Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST001953)

(Analysis AN003178)

Metabolite	Structure	F1	F2	F3	F4
Disaccharide	ME450821	3.24	0.25	0.25	0.25
Serine	ME450694	1.10	0.27	2.19	0.44
All-trans-retinoic acid	ME450804	0.65	0.85	0.91	1.60
Chenodeoxycholic acid	ME450829	0.56	0.72	0.72	2.00
Hexosamine	ME450766	1.72	0.75	0.76	0.77
Prostaglandin E2	ME450823	1.78	0.66	0.77	0.79
Hypotaurine	ME450696	0.96	1.37	0.52	1.14
C18:1 Cer	ME450856	1.17	1.05	0.93	0.85
Glucosylceramide (d18:1/16:0)	ME450872	1.17	1.04	0.95	0.83
PC(14:0/18:2(9Z,12Z))	ME450877	1.13	0.99	1.04	0.84
C16 Cer	ME450854	1.18	1.00	1.03	0.79
PC(14:1(9Z)/P-18:1(11Z))	ME450874	1.21	1.00	1.03	0.75
Coumarate	ME450751	1.38	0.84	0.90	0.87
Glutamine	ME450733	1.25	0.92	0.98	0.84
Phenylacetaldehyde	ME450710	1.31	0.81	1.03	0.85
Urate	ME450756	0.95	1.09	1.03	0.94
2,3-Epoxyaflatoxin B1	ME450817	0.99	1.01	1.07	0.93
PE(14:0/P-18:0)	ME450869	0.98	1.05	1.04	0.92
C3:0 (Propionic acid)	ME450683	0.91	0.89	1.14	1.06
7-Methyl-2-hydroxy-6-oxoocta-2,4-dienoate	ME450769	0.91	0.93	1.15	1.02
Vanillylmandelic acid	ME450779	0.93	0.93	1.12	1.02
6-Dehydrotestosterone glucuronide	ME450838	0.89	0.91	1.18	1.02
Valerolactone	ME450690	0.88	0.95	1.16	1.01
Cortisol	ME450824	0.86	0.96	1.10	1.08
Estrone glucuronide	ME450837	0.83	0.98	1.15	1.04
Catechol	ME450697	0.87	1.07	1.05	1.01
3 beta,7 alpha-Dihydroxy-5-cholestenoate	ME450833	0.88	0.98	1.04	1.09
C10:3	ME450754	0.93	0.96	1.04	1.07
Ketovaline	ME450704	0.89	1.02	1.12	0.97
Ubiquinone-1	ME450795	0.91	0.99	1.11	0.99
Perillyl aldehyde	ME450742	0.90	1.01	1.05	1.04
3,4-Dihydroxyphenylglycol	ME450758	0.90	0.99	1.07	1.03
13-L-Hydroperoxylinoleic acid	ME450811	0.90	0.98	1.09	1.03
Retinoyl b-glucuronide	ME450843	0.90	0.97	1.09	1.03
4-Coumaryl alcohol	ME450741	0.93	0.98	1.06	1.03
Methyl-Tyr	ME450777	0.92	0.96	1.07	1.04
9,10-Epoxyoctadecenoic acid	ME450802	0.95	0.99	1.06	1.00
Propylhydroxypentanoic acid	ME450748	0.93	1.00	1.08	0.99
Phenyl acetate	ME450727	0.94	1.01	1.02	1.03
Cycloheptanecarboxylic acid	ME450730	0.93	1.02	1.04	1.01
Oxobutanoic acid	ME450691	0.92	1.04	1.05	1.00
C4:0 (Butyric acid)	ME450687	0.97	0.97	1.10	0.96
Decanoic acid (FA10:0)	ME450759	0.99	0.98	1.06	0.97
Octanoic acid	ME450731	0.98	0.96	1.07	0.99
Dodecanoic acid (FA12:0)	ME450780	0.98	0.93	1.08	1.01
p-Hydroxyphenylacetic acid	ME450744	0.99	0.93	1.13	0.95
3-Hydroxyanthranilic acid	ME450745	0.99	0.92	1.11	0.97
D-2-Hydroxyisocaproate	ME450721	0.98	0.92	1.10	0.99
Hydroxybutanoic acid	ME450693	1.05	0.88	1.08	0.99
Pyridoxal	ME450755	1.07	0.90	1.05	0.98
