Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST001970)

HILIC NEGATIVE ION MODE (Analysis AN003214)

Metabolite	Structure	F1	F2	F3
Inosine	ME455159	0.01	0.01	2.88
Uridine diphosphategalactose	ME455213	0.04	1.24	1.75
Uridine diphosphate-N-acetylgalactosamine	ME455211	NA	0.39	1.55
Adenine	ME455118	NA	1.76	0.32
3-Hydroxymethylglutaric acid	ME455097	NA	1.59	0.47
Benzyl alcohol	ME455126	NA	1.59	0.47
Cyclohecane-1,2-Diol	ME455208	NA	2.11	0.00
Caproic acid	ME455149	NA	2.11	0.00
2-Deoxy-D-Glucose	ME455083	NA	2.11	0.00
6-deoxy-l-galactose	ME455116	NA	2.11	0.00
Homovanillic acid	ME455153	NA	1.98	0.12
Pantothenic acid	ME455139	NA	1.90	0.19
Pterin	ME455192	1.51	0.44	NA
L-Valine	ME455171	1.90	0.00	NA
2-Methylglutaric acid	ME455085	1.95	NA	0.05
Cholic acid	ME455131	2.00	NA	0.00
trans-Aconitic acid	ME455206	1.41	NA	0.59
Hippuric acid	ME455150	1.70	NA	0.30
Indoleacetic acid	ME455156	1.62	NA	0.38
3-Hydroxycapric acid	ME455080	1.85	1.17	0.00
Urocanic acid	ME455215	1.95	0.95	0.09
Xanthine	ME455216	1.98	1.03	0.00
12-Hydroxydodecanoic acid	ME455187	1.97	0.81	0.21
Itaconic acid	ME455160	2.05	0.84	0.09
Lithocholyltaurine	ME455202	1.27	0.70	1.00
Cyclic AMP	ME455092	1.09	1.08	0.83
L-Tyrosine	ME455170	1.19	1.12	0.71
4-Hydroxybenzoic acid	ME455110	1.33	0.97	0.69
Uracil	ME455209	1.33	1.05	0.63
3-Hydroxybenzoic acid	ME455100	1.47	0.88	0.64
2,5-dihydroxybenzoate	ME455091	1.55	0.94	0.51
Protocatechuic acid	ME455106	1.46	1.04	0.51
Deoxycytidine	ME455143	1.04	0.96	NA
arabinose	ME455123	1.04	0.95	NA
ribose	ME455140	1.04	0.95	NA
2-Amino-4-oxo-6-(1^,2^-dioxoprolyl)-7,8-dihydroxypteridine	ME455089	0.94	1.06	NA
Xanthosine	ME455217	0.95	1.06	NA
cytidine 2,3-cyclic monophosphate	ME455133	0.99	1.02	NA
Ureidopropionic acid	ME455105	0.97	1.04	NA
D-Lyxose	ME455137	1.15	0.83	NA
trans-Cinnamic acid	ME455207	1.29	0.67	NA
Dihydroxyacetone phosphate	ME455144	1.01	1.47	0.57
3-(2-Hydroxyphenyl)propanoic acid	ME455093	1.70	1.34	0.00
Phenylacetic acid	ME455191	1.73	1.30	0.00
p-Hydroxyphenylacetic acid	ME455111	1.72	1.31	0.00
3-hydroxyphenylacetate	ME455101	1.63	1.41	0.00
Ortho-Hydroxyphenylacetic acid	ME455084	1.63	1.41	0.00
Ethylmalonic acid	ME455145	1.59	1.45	0.00
Pimelic acid	ME455115	1.60	1.43	0.01
3,4-Dihydroxybenzeneacetic acid	ME455107	1.54	1.51	0.00
3-methyglutaric acid	ME455102	1.49	1.48	0.08
4-Hydroxybenzaldehyde	ME455109	1.48	1.31	0.23
Suberic acid	ME455198	1.52	1.32	0.19
Methyl beta-D-glucopyranoside	ME455176	1.57	1.25	0.20
N-Acetyl-L-phenylalanine	ME455184	1.54	1.24	0.24
2,4-dihydroxypyrimidine-5-carboxylic acid	ME455090	1.54	1.23	0.26
Ribitol	ME455194	1.55	1.22	0.25
Guanine	ME455148	1.61	1.27	0.15
Succinic acid	ME455199	1.58	1.36	0.10
galactose	ME455136	1.43	1.33	0.28
Orotic acid	ME455188	1.46	1.30	0.28
Azelaic acid	ME455124	1.43	1.29	0.32
3-hydroxybenzaldehyde	ME455099	1.44	1.29	0.30
Benzoic acid	ME455125	1.44	1.29	0.30
Galactitol	ME455146	1.38	1.28	0.37
Indoxyl sulfate	ME455158	1.35	1.33	0.36
Acetoacetic acid	ME455117	1.28	1.39	0.37
allose	ME455121	1.28	1.48	0.29
myo-Inositol	ME455180	1.30	1.49	0.26
L-Asparagine	ME455164	1.38	1.47	0.20
Homogentisic acid	ME455151	1.36	1.41	0.27
Citraconic acid	ME455086	1.39	1.43	0.22
L-Arabitol	ME455162	1.40	1.40	0.24
L-Glutamic acid	ME455165	0.96	1.94	0.19
Sorbose	ME455168	0.95	1.77	0.36
Deoxyguanosine	ME455081	1.12	1.98	0.00
Adipic acid	ME455120	1.33	1.68	0.06
Mono-methyl glutaric acid	ME455179	1.33	1.68	0.06
Ketoleucine	ME455103	1.21	1.74	0.12
Uric acid	ME455210	1.24	1.72	0.11

Factors:

F1	Protocole:P1
F2	Protocole:P3
F3	Protocole:P4

Data matrix