Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Metabolic profiling reveals biochemical pathways and potential biomarkers associated with the pathogenesis of Krabbe disease (Study ST000352)

GC POSITIVE ION MODE (Analysis AN000574)

Metabolite	Structure	F1	F2	F3	F4
trizma acetate	ME120247	1.66	0.65	1.28	0.22
2-aminoadipate	ME120153	0.45	0.49	1.51	1.56
glycerophosphoethanolamine	ME120202	0.46	0.54	1.26	1.68
glucose	ME120196	0.77	1.97	0.63	0.64
inositol 4-phosphate	ME120208	0.64	1.85	0.90	1.02
2-aminobutyrate	ME120154	1.37	1.26	0.29	0.26
maltotriose	ME120215	1.15	1.60	0.60	0.51
oleamide	ME120222	1.35	1.47	0.48	0.70
stearamide	ME120243	1.33	1.49	0.50	0.68
desmosterol	ME120186	1.49	1.52	0.48	0.45
trans-4-hydroxyproline	ME120246	1.47	1.45	0.52	0.55
allo-threonine	ME120170	1.21	1.12	0.89	0.40
dimethylglycine	ME120187	1.14	1.20	0.65	0.56
3-hydroxybutyrate (BHBA)	ME120160	1.46	1.19	0.79	0.56
2-hydroxybutyrate (AHB)	ME120155	1.37	1.29	0.67	0.62
phosphoethanolamine	ME120229	1.34	1.35	0.65	0.66
1,5-anhydroglucitol (1,5-AG)	ME120149	0.93	1.41	1.09	0.56
putrescine	ME120231	1.07	1.16	1.37	0.40
alpha-tocopherol	ME120171	0.68	0.91	1.35	0.86
urate	ME120250	0.86	0.72	1.62	0.80
N-acetylglucosamine	ME120221	1.04	0.51	1.19	1.04
xylose	ME120253	0.98	0.78	1.24	0.98
glycerol 2-phosphate	ME120200	0.93	0.93	0.93	1.20
glycerol 3-phosphate (G3P)	ME120201	1.01	0.98	0.84	1.17
pyrophosphate (PPi)	ME120232	0.92	0.91	1.06	1.12
cysteine	ME120183	0.94	0.85	1.10	1.10
glycerol	ME120199	0.94	0.88	1.08	1.10
2-palmitoylglycerol (2-monopalmitin)	ME120158	0.99	0.90	1.03	1.08
beta-alanine	ME120176	0.96	0.90	1.01	1.13
fructose	ME120191	0.88	1.04	0.97	1.10
erythritol	ME120188	0.84	0.99	1.05	1.11
stearoyl sphingomyelin	ME120244	0.90	0.98	1.01	1.10
1,3-dihydroxyacetone	ME120147	0.94	0.96	1.12	0.97
glycine	ME120203	0.92	0.96	1.07	1.04
cholesterol	ME120179	0.92	1.02	1.04	1.03
malate	ME120213	0.95	1.00	1.04	1.01
dehydroascorbate	ME120185	1.09	0.99	0.87	1.05
1-stearoylglycerol (1-monostearin)	ME120152	1.05	1.05	0.92	0.98
inositol 1-phosphate (I1P)	ME120206	1.03	1.07	0.94	0.96
oxalate (ethanedioate)	ME120225	1.05	1.08	0.94	0.93
adenine	ME120167	1.00	0.96	0.96	1.08
ribitol	ME120233	0.99	0.98	0.96	1.07
phosphate	ME120228	1.00	0.98	1.00	1.03
lactate	ME120209	1.03	0.96	1.00	1.01
sarcosine (N-Methylglycine)	ME120238	1.01	0.96	1.01	1.01
xylonate	ME120252	0.96	1.04	0.94	1.06
1,2-dipalmitoylglycerol	ME120146	1.02	1.03	0.99	0.96
1-palmitoylglycerol (1-monopalmitin)	ME120151	0.96	1.04	0.98	1.02
2-hydroxyglutarate	ME120156	0.97	1.04	1.01	0.98
alanine	ME120168	0.99	1.03	0.99	0.99
xylulose	ME120254	0.99	1.04	0.97	1.00
chiro-inositol	ME120178	0.55	0.75	1.17	1.11
aspartate	ME120175	0.79	0.74	1.22	1.25
