Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST001973)

Reversed phase NEGATIVE ION MODE (Analysis AN003219)

Metabolite	Structure	F1	F2	F3	F4	F5
Pantothenic acid	ME455888	0.57	0.00	0.00	2.95	1.48
Monoethyl malonic acid	ME455869	0.71	0.22	0.90	1.77	1.40
trans-Aconitic acid	ME455854	1.39	0.35	1.15	0.78	1.33
Acetylglycine	ME455882	1.34	0.79	0.63	1.10	1.14
2-Methyl-3-ketovaleric acid	ME455862	0.90	0.51	1.11	1.35	1.13
Azelaic acid	ME455865	0.73	0.76	1.03	1.24	1.23
5-Hydroxymethyluracil	ME455815	0.81	0.75	0.98	1.30	1.16
L-Asparagine	ME455822	0.77	0.71	1.09	1.30	1.13
Malonic acid	ME455844	0.99	0.92	0.90	1.10	1.09
Hippuric acid	ME455833	1.06	0.85	0.80	1.19	1.10
Inosine	ME455838	1.07	0.83	0.88	1.16	1.05
Vanillylmandelic acid	ME455812	1.02	0.77	0.77	1.32	1.12
3,4-Dihydroxymandelic acid	ME455868	0.95	0.87	0.78	1.31	1.09
Citramalic acid	ME455826	0.91	0.87	0.80	1.25	1.16
Norepinephrine	ME455848	0.92	0.81	0.74	1.23	1.30
Aminoadipic acid	ME455819	0.90	0.85	0.86	1.14	1.25
Caffeic acid	ME455824	0.95	0.78	0.84	1.22	1.21
4-Hydroxy-L-proline	ME455861	1.20	0.80	0.95	1.02	1.03
L-Glutamic acid	ME455878	1.15	0.87	0.92	1.01	1.06
N-Acetylserine	ME455885	1.15	0.87	0.92	1.01	1.06
D-Glucose	ME455871	0.99	0.76	1.04	0.97	1.24
3-Methylglutaric acid	ME455860	1.08	0.77	0.98	1.00	1.17
Succinic acid	ME455851	1.13	0.79	0.96	0.96	1.16
L-Lactic acid	ME455841	1.04	0.86	0.98	0.96	1.16
N-Acetyl-L-methionine	ME455884	0.99	0.83	1.03	0.98	1.16
L-Arginine	ME455821	1.02	0.72	0.98	1.23	1.05
L-Tryptophan	ME455855	0.93	0.80	1.06	1.20	1.01
3-Hydroxycapric acid	ME455804	1.14	0.65	0.93	1.09	1.18
Citrulline	ME455827	1.11	0.65	0.95	1.13	1.16
L-Kynurenine	ME455840	1.01	0.75	0.96	1.10	1.19
Uridine	ME455857	0.97	0.75	0.94	1.17	1.17
trans-Cinnamic acid	ME455825	0.67	0.85	0.64	1.65	1.19
Mannitol	ME455846	0.79	0.53	0.87	1.59	1.22
L-Dopa	ME455807	0.85	0.72	0.69	1.50	1.23
3-Hydroxybenzoic acid	ME455811	1.00	0.57	0.80	1.52	1.11
O-Succinyl-L-homoserine	ME455887	0.92	0.56	0.77	1.53	1.22
Fumaric acid	ME455830	0.87	0.68	0.84	1.50	1.12
L-Lysine	ME455842	0.97	0.59	0.86	1.39	1.18
L-Arabitol	ME455820	0.96	0.72	0.80	1.41	1.11
2-Deoxy-D-Glucose	ME455806	1.01	0.67	0.78	1.41	1.13
Cysteic acid	ME455877	1.03	0.64	0.79	1.45	1.10
Indoxyl sulfate	ME455875	0.86	0.75	0.80	1.69	0.90
Glyceric acid	ME455831	0.97	0.92	0.74	1.40	0.98
