Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002416)

(Analysis AN003937)

Metabolite	Structure	F1	F2	F3	F4	F5
Salbutamol	ME575109	4.54	0.08	0.09	0.06	0.09
L-Glutamic acid	ME575070	0.03	0.28	0.05	0.05	4.80
Cyclic AMP	ME575033	NA	0.48	0.03	0.03	3.14
Saccharopine	ME575108	0.38	0.11	0.13	0.15	3.73
Cortisol	ME575030	0.21	3.44	0.02	0.03	0.04
Sphinganine	ME575116	0.00	3.43	0.01	0.00	0.01
Glycine	ME575052	0.10	0.89	0.93	3.23	0.15
2,5-Furandicarboxylic acid	ME574986	0.36	0.64	1.71	2.90	0.20
Cis-Aconitic acid	ME575027	0.27	0.72	1.91	2.33	0.18
Phosphoric acid	ME575098	0.01	0.45	1.79	2.53	0.01
L-Dopa	ME575069	0.43	0.53	2.31	1.03	0.27
Spermine	ME575115	1.09	0.62	2.27	0.34	0.79
4-Guanidinobutanoic acid	ME575000	0.10	1.51	1.55	0.01	0.81
DL-2-aminooctanoic acid	ME575041	0.02	1.80	1.97	0.42	0.48
Cytidine	ME575034	0.02	2.04	1.46	0.32	0.32
Cytosine	ME575036	0.04	2.15	1.42	0.59	0.42
Alloxan	ME575010	NA	0.35	1.14	1.85	NA
Glucosamine 6-sulfate	ME575049	0.01	0.06	1.05	1.60	NA
Alpha-N-phenylacetyl-L-glutamine	ME575011	NA	1.38	0.69	0.89	0.09
Benzoic acid	ME575017	NA	1.12	1.12	0.91	0.38
5-Hydroxy-L-tryptophan	ME575002	0.07	1.38	1.33	1.26	0.20
N-Acetylputrescine	ME575086	0.06	1.49	1.32	1.16	0.14
Creatinine	ME575032	0.03	1.41	1.43	1.38	0.07
L-Histidine	ME575072	0.02	1.37	1.50	1.39	0.07
m-Coumaric acid	ME575079	0.13	1.49	1.46	1.31	0.22
o-Tyrosine	ME575092	0.13	1.48	1.61	1.43	0.24
Carnosine	ME575021	0.09	1.23	1.66	1.47	0.15
L-Acetylcarnitine	ME575065	0.16	1.50	1.81	1.40	0.30
Cadaverine	ME575019	0.04	0.96	1.90	1.91	0.05
N-Acetyl-L-alanine	ME575084	0.13	0.95	1.44	1.92	0.47
Pyridoxal 5^-phosphate	ME575103	0.19	1.00	1.32	1.69	0.34
Citrulline	ME575028	0.65	0.87	NA	NA	1.57
Salicyluric acid	ME575110	0.19	1.77	0.44	0.20	1.35
4-Aminophenol	ME574998	1.49	0.66	1.13	0.53	0.94
Tiglylglycine	ME575121	1.79	0.63	1.35	0.29	0.72
N-Acetyl-D-glucosamine	ME575083	2.03	0.56	0.68	0.43	0.99
2,4-Diaminobutyric acid	ME574985	1.81	0.89	0.58	0.46	0.92
Azythromycin	ME575014	1.85	0.83	0.63	0.59	0.79
Sphingosine	ME575117	1.74	0.78	0.95	0.71	0.56
Uric acid	ME575127	2.03	0.75	0.69	0.84	0.30
Gluconolactone	ME575047	1.36	0.60	0.46	1.72	1.00
Glutathione	ME575050	1.32	0.66	0.49	1.61	0.94
PC(16:0/16:0)	ME575095	0.04	1.06	1.12	1.78	1.44
Epinephrine	ME575044	0.22	1.29	1.11	1.08	1.56
Urea	ME575126	0.52	1.13	0.84	1.20	1.44
1,11-Undecanedicarboxylic acid	ME574979	1.14	1.33	0.90	0.29	0.52
Glycerophosphocholine	ME575051	1.10	0.66	0.90	0.99	1.48
Glycyl-L-leucine	ME575053	1.18	0.58	0.59	0.59	2.04
Succinylacetone	ME575119	1.12	0.75	0.77	0.68	1.74