Hexuronic acid; Ascorbate	ME450764	1.05	0.90	1.11	0.94
Argininosuccinic acid	ME450801	1.02	0.94	1.12	0.93
Aspartate semialdehyde	ME450705	1.03	0.93	1.10	0.94
4-Methyl-2-oxopentanoate	ME450717	1.03	0.93	1.07	0.97
D-Glyceric acid	ME450695	1.05	0.96	1.06	0.93
Dihydrouracil	ME450701	1.02	0.94	1.02	1.02
Pyruvate	ME450686	0.99	0.98	0.99	1.04
Leukotriene B4	ME450820	1.01	0.88	0.99	1.11
Sphinganine	ME450805	0.98	0.89	1.07	1.06
Succinate	ME450707	1.03	0.86	1.07	1.04
Hypoxanthine	ME450726	1.13	0.87	1.02	0.97
Pentose	ME450740	1.15	0.84	1.06	0.95
L-Cystathionine	ME450790	1.13	0.86	1.16	0.86
Asparagine	ME450720	1.10	0.85	1.11	0.93
Oxalosuccinic acid	ME450772	1.10	0.84	1.13	0.93
PE(14:0/18:2(9Z,12Z))	ME450870	0.91	0.81	1.28	1.00
4,6-Dihydroxyquinoline	ME450749	1.04	0.80	1.24	0.92
Cholesterol sulfate	ME450841	0.97	0.90	1.21	0.92
cis-beta-D-Glucosyl-2-hydroxycinnamate	ME450816	0.98	0.86	1.17	0.99
11b-Hydroxyprogesterone	ME450819	0.76	0.94	1.12	1.18
Prostaglandin G2	ME450827	0.82	0.90	1.11	1.17
Leukotriene A4	ME450813	0.79	0.92	1.01	1.27
Cysteic acid	ME450757	0.79	1.00	1.01	1.20
Glyoxylic acid	ME450682	0.86	0.99	0.99	1.16
Palmitoleic acid	ME450796	0.89	0.84	1.16	1.11
2-Phenylethanol glucuronide	ME450803	0.84	0.92	1.26	0.98
Androsterone glucuronide	ME450840	0.76	0.96	1.24	1.04
1-(alpha-Methyl-4-(2-methylpropyl)benzeneacetate)-beta-D-Glucopyranuronic acid	ME450828	0.78	0.95	1.23	1.04
2-Methoxy-estradiol-17b 3-glucuronide	ME450844	0.78	0.96	1.24	1.02
Testosterone glucuronide	ME450839	0.82	0.91	1.22	1.05
Deoxycholic acid 3-glucuronide	ME450860	0.79	0.94	1.20	1.07
Pregnanediol-3-glucuronide	ME450849	0.80	0.93	1.18	1.09
Eicosapentaenoic acid	ME450806	0.92	1.04	0.81	1.23
Hexose	ME450767	0.89	1.21	0.69	1.21
PC(15:0/18:3(6Z,9Z,12Z))	ME450882	1.08	1.10	0.86	0.97
PC(14:0/20:2(11Z,14Z))	ME450884	1.09	1.08	0.88	0.94
PC(14:0/20:3(5Z,8Z,11Z))	ME450883	1.10	1.07	0.87	0.95
Arginine	ME450761	1.09	1.05	0.90	0.96
Glycolate	ME450685	1.07	1.08	0.89	0.97
3-O-Sulfogalactosylceramide (d18:1/18:0)	ME450889	1.07	1.05	0.91	0.98
PC(14:1(9Z)/22:2(13Z,16Z))	ME450887	1.06	1.06	0.90	0.98
Pyrroline carboxylic acid	ME450700	1.05	1.05	0.89	1.01
Uridine	ME450794	1.04	1.06	0.91	1.00
PE(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))	ME450885	1.02	1.08	0.92	0.99
Uridine diphosphate glucuronic acid	ME450861	1.04	1.08	0.90	0.98
Fumarate	ME450703	1.11	0.99	0.87	1.03
Alanine	ME450688	1.04	1.06	0.87	1.03
Glutamate	ME450736	1.10	1.04	0.84	1.02
Taurine	ME450713	1.08	1.04	0.84	1.04
Deoxyhexose	ME450752	1.00	1.04	0.99	0.96
