Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Metabolomic study on a schizophrenia and type 2 diabetes susceptibility gene (Study ST000568)

UPLC NEGATIVE ION MODE (Analysis AN000875)

Metabolite	Structure	F1	F2	F3
5-hydroxy-tryptophan	ME168631	0.90	1.50	0.61
(S)-2-hydroxy-isocaproic acid	ME168610	0.90	1.47	0.63
adenine	ME168638	1.06	1.31	0.63
fumaric acid	ME168663	0.98	1.38	0.64
mandelic acid	ME168689	0.64	1.43	0.93
paraxanthine(1,7-dimethylxanthine)	ME168704	0.69	1.63	0.68
theophylline	ME168719	0.68	1.68	0.64
indole-3-butyric acid	ME168676	1.03	0.51	1.47
pipecolinic acid	ME168709	0.94	0.75	1.31
citric acid	ME168652	0.87	0.85	1.28
terephthalic acid	ME168717	0.82	0.81	1.37
capric acid (C10:0)	ME168648	1.39	0.83	0.78
lauric acid (C12:0)	ME168683	1.35	0.79	0.86
maltose	ME168688	0.82	1.04	1.14
isocaproic acid	ME168678	0.81	1.10	1.09
isovaleric acid	ME168681	0.79	1.14	1.07
cholic acid	ME168650	0.72	1.20	1.08
isolithocholic acid	ME168680	0.73	1.16	1.11
leucine	ME168684	0.88	1.24	0.87
1-methyluric acid	ME168611	1.04	1.23	0.73
3-methylxanthine	ME168623	1.07	1.21	0.72
glycolithocholic acid	ME168667	0.96	1.15	0.90
oxypurinol	ME168701	0.95	1.19	0.86
allantoin	ME168640	0.99	1.23	0.79
2^-o-methyladenosine	ME168617	1.00	1.17	0.83
theanine	ME168718	1.00	1.19	0.81
aspartic acid	ME168646	1.02	1.15	0.83
stearic acid (C18:0)	ME168715	1.04	1.13	0.83
3,4-dehydro-proline	ME168618	0.96	0.83	1.19
7-ketolithocholic acid	ME168635	0.92	0.97	1.11
proline	ME168710	0.89	0.97	1.14
quinic acid	ME168713	0.91	0.94	1.15
xylitol	ME168732	0.90	0.95	1.15
valeric acid (C5:0)	ME168729	0.99	0.89	1.13
4-hydroxybenzaldehyde	ME168626	1.00	0.92	1.08
taurine	ME168716	0.98	0.93	1.09
chenodeoxycholic acid	ME168649	0.93	1.08	0.99
shikimic acid	ME168714	0.93	1.09	0.97
23-nordeoxycholic acid	ME168614	0.99	1.06	0.95
formylglycine	ME168662	0.98	1.06	0.96
alpha-alanine	ME168641	0.97	1.06	0.98
5-hydroxymethylcystein	ME168630	0.96	1.07	0.98
homoserine	ME168672	0.96	1.07	0.97
2,5-dihydroxybenzoic acid	ME168612	1.03	1.07	0.90
N-alpha-acetyl-ornithine	ME168696	1.04	1.06	0.90
pyridoxal	ME168711	1.01	1.07	0.92
uracil	ME168725	1.02	1.06	0.92
5-methoxy-dtryptophan	ME168632	1.04	1.02	0.94
guanosine	ME168668	1.03	1.03	0.94
4-hydroxy-proline	ME168627	1.01	1.04	0.95
hippurate	ME168670	1.02	1.04	0.94
trans-cinnamic acid	ME168722	1.00	1.06	0.94
tryptophan	ME168723	1.01	1.05	0.93
phenylalanine	ME168707	1.03	1.09	0.88
N-acetyl-methionine	ME168694	0.99	1.13	0.88
tyrosine	ME168724	1.00	1.13	0.88
acetaminophen	ME168637	1.00	1.10	0.91
citrulline	ME168653	1.00	1.10	0.90
glutamic acid	ME168664	1.00	1.10	0.90
4-aminobutyric acid	ME168625	1.00	1.11	0.89
N-oleoylethanolamine	ME168697	1.01	1.10	0.89
isoleucine	ME168679	0.99	1.08	0.93
lithocholic acid	ME168687	1.00	1.08	0.93
N-acetyl-5-hydroxytryptamine	ME168693	0.97	1.10	0.93