Glucosamine	ME575048	1.07	1.05	0.67	0.66	1.49
4-Ethylbenzoic acid	ME574999	1.12	1.11	0.92	0.50	1.25
Cinnamaldehyde	ME575024	1.26	1.04	0.94	0.50	1.11
Pyrocatechol	ME575104	0.98	1.04	1.08	0.59	1.29
Uridine	ME575128	1.03	1.05	0.87	0.64	1.37
Adenosine monophosphate	ME575008	1.68	0.61	0.71	0.63	1.23
Deoxyinosine	ME575039	1.52	0.73	0.62	0.67	1.28
L-Valine	ME575078	1.43	0.62	0.72	0.73	1.47
Elaidic acid	ME575043	1.38	0.78	0.67	0.64	1.50
L-Carnitine	ME575068	1.32	0.86	0.71	0.64	1.39
7,8-Dihydrobiopterin	ME575004	1.52	1.04	0.48	0.34	1.34
Creatine	ME575031	1.42	0.86	0.43	0.43	1.70
D-Alanine	ME575037	1.34	0.96	0.55	0.55	1.53
Thymidine	ME575120	0.79	0.95	1.27	1.43	0.68
3b-Hydroxy-5-cholenoic acid	ME574997	1.02	0.88	1.05	1.41	0.92
Acetone	ME575006	0.71	0.91	1.15	1.39	1.02
Propanal	ME575099	0.84	0.89	1.05	1.30	1.06
Sebacic acid	ME575112	0.88	1.42	0.90	0.75	0.80
Cinnamic acid	ME575025	0.91	0.96	1.06	0.80	1.33
Propylene glycol	ME575101	0.97	0.99	0.98	0.85	1.22
L-Kynurenine	ME575073	0.96	1.05	0.93	0.89	1.18
Valeric acid	ME575131	0.97	0.99	0.99	0.92	1.15
1,3,7-Trimethyluric acid	ME574981	0.96	1.13	0.81	0.83	1.23
Naproxen	ME575088	0.99	1.06	0.88	0.77	1.23
Phenylacetaldehyde	ME575097	1.10	1.04	0.87	0.81	1.23
Isobutyric acid	ME575062	0.97	1.10	1.14	0.80	0.96
Homogentisic acid	ME575056	0.96	0.91	0.99	1.12	1.10
S-Adenosylhomocysteine	ME575107	0.87	0.98	1.02	1.12	1.07
2-Ketobutyric acid	ME574988	0.92	0.98	1.12	0.92	1.11
Hypoxanthine	ME575057	1.02	1.04	0.96	0.88	1.07
Pyridine	ME575102	1.08	0.97	0.96	0.94	1.05
Inosine	ME575060	1.02	0.95	1.02	1.02	1.02
Succinic acid	ME575118	0.98	0.95	1.04	1.01	1.06
2-Ketohexanoic acid	ME574989	0.95	1.01	1.01	1.04	1.01
Serotonin	ME575113	1.02	1.00	0.99	1.02	0.96
2-Hydroxycaproic acid	ME574987	0.94	1.01	1.09	0.99	0.99
Cholic acid	ME575023	0.94	1.04	1.04	0.97	1.03
N-Acetylserotonin	ME575087	0.93	1.02	1.05	0.97	1.05
6-Dimethylaminopurine	ME575003	0.97	1.05	1.01	0.93	1.03
2,2-Dimethylsuccinic acid	ME574984	0.96	1.05	0.98	0.95	1.06
Chlorpheniramine	ME575022	0.94	1.07	1.00	0.94	1.06
1,3,5-Trimethoxybenzene	ME574980	0.61	1.12	1.19	0.95	1.23
Trimethylamine	ME575123	0.57	1.16	1.03	1.04	1.34
Normetanephrine	ME575090	0.69	1.15	0.99	0.99	1.25
Pantothenic acid	ME575094	0.74	1.13	1.00	0.96	1.23
Maltitol	ME575080	0.53	1.08	1.25	1.23	1.02
Aspartame	ME575013	0.62	1.19	1.18	1.13	0.98
Oxypurinol	ME575093	0.60	1.18	1.18	1.09	1.06
Guanine	ME575055	0.78	1.17	0.94	1.13	1.05
Anserine	ME575012	0.75	1.24	1.14	0.92	0.96
5^-Methylthioadenosine	ME575001	0.69	1.28	1.12	0.90	1.03
Propionic acid	ME575100	0.69	1.22	1.20	0.88	1.05