PC(14:0/18:1(11Z))	ME450878	1.04	1.02	1.00	0.94
Propenoic acid C3:1	ME450681	1.04	1.01	0.95	1.01
Thymine	ME450714	1.01	1.01	0.96	1.02
PE(14:0/22:5(4Z,7Z,10Z,13Z,16Z))	ME450879	1.07	1.01	0.95	0.97
PE(14:0/20:3(5Z,8Z,11Z))	ME450873	1.03	1.04	0.95	0.98
Proline	ME450702	1.05	1.03	0.93	0.99
Uracil	ME450699	1.04	1.04	0.93	0.99
C20 Cer	ME450863	1.05	1.12	0.91	0.92
C18 Cer	ME450858	1.09	1.07	0.95	0.89
Palmitaldehyde	ME450793	1.08	1.05	0.97	0.90
PC(14:0/15:0)	ME450871	1.04	1.05	0.97	0.94
PC(14:0/P-18:1(11Z))	ME450875	1.06	1.07	0.94	0.93
Aminoadipate	ME450750	0.99	1.01	0.90	1.10
Aconitate	ME450760	0.98	1.11	0.90	1.02
Itaconate	ME450716	1.00	1.07	0.90	1.02
Mercaptopyruvic acid	ME450709	0.99	1.08	0.92	1.01
UMP	ME450815	0.99	1.08	0.92	1.00
PC(15:0/18:4(6Z,9Z,12Z,15Z))	ME450881	1.01	1.07	0.95	0.97
PA(16:0/18:1(11Z))	ME450868	0.97	1.10	0.95	0.98
PC(22:0/P-18:1(11Z))	ME450890	0.98	1.07	0.97	0.98
Arachidic acid	ME450812	0.93	1.04	0.97	1.07
C14:0	ME450791	0.94	1.04	0.93	1.09
Cholesterol glucuronide	ME450855	0.98	1.02	0.96	1.04
Alpha-Linolenic acid	ME450798	0.95	1.06	0.95	1.03
Carbamoyl phosphate	ME450728	0.97	1.06	0.95	1.02
Malate	ME450724	1.19	0.93	0.90	0.98
Phenylacetylglycine	ME450776	1.17	0.95	0.89	0.99
N-Acetylimidazole	ME450698	1.13	0.99	0.97	0.91
Oxidized glutathione	ME450865	1.14	1.01	0.97	0.88
Cys-Gly	ME450765	1.12	0.98	0.94	0.96
Glycerophosphocholine	ME450797	1.12	0.99	0.94	0.95
Nicotinamide	ME450712	1.13	1.02	0.93	0.93
Acetyl-Glu	ME450771	1.10	1.03	0.94	0.93
CE(19:0)	ME450867	1.08	1.04	0.94	0.94
Hydroxyglutarate	ME450737	1.10	0.95	1.01	0.93
Indole-5,6-quinone	ME450735	1.07	0.96	1.02	0.95
Lysine	ME450734	1.08	0.97	0.99	0.96
Benzoate	ME450711	1.15	0.92	0.96	0.97
4-Acetamidobutanoate	ME450732	1.14	0.95	1.00	0.91
Lactate	ME450689	1.13	0.94	0.99	0.94
Mevalonate	ME450738	1.14	0.93	0.99	0.93
Orotidylic acid	ME450826	1.22	1.04	0.77	0.97
Phosphoserine	ME450770	1.18	1.10	0.72	1.00
dTDP-hexose	ME450857	1.15	1.07	0.76	1.02
Glycerylphosphorylethanolamine	ME450785	1.16	1.07	0.74	1.03
(Iso)Citrate	ME450775	0.94	1.18	0.85	1.03
LysoPC(16:0)	ME450848	0.92	1.17	0.85	1.05
Butynal	ME450680	0.89	1.15	0.86	1.10
Guanosine	ME450800	0.90	1.16	0.88	1.06
LPA(0:0/18:1(9Z))	ME450834	0.87	1.17	0.89	1.07
C15:5	ME450773	0.88	1.19	0.96	0.97
Ethylene glycol	ME450679	0.94	1.14	0.96	0.95
CTP	ME450846	1.01	1.13	0.85	1.01
C18:2	ME450799	1.04	1.13	0.84	0.99
GDP	ME450835	1.02	1.14	0.85	0.99
PC(15:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))	ME450888	1.02	1.15	0.86	0.97
N-Acetylaspartylglutamic acid	ME450807	0.99	1.17	0.86	0.98