p-coumaric acid	ME168705	0.98	1.09	0.93
3-ketocholanic acid	ME168621	0.95	1.10	0.95
pyroglutamic acid	ME168712	0.94	1.12	0.93
xanthosine	ME168731	0.96	1.12	0.92
arabionse	ME168643	0.93	1.04	1.03
6-aminocaproic acid	ME168634	0.98	0.95	1.06
norepinephrine	ME168698	0.98	0.97	1.05
glutamine	ME168665	0.93	1.00	1.06
glycine	ME168666	0.96	0.99	1.05
uridine	ME168726	0.96	1.00	1.04
myo-inositol	ME168691	0.95	0.98	1.06
deoxycholic acid	ME168655	0.95	0.97	1.08
o-acetyl-serine	ME168699	0.96	0.97	1.07
azelaic acid	ME168647	1.04	0.93	1.02
2,6-di-tert-butyl-4-methylphenol	ME168613	1.02	0.95	1.03
3-hydroxybutyric acid	ME168619	1.02	0.95	1.04
docosahexaenoic acid (DHA,cis-4,7,10,13,16,19-C22:6,n-3)	ME168656	1.02	0.95	1.04
3-indoleacetonitrile	ME168620	1.05	0.98	0.97
thyroxine	ME168720	1.06	0.99	0.96
linoleic acid (cis-9,12-C18:2)	ME168685	1.03	0.97	0.99
creatinine	ME168654	1.01	1.00	0.99
eicosapentaenoic acid (cis-5,8,11,14,17-C20:5)	ME168659	1.02	1.00	0.98
eicosenoic acid (cis-11-C20:1,n-9)	ME168660	1.04	1.00	0.96
3-methylindole	ME168622	1.03	0.99	0.97
arachidonic acid (cis-5,8,11,14-C20:4,n-6)	ME168644	1.03	0.99	0.97
hydrocortisone	ME168673	1.03	0.99	0.98
linolenic acid	ME168686	1.03	0.99	0.98
indole	ME168675	1.00	0.98	1.02
urocanic acid	ME168727	0.98	1.03	0.98
7Z,10Z,13Z-hexadecatrienoic acid (7Z,10Z,13Z-C16:3)	ME168636	1.00	1.02	0.99
asparagine	ME168645	0.99	1.02	0.99
N-alpha-acetyl-lysine	ME168695	0.98	0.99	1.02
valine	ME168730	0.99	1.00	1.01
lactic acid	ME168682	0.98	1.02	1.00
ursodeoxycholic acid	ME168728	0.97	1.01	1.02
p-hydroxyphenyllactic acid	ME168708	0.97	1.01	1.01
5-aminolevulinic acid	ME168629	0.98	1.01	1.01
apocholic acid	ME168642	0.98	1.01	1.01
hyodeoxycholic acid	ME168674	1.15	1.03	0.82
inosine	ME168677	1.08	1.04	0.88
4^,5,7-trihydroxyisoflavone	ME168624	1.10	1.00	0.90
2-methyl-4-pentenoic acid	ME168616	1.08	0.99	0.93
heptadecanoic acid (C17:0)	ME168669	1.08	0.99	0.93
5-phenylvaleric acid	ME168633	1.06	1.02	0.92
eicosadienoic acid (cis-11,14-C20:2, n-6)	ME168658	1.07	1.01	0.92
2-hydroxy-3-methylbutyric acid	ME168615	1.18	0.93	0.89
histidine	ME168671	1.10	0.89	1.01
palmitic acid (C16:0)	ME168703	1.10	0.95	0.95
pentadecanoic acid (C15:0)	ME168706	1.10	0.94	0.96
elaidic acid (trans-9-C18:1)	ME168661	1.07	0.96	0.97
oleamide	ME168700	1.08	0.94	0.98
murocholic acid	ME168690	1.15	0.88	0.97
cis-8,11,14-eicosatrienoic acid (cis-8,11,14-C20:3 n-6)	ME168651	1.14	0.93	0.93
myristic acid (C14:0)	ME168692	1.11	0.91	0.97
adrenic acid (cis-7,10,13,16-C22:4)	ME168639	1.12	0.93	0.95
docosapentaenoic acid (cis-4,7,10,13,16-C22:5, 22n-6)	ME168657	1.14	0.91	0.95
palmitelaidic acid (trans-9-C16:1)	ME168702	1.13	0.91	0.96
4-hydroxytolbutamide	ME168628	0.40	0.36	2.24
tolbutamide	ME168721	0.07	0.07	2.87

Factors:

F1	Genotype:AA
F2	Genotype:AC
F3	Genotype:CC

Data matrix