Hydroxyphenyllactic acid	ME455809	0.95	0.87	0.70	1.43	1.05
L-Cystathionine	ME455828	0.94	0.82	0.72	1.50	1.01
N6-(delta2-Isopentenyl)-adenine	ME455839	0.84	0.93	0.97	1.27	0.99
Homogentisic acid	ME455835	0.89	0.86	0.88	1.39	0.97
L-Pipecolic acid	ME455879	0.82	0.95	0.85	1.42	0.96
trans-Ferulic acid	ME455829	0.81	0.91	1.05	0.86	1.37
3-Dehydroshikimate	ME455810	0.77	1.18	0.69	1.32	1.04
D-Glucuronic acid	ME455873	0.95	1.12	0.81	1.20	0.92
Pyroglutamic acid	ME455816	0.75	1.07	1.05	1.25	0.89
D-Maltose	ME455845	0.86	0.89	1.10	1.08	1.07
Hypoxanthine	ME455837	0.79	1.04	0.98	1.09	1.10
N-Acetylserotonin	ME455886	0.85	1.24	0.99	0.94	0.99
Xanthine	ME455858	0.91	1.07	0.95	0.93	1.14
L-Histidine	ME455834	1.59	1.30	0.61	0.62	0.89
3-Methyldioxyindole	ME455813	1.11	0.93	1.10	0.93	0.93
Cytidine 2^,3^-cyclic phosphate	ME455867	1.14	0.84	1.24	0.91	0.88
Isocitric acid	ME455876	1.25	0.95	1.32	0.56	0.91
3-Oxoadipic acid	ME455864	1.41	0.81	1.19	0.75	0.84
Allantoin	ME455818	1.33	0.98	1.06	0.71	0.92
L-Serine	ME455850	0.85	1.34	1.24	0.60	0.97
Glucose 6-phosphate	ME455872	1.12	1.26	1.14	0.70	0.78
L-Aspartic acid	ME455823	0.96	1.34	1.23	0.69	0.78
3-Hydroxysuberic acid	ME455889	1.23	1.49	0.92	0.59	0.76
2-Methyl-2-oxovaleric acid	ME455863	0.86	1.70	0.90	0.76	0.79
L-Tyrosine	ME455856	0.92	1.60	0.92	0.71	0.85
Adenine	ME455817	0.89	1.37	0.99	0.83	0.91
N-Acetyl-L-aspartic acid	ME455881	0.86	1.52	0.94	0.83	0.85
Ciliatine	ME455805	1.69	1.00	1.50	0.32	0.50
N-Acetyl-4-O-acetylneuraminic acid	ME455880	1.38	0.55	1.84	0.36	0.87
L-Malic acid	ME455843	2.27	0.44	2.29	0.00	0.00
Thymidine	ME455853	2.20	1.18	1.54	0.08	0.00
N6-Acetyl-L-lysine	ME455883	1.56	2.03	0.24	0.38	0.79
Diaminopimelic acid	ME455859	1.19	2.11	0.88	0.33	0.49
Glyceraldehyde 3P diethyl acetal	ME455874	1.13	1.81	0.98	0.44	0.64
L-Homoserine	ME455836	1.23	1.94	1.37	0.20	0.27
Ureidopropionic acid	ME455814	1.11	2.25	1.31	0.07	0.26
L-Phenylalanine	ME455849	1.19	2.28	1.53	0.00	0.00
Taurine	ME455852	1.19	2.28	1.53	0.00	0.00
Guanine	ME455832	0.00	5.00	0.00	0.00	0.00
L-Methionine	ME455847	0.00	5.00	0.00	0.00	0.00
3-(2-Hydroxyphenyl)propanoic acid	ME455808	0.00	2.89	2.11	0.00	0.00
Cortisol 21 acetic acid	ME455866	0.00	3.39	0.33	0.00	1.28
Gluconic acid	ME455870	0.18	2.50	0.00	0.38	1.95

Factors:

F1	Protcole:P1
F2	Protcole:P2
F3	Protcole:P4
F4	Protcole:P5
F5	Protcole:P6

Data matrix