GMP	ME450825	1.00	1.15	0.85	1.00
GTP	ME450853	1.00	1.16	0.85	0.99
Lipoamide	ME450783	1.04	1.19	0.84	0.94
UTP	ME450847	1.06	1.14	0.84	0.96
PC(18:4(6Z,9Z,12Z,15Z)/P-16:0)	ME450880	1.10	1.15	0.80	0.95
CDP	ME450830	1.04	1.18	0.79	0.99
PE(18:3(6Z,9Z,12Z)/P-18:1(11Z))	ME450876	1.06	1.17	0.80	0.98
UDP	ME450831	1.06	1.16	0.80	0.98
AMP	ME450822	0.98	1.17	0.81	1.05
Hexonic acid	ME450778	0.99	1.12	0.84	1.06
CMP	ME450814	0.97	1.11	0.80	1.12
Acetyl-Asp	ME450762	1.01	1.14	0.74	1.11
Triose	ME450850	1.00	1.14	0.76	1.10
Aspartate	ME450723	1.03	1.07	0.83	1.07
GDP-L-fucose	ME450862	1.05	1.08	0.82	1.05
5-Aminolevulinic acid	ME450718	1.03	1.11	0.78	1.08
Ethanolamine phosphate	ME450729	1.05	1.08	0.79	1.07
Aminobutanoic acid (ABA)	ME450692	1.04	1.09	0.81	1.07
Phosphocreatine	ME450784	1.04	1.10	0.80	1.07
3-O-Sulfogalactosylceramide (d18:1/16:0)	ME450886	1.07	1.09	0.83	1.01
Pantothenic acid	ME450787	1.09	1.09	0.79	1.03
CDP-ethanolamine	ME450836	1.05	1.17	0.70	1.07
UDP-acetyl-hexosamine	ME450864	1.11	1.12	0.74	1.03
Arachidonic acid	ME450808	1.07	1.18	0.74	1.01
UDP-hexose	ME450859	1.04	1.15	0.76	1.05
8,11,14-Eicosatrienoic acid	ME450809	1.05	1.14	0.77	1.04
Glutathione	ME450810	1.06	1.13	0.77	1.04
Stachyose	ME450866	0.98	1.32	0.78	0.93
LysoPC(15:0)	ME450845	0.95	1.26	0.74	1.04
LysoPC(17:0)	ME450852	0.93	1.26	0.75	1.06
C22:6	ME450818	1.03	1.23	0.73	1.01
ADP	ME450832	1.00	1.21	0.78	1.00
ATP	ME450851	1.01	1.22	0.79	0.98
Citrulline	ME450763	1.54	0.37	1.68	0.41
Histidine	ME450746	1.18	0.44	1.82	0.55
(Iso)Leucine	ME450719	1.30	0.56	1.54	0.60
Phenylalanine	ME450753	1.29	0.53	1.62	0.56
Tryptophan	ME450782	1.14	0.57	1.67	0.62
Valine; Betaine	ME450706	1.16	0.55	1.67	0.63
L-Acetylcarnitine	ME450781	1.19	0.57	1.61	0.63
Tyrosine	ME450768	1.21	0.59	1.56	0.63
Threonine	ME450708	1.10	0.57	1.63	0.71
Xanthine	ME450743	1.07	0.65	1.56	0.72
Vitamin K1 2,3-epoxide	ME450842	1.39	0.86	1.26	0.49
5-L-Glutamyl-L-alanine	ME450786	1.31	0.78	1.17	0.74
Deoxyribose	ME450725	1.39	0.72	1.14	0.75
5-Hydroxyindoleacetic acid	ME450774	1.34	0.67	1.34	0.64
Methionine	ME450739	1.30	0.70	1.28	0.72
Oxitriptan	ME450788	1.24	0.72	1.31	0.73
Ornithine	ME450722	1.15	0.72	1.38	0.75
Oxoproline	ME450715	1.17	0.75	1.35	0.74
Glycine	ME450684	1.08	0.74	1.35	0.83
Indoleacetaldehyde	ME450747	1.07	0.80	1.35	0.78
Dyspropterin	ME450792	1.09	0.86	1.45	0.60
N-Acetylgalactosamine	ME450789	1.19	0.79	1.44	0.58

Factors:

F1	Group:BAD SAHBA SD \| Treatment:Cytokines
F2	Group:BAD SAHBA SD \| Treatment:PBS
F3	Group:Vehicle \| Treatment:Cytokines
F4	Group:Vehicle \| Treatment:PBS

Data matrix