.68	1.48	0.40	0.73	1.12	1.29	0.57	0.70	0.85
7-Methylguanine	ME400021	2.48	1.25	0.99	0.97	0.84	0.98	1.10	1.29	1.29	1.44	0.88	0.92	0.88
5-Hydroxyindole-3-acetic acid	ME400019	2.12	0.82	1.27	0.79	1.03	1.01	0.76	1.21	1.12	0.94	0.95	1.05	0.93
L-Kynurenine	ME400139	2.12	0.82	1.28	0.79	1.03	1.01	0.77	1.21	1.13	0.94	0.95	1.05	0.92
Glycerophospho-N-palmitoyl ethanolamine	ME400086	1.93	1.68	0.97	0.76	1.22	0.94	0.94	1.03	0.97	0.97	1.42	0.97	0.99
Oxoglutaric acid	ME400176	1.46	1.14	0.80	0.77	0.88	0.92	1.02	1.67	0.92	1.06	1.39	1.24	0.87
Indole-3-acetic acid	ME400118	0.65	0.38	0.66	0.83	1.31	0.99	1.15	0.75	0.32	0.96	0.58	1.31	0.87
5,5-Dimethylhydantoin	ME400017	0.71	0.72	0.94	1.00	0.89	0.97	0.84	0.86	0.66	1.16	0.84	1.35	0.70
DL-α-Aminocaprylic acid	ME400070	0.80	0.66	0.66	1.03	0.97	0.90	0.72	1.25	0.57	1.12	0.56	1.41	0.98
Citraconic Acid	ME400048	0.95	0.90	0.86	0.92	1.24	1.12	0.92	1.27	0.52	1.18	0.54	0.89	0.96
N6,N6,N6-Trimethyl-L-lysine	ME400161	0.91	0.53	0.93	0.95	1.15	1.01	1.05	1.02	0.73	1.56	0.57	0.99	0.98
Propionylcarnitine	ME400185	0.59	0.87	0.71	0.85	0.88	1.16	0.57	1.04	1.06	1.38	1.03	1.01	0.98
D-(-)-Mannitol	ME400057	0.77	0.67	0.75	0.71	1.14	1.33	0.51	0.47	0.47	1.74	0.47	0.79	1.01
3-Indoxyl sulphate	ME400004	0.81	0.74	0.97	0.89	0.81	1.16	0.72	0.39	0.70	1.47	0.83	1.00	0.94
4-Hydroxyindole	ME400013	0.65	0.73	0.97	0.86	0.76	1.24	0.76	0.35	0.67	1.39	0.75	0.96	0.90
3-Methylcrotonylglycine	ME400006	1.02	0.71	2.08	0.95	0.99	1.03	0.81	0.78	1.04	0.85	0.83	0.91	0.87
Diaminopimelic acid	ME400065	1.22	0.79	1.82	0.78	0.95	0.95	1.03	0.71	0.90	1.16	0.78	1.05	0.97
Alpha-Linolenic acid	ME400035	1.15	0.79	0.80	1.48	0.93	0.91	1.47	0.66	0.72	1.10	0.93	0.98	0.84
D-δ-Tocopherol	ME400079	1.04	1.02	0.89	1.43	0.99	0.97	1.45	0.72	0.97	0.88	0.82	0.88	0.85
Citral	ME400049	1.36	0.73	0.85	1.64	0.75	0.99	0.94	0.81	0.90	0.90	0.89	0.86	1.10
L-Methionine	ME400143	1.06	1.08	0.97	1.73	0.97	0.89	0.90	0.89	1.08	1.15	0.72	0.86	0.98
Dodecanedioic acid	ME400074	0.89	1.17	1.07	0.70	0.69	1.23	0.94	0.56	0.69	0.99	0.68	0.98	0.95
N-Acetylglutamic acid	ME400163	1.17	1.22	1.06	0.94	0.42	1.14	1.18	0.75	0.72	0.92	1.14	1.01	0.86
N-Acetyl-L-aspartic acid	ME400165	1.12	1.15	1.58	0.74	0.74	0.87	0.99	1.68	0.91	0.81	0.72	1.50	0.57