cysteinylglycine	ME120184	0.63	0.79	1.21	1.30
arabitol	ME120173	0.81	0.82	0.99	1.38
sorbitol	ME120242	0.88	0.78	1.03	1.30
3-phosphoserine	ME120162	0.62	0.97	1.18	1.23
1,3-dipalmitoylglycerol	ME120148	0.70	1.01	1.12	1.13
ribulose	ME120236	0.83	0.97	1.14	1.06
ribulose/xylulose 5-phosphate	ME120237	0.80	1.02	1.10	1.07
lignocerate (24:0)	ME120212	0.75	0.90	1.22	1.13
ribose 5-phosphate	ME120235	0.76	0.89	1.09	1.25
erythronate*	ME120189	0.80	0.89	1.12	1.19
methylphosphate	ME120219	0.77	0.86	1.14	1.22
myo-inositol	ME120220	0.84	0.93	1.07	1.16
cis-vaccenate (18:1n7)	ME120180	0.85	0.84	1.14	1.17
gamma-aminobutyrate (GABA)	ME120194	0.85	0.87	1.12	1.16
ribose	ME120234	0.88	0.89	1.10	1.13
oleate (18:1n9)	ME120223	0.87	0.87	1.14	1.12
2-pyrrolidinone	ME120159	0.85	0.89	1.15	1.12
scyllo-inositol	ME120239	0.85	0.89	1.15	1.11
lanosterol	ME120210	1.11	1.03	0.61	1.20
maltose	ME120214	1.07	1.45	0.68	0.80
glucose-6-phosphate (G6P)	ME120197	0.90	1.40	0.87	0.83
fructose-6-phosphate	ME120192	0.94	1.38	0.84	0.84
mannose-6-phosphate	ME120218	0.93	1.36	0.87	0.84
sedoheptulose-7-phosphate	ME120240	0.84	1.32	0.94	0.90
citrate	ME120181	0.92	1.28	0.93	0.88
1,6-anhydroglucose	ME120150	0.93	1.28	0.88	0.92
phosphoglycolate	ME120230	0.91	1.30	0.91	0.91
hypotaurine	ME120205	1.12	0.98	1.06	0.83
5-hydroxyindoleacetate	ME120164	1.05	1.10	1.06	0.79
urea	ME120251	1.01	1.17	1.04	0.78
homoserine	ME120204	1.15	1.15	0.72	0.98
glucarate (saccharate)	ME120195	1.19	1.18	0.72	0.88
7-alpha-hydroxycholesterol	ME120165	1.15	1.20	0.77	0.88
lathosterol	ME120211	1.11	1.20	0.76	0.93
3-phosphoglycerate	ME120161	1.01	1.26	0.83	0.91
ornithine	ME120224	1.01	1.14	0.88	0.97
mannitol	ME120216	0.99	1.20	0.84	0.94
arabinose	ME120172	1.01	1.19	0.82	0.96
inositol 2-phosphate (I2P)	ME120207	1.02	1.19	0.84	0.96
7-beta-hydroxycholesterol	ME120166	1.13	1.08	0.85	0.94
glycerate	ME120198	1.15	1.07	0.82	0.95
palmitic amide	ME120226	1.11	1.12	0.84	0.93
UDP-galactose	ME120248	1.08	1.10	0.86	0.95
ascorbate (Vitamin C)	ME120174	1.04	1.15	0.96	0.85
cystathionine	ME120182	1.09	1.15	0.89	0.87
fumarate	ME120193	1.04	1.17	0.91	0.88
ethanolamine	ME120190	1.17	1.10	0.87	0.86
palmitoyl sphingomyelin	ME120227	1.12	1.11	0.95	0.82
5,6-dihydrouracil	ME120163	1.26	1.24	0.74	0.77
taurine	ME120245	1.20	1.19	0.80	0.81
serine	ME120241	1.26	1.24	0.82	0.69
campesterol	ME120177	1.28	1.14	0.83	0.75
uracil	ME120249	1.31	1.16	0.79	0.74
2-oleoylglycerol (2-monoolein)	ME120157	1.11	1.41	0.95	0.72
allantoin	ME120169	1.14	1.29	0.87	0.70
mannose	ME120217	1.09	1.30	0.83	0.79

Factors:

F1	age:P15 \| genotype:Twitcher
F2	age:P15 \| genotype:Wild Type
F3	age:P22 \| genotype:Twitcher
F4	age:P22 \| genotype:Wild Type

Data matrix