L-Methionine	ME575074	0.75	1.06	1.29	1.02	0.98
N,N-Dimethylformamide	ME575082	0.74	1.11	1.21	1.02	0.99
Scyllitol	ME575111	0.76	1.11	1.18	1.06	0.96
Acetic acid	ME575005	0.84	1.12	1.11	1.03	0.92
Mevalonic acid	ME575081	0.88	1.07	1.14	0.98	0.96
3,4-Dihydroxyphenylglycol	ME574993	0.91	1.13	1.13	0.98	0.84
Niacinamide	ME575089	0.94	1.09	1.05	0.99	0.91
Benzene	ME575015	0.81	1.14	1.09	0.90	1.10
Caffeine	ME575020	0.89	1.13	1.02	0.94	1.00
FAD	ME575046	0.80	1.13	1.06	0.98	1.02
L-Tryptophan	ME575077	1.23	1.14	0.81	0.71	0.92
Indoleacrylic acid	ME575058	1.20	1.16	0.88	0.78	0.80
Nutriacholic acid	ME575091	1.28	1.10	0.84	0.80	0.74
2-Phenylbutyric acid	ME574990	1.11	1.10	1.15	1.04	0.51
Phenol	ME575096	1.21	1.10	1.04	0.95	0.62
3-Aminoisobutanoic acid	ME574994	0.91	1.08	1.08	1.14	0.80
2-Pyrrolidinone	ME574991	1.15	0.91	1.06	1.04	0.82
Diacetyl	ME575040	1.07	1.04	1.01	0.99	0.84
1-Butanol	ME574982	0.31	1.54	1.08	0.88	0.85
Uracil	ME575125	0.44	1.45	1.04	1.14	0.98
L-Arginine	ME575066	0.17	1.13	1.52	1.54	0.86
3-Hexenedioic acid	ME574995	0.32	1.37	1.59	1.04	0.76
Benzocaine	ME575016	0.55	1.21	1.43	1.16	0.78
Inosinic acid	ME575061	1.71	0.10	0.05	0.01	0.87
Adenine	ME575007	1.61	0.04	0.05	NA	1.68
Indoxyl sulfate	ME575059	0.98	0.07	NA	0.36	1.60
Biopterin	ME575018	1.05	NA	0.03	NA	1.13
Isovalerylcarnitine	ME575063	1.23	0.04	0.03	NA	1.30
Uridine 5^-monophosphate	ME575129	1.29	0.02	NA	0.03	1.22
ADP	ME575009	2.49	0.04	0.04	0.04	2.14
L-Aspartic acid	ME575067	2.23	0.07	0.04	0.05	2.31
Cis,cis-Muconic acid	ME575026	1.44	0.24	0.12	0.13	2.53
Pyroglutamic acid	ME575105	1.92	0.11	0.12	0.10	2.73
N-Acetyl-L-aspartic acid	ME575085	1.87	0.03	0.03	0.04	2.27
Ribothymidine	ME575106	1.82	0.07	0.09	0.08	2.35
Cytidine monophosphate	ME575035	1.54	0.69	0.24	0.27	2.14
Guanidine	ME575054	1.85	0.31	0.59	0.56	1.61
Kynurenic acid	ME575064	1.74	0.75	NA	0.07	0.42
3,4,5-Trimethoxycinnamic acid	ME574992	1.53	0.04	0.05	NA	0.06
3-Hydroxymethylglutaric acid	ME574996	1.77	0.01	NA	0.02	0.01
L-Glutamine	ME575071	2.82	0.40	0.16	0.19	0.85
L-Norleucine	ME575075	2.37	0.40	0.10	0.02	1.16
Sorbitol	ME575114	2.34	0.73	0.06	0.02	1.32
DL-a-glycerophosphate	ME575042	3.35	0.14	0.08	0.11	0.13
Urocanic acid	ME575130	3.43	0.02	0.02	0.02	0.12
Cortexolone	ME575029	2.54	0.01	0.01	0.02	0.01
L-Threonine	ME575076	2.44	0.01	0.00	0.00	0.00
Deoxyadenosine	ME575038	2.45	0.24	0.58	0.19	0.52
Traumatic acid	ME575122	2.54	0.26	0.44	0.64	0.20

Factors:

F1	Group:Normal
F2	Group:Preventative1707
F3	Group:Prophylactic1707
F4	Group:Therapeutic1707
F5	Group:Vehicle

Data matrix