Citrulline	ME400051	1.06	0.97	1.17	0.72	0.78	0.99	1.18	1.43	0.85	1.07	1.21	1.21	0.74
Glycine	ME400087	0.74	1.03	1.41	0.74	0.90	0.92	0.97	1.46	0.69	1.06	0.97	1.36	0.61
Allantoin	ME400034	1.14	1.08	1.45	0.58	0.62	0.99	0.60	1.01	0.86	0.95	0.66	1.36	1.10
Pyroglutamic acid	ME400189	1.14	0.97	1.10	0.74	0.68	1.02	0.87	1.09	1.19	0.84	0.49	1.37	0.85
Indole-3-pyruvic acid	ME400120	0.69	0.86	1.20	0.72	1.09	1.03	0.77	1.35	0.72	0.63	0.75	1.23	0.91
L-Lactic acid	ME400140	0.74	1.17	1.16	0.81	1.09	0.92	0.83	1.17	0.95	0.85	0.84	1.24	0.96
Myo-inositol	ME400157	0.82	0.92	1.74	0.84	1.00	0.95	0.82	1.33	0.89	0.88	0.60	1.14	0.94
N-Acetylornithine	ME400166	0.95	0.93	1.59	0.83	1.32	0.98	0.49	1.39	0.82	0.94	0.62	1.05	0.98
(1^S,2^S)-3^,11^-dihydroxy-1^,2^,5^-trimethyl-8^-oxaspiro[oxirane-2,12^-tricyclo[7.2.1.0Â?,â·]dodecan]-5^-en-4^-one	ME399987	1.26	0.95	1.51	0.95	1.29	0.90	1.31	1.53	1.52	0.58	1.00	1.01	0.70
Bilirubin	ME400043	0.59	0.80	0.95	0.99	1.09	1.10	0.70	1.60	1.18	0.99	1.29	0.96	0.75
Heavy Glutamate	ME400097	0.88	1.00	1.07	1.03	1.06	0.96	1.15	1.47	1.09	0.76	1.41	1.01	0.81
Imidazolelactic acid	ME400117	0.94	0.78	1.10	0.69	1.23	1.01	1.15	1.52	1.23	0.63	1.00	1.10	0.85
L-Arginine	ME400126	1.92	0.88	1.22	1.04	0.98	0.96	1.21	0.58	1.38	1.26	1.09	0.86	0.97
DL-4-Hydroxyphenyllactic acid	ME400068	1.68	0.86	0.67	1.13	0.91	1.10	1.24	0.74	1.28	1.02	0.72	0.86	0.91
Succinic acid	ME400199	1.49	0.82	1.13	0.89	0.87	1.06	1.47	0.85	1.03	0.85	0.91	0.81	1.17
Betaine	ME400042	1.04	0.69	1.02	1.08	0.93	0.89	1.32	1.43	1.38	1.30	0.87	1.04	0.96
Choline	ME400046	1.20	1.55	0.99	0.90	0.94	0.93	0.94	1.28	1.29	1.17	0.81	1.08	0.99
L-Isoleucine	ME400138	1.04	1.36	1.08	0.86	0.83	1.10	0.77	1.07	0.88	1.18	0.77	1.01	0.87
Taurine	ME400201	1.15	1.17	1.17	0.88	1.17	0.98	0.95	1.07	0.89	1.46	0.73	0.88	1.09
L-Ascorbic acid 2-sulfate	ME400127	1.12	0.83	1.36	0.93	1.02	0.99	1.05	0.74	1.66	1.32	0.92	0.96	0.84
Oleamide	ME400170	1.28	1.05	1.38	0.99	1.16	0.92	1.08	1.01	1.52	1.41	0.79	0.89	0.91
Pseudouridine	ME400187	1.53	1.03	1.31	0.83	1.04	0.92	0.98	1.13	1.53	1.36	0.73	1.09	0.83
Hexadecanamide	ME400112	1.30	1.32	1.32	1.02	1.06	0.91	1.17	0.87	1.33	1.51	0.78	0.95	0.77
N6-Acetyl-L-lysine	ME400162	1.08	1.10	1.43	0.94	0.98	0.89	1.06	1.12	1.18	1.59	0.74	0.99	0.97
