Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002578)

GC POSITIVE ION MODE (Analysis AN004249)

Metabolite	Structure	F1	F2	F3
Fumaric (287,329)	ME620784	1.57	0.35	1.08
3-HydroxyIsobutyric (275)	ME620764	0.91	1.40	0.69
Alanine (260,232)	ME620758	0.47	1.82	0.71
Glycine (246,218)	ME620760	0.72	1.78	0.50
Carbodiimide (213,255,171)	ME620752	1.51	0.96	0.53
Cholesterol 0TBDMS (386,275)	ME620846	0.94	1.01	1.03
Glyceraldehyde-3P (484,457,425)	ME620816	0.05	0.77	1.78
Pyroglutamic (300,272)	ME620791	1.60	0.18	1.22
Aminoadipic 3TBDMS	ME620820	1.33	0.59	1.08
Urea 3TBDMS	ME620786	1.40	0.79	0.79
Homocysteine (420,392)	ME620817	1.15	1.29	0.61
2-hydroxybutyrate	ME620759	0.58	1.83	0.63
Asparagine (417,302)	ME620812	0.47	1.90	0.63
Sarcosine	ME620766	0.96	1.52	0.69
DHAP 1/2 (484,452,383)	ME620818	0.06	1.92	0.79
2-phosphoglycerate (585,383)	ME620828	0.61	0.73	1.27
Proline (286,258)	ME620783	0.94	1.50	0.56
Sulfuric acid (269)	ME620761	0.95	0.91	1.14
Cysteine (406,378)	ME620806	1.60	0.66	0.74
Hypotaurine (280,158)	ME620785	1.62	0.66	0.72
Threonine 2TBDMS (290, 302,130)	ME620779	1.05	0.97	NA
Hydroxyproline 3TBDMS (416,388)	ME620805	0.90	1.51	0.59
Niacinamide (179, 136, 221)	ME620776	1.39	0.87	0.74
Phenylalanine (336,308)	ME620799	0.59	2.22	0.19
Myristic-D27 (ISTD)	ME620798	0.98	1.06	0.96
Pantothenic 3TBDMS (504,546,375)	ME620838	1.16	0.93	0.91
GABA	ME620782	1.72	0.70	0.58
2-ketoglutarate (346,258)	ME620796	0.62	0.07	1.98
Glutamine (431,329)	ME620823	0.71	0.01	2.11
Histidine (440,338)	ME620829	0.49	1.87	0.35
Glutamic (432,330)	ME620810	1.36	0.34	1.30
Citric (459,431)	ME620832	0.37	0.23	2.40
Phosphoserine (584,482)	ME620836	1.11	1.00	0.89
Creatinine (284,341)	ME620792	0.65	1.87	0.14
N-acetyl-L-alanine (302,200)	ME620775	1.15	0.78	1.09
Histidine (338)	ME620830	0.52	1.84	0.41
Glucose 2 (608,344,202)	ME620839	NA	1.11	0.89
Leucine (302,274)	ME620774	0.89	1.75	0.36
Succinic (289,331)	ME620780	1.84	0.44	0.71
2-Hydroxyisobutyric (275,247)	ME620757	1.04	1.10	0.86
Oxaloacetic (332,374)	ME620788	1.27	NA	0.76
Urea 2TBDMS (231, 273)	ME620771	1.26	1.07	0.66
Adenine 2TBDMS	ME620815	1.61	0.60	0.79
DHAP 2/2 (484,452,383)	ME620819	0.06	1.87	0.76
Pyruvic (174,115)	ME620751	1.10	0.14	1.77
Methionine (320,292)	ME620794	0.87	1.79	0.35
Glucose 4 (608,301,273)	ME620842	0.36	1.58	1.06
Threonine 3TBDMS (404,376)	ME620797	0.60	2.00	0.40
3-phosphoglycerate (585,383)	ME620833	0.30	1.11	1.23
Malic (419,287)	ME620803	1.21	0.09	1.70
2P-Glycerol	ME620826	0.47	1.97	0.57
3P-glycerol	ME620827	0.32	2.32	0.37
N-acetylAspartic 3TBDMS	ME620814	1.57	0.61	0.81
Glycerol 3TBDMS	ME620787	0.37	2.04	0.59
Cytosine 2TBDMS	ME620790	1.28	0.89	0.83
Xanthine 3TBDMS	ME620831	1.04	1.08	0.87
Myristic (285,129,327)	ME620801	1.08	0.99	0.93
Propylene glycol 2TBDMS (247,189)	ME620753	1.17	1.06	0.77
ß-alanine	ME620769	1.17	1.01	0.82
Unknown A (460,358)	ME620824	0.71	1.63	0.66
Hypoxanthine	ME620809	0.51	1.60	0.19
Cis-aconitic (459,327)	ME620822	0.69	0.58	1.53
Lactic (261,233)	ME620755	0.12	1.69	1.19
Maleic (287,329,133)	ME620778	1.30	0.74	0.96
Ornithine (474,417)	ME620811	0.95	1.36	0.52
Lysine (431,488)	ME620821	0.83	1.62	0.28
Unknown 2 (720,570)	ME620848	1.13	0.44	1.43
N-acetyl aspartic 2TBDMS	ME620802	1.18	0.91	0.91
Glycerol2TBDMS #2	ME620768	0.52	1.62	0.77
Glycolic Acid (247,189)	ME620756	0.83	1.71	0.47
Isocitric (459,431)	ME620834	0.23	0.28	1.74
Homoserine (404,446,376,302)	ME620800	0.84	1.66	0.34
Aspartic (418,390)	ME620804	2.32	0.03	0.65
Stearic 341,129,383	ME620825	0.99	1.10	0.91
Tyrosine (466,302)	ME620835	0.67	2.07	0.26
Glyceraldehyde (261,231,89)	ME620772	0.47	1.03	1.23
Valine (288)	ME620770	0.72	2.14	0.14
Ethanolamine (232,144)	ME620754	1.00	1.21	0.79
Tryptophan 3TBDMS (244)	ME620845	0.75	1.98	0.27
Glycerol 2TBDMS #1	ME620767	0.28	1.90	0.81
Glucose 3 (608,375,344)	ME620841	0.06	1.24	1.23
Hydracrylic (261,219,133)	ME620762	0.96	1.36	0.67
Glucose 1 (608,315,273)	ME620837	0.22	1.48	1.30
3-Hydroxyisobutyric (219)	ME620765	0.88	1.40	0.69
3-hydroxybutyric (233, 275, 159)	ME620763	0.86	1.38	0.77
Cytosine 1TBDMS	ME620773	0.89	1.16	0.96
Tryptophan 2TBDMS (302,375,130)	ME620840	0.55	1.42	0.09
Palmitic	ME620813	1.05	0.99	0.96
2-hydroxyglutaric (433,245)	ME620807	0.91	1.25	0.87
Uracil	ME620781	1.24	0.83	0.93
Isoleucine (302,274)	ME620777	0.98	1.61	0.41
Phosphoenolpyruvic (453,495)	ME620808	0.32	0.89	1.60
Serine (390,362)	ME620795	0.32	2.47	0.21
Unknown 1 (702,570)	ME620847	1.10	0.42	1.48
L-Hydroxyproline 2TBDMS (302,274)	ME620793	0.29	2.16	0.64

Factors:

F1	Treatment:Glucose depletion 24h
F2	Treatment:Glutamine depletion 24h
F3	Treatment:No treatment

Data matrix