N-Acetyl-L-alanine	ME400164	1.28	0.99	1.42	1.02	0.99	0.95	0.96	1.05	1.21	1.36	0.82	0.94	0.92
D-Erythro-sphingosine 1-phosphate	ME400062	1.16	1.26	1.24	0.93	1.13	1.03	1.06	1.30	0.97	0.74	0.54	0.94	0.94
Uridine	ME400209	0.93	1.09	1.23	0.93	1.34	1.03	0.84	1.25	1.35	0.75	0.80	0.94	0.85
Indole-3-lactic acid	ME400119	1.44	0.84	0.89	0.84	0.97	1.10	0.91	0.85	0.93	0.79	0.85	1.10	0.90
Heavy Tyrosine_2	ME400109	1.17	1.15	1.16	1.01	1.15	0.92	1.06	1.21	1.63	1.12	1.13	0.97	0.84
L-Histidine	ME400136	1.55	1.15	1.16	0.92	1.04	0.95	1.03	1.29	1.52	1.02	0.93	0.99	0.93
Dimethylglycine	ME400066	1.59	1.08	0.91	1.04	1.17	0.93	0.91	1.34	1.25	1.28	0.82	0.98	0.96
L-Carnitine	ME400130	1.25	0.87	0.96	0.94	1.12	1.00	0.92	1.11	1.24	1.30	0.75	0.98	0.97
Symmetric dimethylarginine	ME400200	1.20	0.93	1.15	0.85	0.98	0.96	0.97	1.33	1.29	1.43	0.77	1.04	0.96
1,5-Anhydro-D-glucitol	ME399989	1.11	0.90	1.22	0.87	1.33	0.95	1.00	1.11	1.35	1.00	0.71	1.00	0.96
Isoquinoline	ME400122	1.13	1.00	1.09	0.88	1.16	0.96	1.00	1.07	1.25	0.89	0.84	1.09	0.93
Skatole	ME400195	1.20	0.98	1.01	0.80	1.25	0.99	0.83	1.18	1.19	0.84	0.75	1.12	0.93
6-Methylquinoline	ME400020	1.36	1.04	0.99	0.84	1.19	1.02	0.88	1.14	1.27	0.84	0.76	1.06	0.92
8-Hydroxyquinoline	ME400024	1.36	1.02	1.04	0.80	1.20	1.00	0.89	1.22	1.20	0.91	0.77	1.05	0.95
L-Tryptophan	ME400148	1.32	1.05	1.05	0.86	1.14	0.99	0.92	1.23	1.18	0.90	0.78	1.06	0.94
L-Leucine	ME400141	1.20	1.12	1.06	0.91	1.02	1.01	0.84	1.12	0.93	1.04	0.95	1.02	0.99
L-Lysine	ME400142	1.04	1.08	1.11	0.88	1.06	1.04	0.88	1.23	1.22	0.97	0.80	0.97	0.99
trans-Cinnamic acid	ME400205	1.16	1.24	1.10	0.94	0.99	1.02	0.86	1.06	1.17	1.05	0.86	1.01	0.92
L-Phenylalanine	ME400144	1.20	1.20	1.09	0.99	0.98	0.98	0.98	1.10	1.24	1.05	0.95	1.01	0.92
L-Valine	ME400150	1.19	1.13	1.06	1.00	1.08	0.96	1.03	1.13	1.27	1.04	0.83	1.00	0.94
1-Nitrosopiperidine (NPIP)	ME399994	1.23	1.00	1.00	0.86	0.86	1.02	1.00	1.28	1.38	0.99	0.78	1.08	0.94
Ornithine	ME400173	1.29	1.00	0.99	0.88	0.87	1.02	0.99	1.31	1.19	1.00	0.78	1.09	0.94
Heavy Oxoglutaric acid	ME400102	1.02	1.01	1.29	0.92	0.95	0.93	1.02	1.44	1.21	0.94	0.97	1.13	0.85
L-Glutamic acid	ME400134	1.09	1.11	1.12	0.93	0.91	0.96	0.96	1.28	1.18	1.01	0.92	1.15	0.83
L-Glutamine	ME400135	1.10	1.07	1.16	0.94	0.91	0.95	1.00	1.16	1.20	1.00	0.92	1.15	0.84
Creatine	ME400054	1.19	0.82	1.13	0.90	1.09	0.99	1.24	1.21	0.94	0.86	1.00	0.99	0.95
Heavy Taurine	ME400106	1.27	0.95	0.95	1.08	1.08	0.92	1.14	0.84	1.26	1.08	1.12	0.98	1.03
Heavy Threonine	ME400107	0.99	0.85	1.00	1.08	1.12	0.95	1.11	0.91	1.18	1.02	1.10	0.93	1.06
Heavy Histidine	ME400098	1.25	0.95	1.16	1.04	1.01	0.94	1.23	1.07	1.37	0.91	1.07	0.98	0.93
Heavy Phenylalanine	ME400103	1.20	0.94	1.07	1.02	1.06	0.94	1.21	1.03	1.29	0.94	1.05	1.03	0.89
Heavy Lysine	ME400099	1.25	0.86	1.05	1.00	1.11	0.94	1.15	1.00	1.36	0.97	0.99	1.02	0.94
Heavy Methionine	ME400100	1.19	0.94	1.12	0.94	1.11	0.92	1.15	1.05	1.33	0.99	0.99	1.05	0.93
Heavy Proline	ME400104	1.18	1.02	1.08	1.05	1.13	0.92	1.25	0.99	1.33	0.97	0.94	0.99	0.91
Heavy Valine	ME400110	1.16	0.87	1.11	1.03	1.13	0.89	1.28	0.94	1.40	0.96	0.97	1.04	0.92
Heavy Xanthine	ME400111	1.01	1.06	1.05	0.98	1.07	0.95	1.04	1.20	1.25	0.91	1.03	1.07	0.89
Heavy Arginine	ME400094	0.99	0.90	0.99	0.96	1.08	0.94	1.14	1.21	1.34	0.85	1.01	1.10	0.91
Heavy Tyrosine	ME400108	1.01	0.94	1.07	0.96	1.07	0.94	1.16	1.10	1.31	0.95	0.96	1.06	0.93
Acetophenone	ME400027	1.44	1.07	1.12	1.03	0.86	1.02	0.98	0.90	1.15	1.07	0.89	0.99	0.88
4-Hydroxybenzaldehyde	ME400011	1.48	1.10	1.07	1.00	0.94	1.04	0.90	0.76	1.32	1.04	0.86	0.94	0.99
Coumarin	ME400053	1.46	1.04	1.12	0.98	0.93	1.05	0.89	0.79	1.31	1.01	0.88	0.96	0.92
N-Benzylformamide	ME400167	1.48	1.12	1.08	0.99	1.00	1.02	0.96	0.92	1.34	0.93	0.91	0.94	0.96
2-Hydroxycinnamic acid	ME400000	1.47	1.10	1.04	0.96	1.02	1.01	1.02	0.79	1.37	1.02	0.92	0.95	0.95
L-Tyrosine	ME400149	1.47	1.11	1.04	0.96	1.02	1.01	1.02	0.79	1.37	1.02	0.92	0.95	0.95
Uric acid	ME400208	1.50	0.92	1.12	1.01	1.16	0.92	1.03	1.00	1.06	1.29	0.79	1.02	0.89
Creatinine	ME400055	1.01	0.79	0.95	1.01	1.05	0.99	0.98	0.91	0.91	1.29	0.77	1.03	0.97
Linoleic Acid	ME400137	1.27	0.82	1.09	0.92	1.07	0.97	1.12	0.77	1.14	1.17	0.82	1.05	0.92
L-Threonine	ME400147	1.19	0.92	0.98	1.08	1.00	0.96	1.14	0.85	1.08	1.21	0.83	0.95	1.07
D-2-Hydroxyglutaric acid	ME400059	0.76	0.81	0.90	1.13	0.78	1.17	1.21	0.93	0.47	0.61	1.17	0.99	0.68
Malic acid	ME400151	1.18	0.86	0.76	1.09	0.81	1.01	1.17	1.03	0.78	0.60	1.22	1.09	1.02
4-Hydroxybutyric acid (GHB)	ME400012	0.69	0.77	0.84	0.91	1.01	1.05	1.00	0.97	0.89	0.66	1.12	1.15	0.90
L-Ergothioneine	ME400133	0.75	1.02	0.87	1.00	0.80	1.07	0.88	0.79	0.83	0.59	1.26	1.11	0.98
Arachidic Acid	ME400037	0.77	0.90	1.18	0.97	1.09	0.89	1.17	0.92	0.83	0.90	1.26	0.95	1.33
Stearic Acid	ME400197	0.98	1.06	0.93	0.97	1.09	0.92	1.20	0.93	0.89	1.01	1.00	0.92	1.37
Pyruvic acid	ME400190	0.75	0.83	0.93	0.91	1.24	1.03	0.90	0.58	1.06	0.82	1.44	1.02	0.94
DL-3-Aminoisobutyric acid	ME400067	0.61	0.71	0.92	0.87	1.08	1.05	0.97	1.11	1.18	0.94	0.70	1.12	0.91
Oleoyl-L-α-lysophosphatidic acid	ME400172	0.97	0.68	0.97	0.68	1.21	1.05	0.75	1.06	0.95	0.89	1.00	1.14	0.97
L-Alanine	ME400125	0.93	1.00	0.98	0.93	1.14	0.98	0.92	0.91	1.29	0.98	1.16	1.03	0.97
L-Proline	ME400145	0.81	0.94	0.96	0.88	1.00	1.03	0.83	0.98	1.02	1.01	1.17	1.06	0.97

Factors:

F1	Non controllers (NC=1) or post-treatment controller (PTC=2):1 \| Gender:F \| Race/ethnicity:Black
F2	Non controllers (NC=1) or post-treatment controller (PTC=2):1 \| Gender:F \| Race/ethnicity:Hispanic
F3	Non controllers (NC=1) or post-treatment controller (PTC=2):1 \| Gender:F \| Race/ethnicity:White
F4	Non controllers (NC=1) or post-treatment controller (PTC=2):1 \| Gender:M \| Race/ethnicity:Black
F5	Non controllers (NC=1) or post-treatment controller (PTC=2):1 \| Gender:M \| Race/ethnicity:Hispanic
F6	Non controllers (NC=1) or post-treatment controller (PTC=2):1 \| Gender:M \| Race/ethnicity:White
F7	Non controllers (NC=1) or post-treatment controller (PTC=2):2 \| Gender:F \| Race/ethnicity:Black
F8	Non controllers (NC=1) or post-treatment controller (PTC=2):2 \| Gender:F \| Race/ethnicity:Hispanic
F9	Non controllers (NC=1) or post-treatment controller (PTC=2):2 \| Gender:F \| Race/ethnicity:White
F10	Non controllers (NC=1) or post-treatment controller (PTC=2):2 \| Gender:M \| Race/ethnicity:Black
F11	Non controllers (NC=1) or post-treatment controller (PTC=2):2 \| Gender:M \| Race/ethnicity:Hispanic
F12	Non controllers (NC=1) or post-treatment controller (PTC=2):2 \| Gender:M \| Race/ethnicity:White
F13	Non controllers (NC=1) or post-treatment controller (PTC=2):NA \| Gender:NA \| Race/ethnicity:NA

Data matrix