Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Metabolomics of aged iPSC (Study ST000554)

Reversed phase POSITIVE ION MODE (Analysis AN000849)

Metabolite	Structure	F1	F2	F3
3-UREIDOPROPIONATE	ME166273	0.65	3.65	0.61
4-AMINOBUTANOATE (GABA)_R2	ME166275	2.81	0.27	0.42
4-AMINOBUTANOATE (GABA)_R1	ME166274	2.20	0.37	0.64
N-ACETYL-L-ASPARTIC ACID	ME166358	2.22	0.69	0.57
ADENOSINE	ME166280	2.06	0.68	0.64
GUANINE	ME166315	2.02	0.52	0.69
N-ACETYL-DL-GLUTAMIC ACID	ME166356	1.55	0.29	0.92
GUANOSINE	ME166316	1.87	1.02	0.65
DEOXYURIDINE	ME166302	1.65	0.68	0.80
URIDINE	ME166394	1.59	0.88	0.79
DEOXYCYTIDINE	ME166301	1.54	0.98	0.79
Triethyl phosphate	ME166387	1.49	0.93	0.82
Acyl-Carnitine(5-OH)	ME166278	0.43	1.71	1.08
Orthophosphate	ME166365	1.46	1.85	0.65
ALPHA-AMINOADIPATE/N-METHYL-L-GLUTAMATE	ME166283	1.26	1.63	0.77
CMP	ME166295	1.32	1.62	0.75
Allopurinol	ME166282	1.13	1.73	0.80
DEOXYCARNITINE	ME166300	1.18	1.72	0.78
INOSINE	ME166320	1.20	1.70	0.78
Phe-Phe	ME166371	1.28	1.80	0.73
TAURINE	ME166381	1.19	1.85	0.75
CYS-GLY	ME166298	1.19	2.30	0.66
Isovalerylcarnitine	ME166323	1.11	2.15	0.73
NICOTINAMIDE	ME166362	1.00	2.25	0.75
PEG n5	ME166368	0.83	2.00	0.87
PYRIDOXAL	ME166376	0.88	2.06	0.83
D-Ribose	ME166307	1.07	1.82	0.81
CREATINE	ME166296	1.01	1.92	0.81
SUCCINATE	ME166379	1.07	1.92	0.79
ANTHRANILATE-Water	ME166285	1.10	1.22	0.92
N-ACETYLNEURAMINATE	ME166359	1.08	1.16	0.94
Glycerophosphocholine	ME166312	0.99	1.35	0.94
ASPARTATE	ME166286	1.06	1.34	0.91
PIPECOLATE/L-PIPECOLIC ACID	ME166374	1.07	1.30	0.91
PYRIDOXAL 5^-PHOSPHATE	ME166377	1.03	1.21	0.94
5-OXO-L-PROLINE	ME166277	1.02	1.27	0.94
Erucamide	ME166309	1.05	1.26	0.93
L-CYSTEINE	ME166329	1.23	1.32	0.85
N-METHYL-D-ASPARTIC ACID	ME166363	1.16	1.41	0.85
HYPOTAURINE	ME166318	1.09	1.38	0.89
L-CARNITINE	ME166328	1.13	1.36	0.87
L-2-PHOSPHOGLYCERIC ACID_R2	ME166325	0.81	1.24	1.03
5-AMINOLEVULINIC ACID	ME166276	0.72	1.51	1.01
CARNOSINE	ME166292	0.76	1.38	1.02
PHOSPHO(ENOL)PYRUVIC ACID	ME166372	0.68	1.41	1.05
Glycyl-L-leucine	ME166314	0.82	1.63	0.95
N(PAI)-METHYL-L-HISTIDINE	ME166355	0.68	1.71	0.99
PYRIDOXINE	ME166378	0.93	1.64	0.90
URIDINE-5-MONOPHOSPHATE	ME166395	1.01	1.57	0.88
LL-2,6-DIAMINOHEPTANEDIOATE	ME166334	1.03	1.66	0.86
URACIL	ME166392	0.99	1.63	0.88
URATE	ME166393	0.84	1.45	0.97
Anthranilate	ME166284	1.03	1.47	0.90
Choline	ME166293	0.93	1.46	0.94
HYPOXANTHINE	ME166319	0.95	1.43	0.93
L-ASPARAGINE	ME166327	0.92	0.66	1.10
L-SERINE	ME166341	0.89	0.65	1.11
Proprionylcarnitine	ME166375	0.87	0.65	1.12
LysoPE (18:1)_R1	ME166348	0.88	0.54	1.14
LysoPC (16:1)	ME166346	0.93	0.54	1.12
THYMINE	ME166385	0.95	0.50	1.12
GLUCOSAMINE/MANNOSAMINE	ME166310	1.11	0.51	1.05
N-Methylnicotinamide	ME166364	1.06	0.49	1.08
PHOSPHOCHOLINE	ME166373	1.07	0.54	1.07
CYTIDINE	ME166299	1.17	0.67	1.00
Isocytosine	ME166322	1.07	0.71	1.03
N-ACETYL-L-ALANINE	ME166357	0.80	0.84	1.11
2-Hydroxyphenylalanine	ME166270	0.87	0.90	1.07
HOMOCYSTEINE	ME166317	0.93	0.85	1.06
Monobutyl phthalate	ME166354	0.92	0.88	1.06
Sulcatol	ME166380	0.93	0.88	1.05
Ergothioneine	ME166308	0.96	0.78	1.06
Camphor	ME166291	0.89	0.79	1.09
Dipropylene glycol	ME166305	0.92	0.75	1.08
L-ARGININE	ME166326	0.89	0.74	1.09
L-Tyrosine 13C6	ME166343	1.11	0.94	0.97
L-Leucine 13C6	ME166335	1.16	0.94	0.95
L-Phenylalanine 13C6	ME166339	1.15	0.91	0.96
Dibutyl phthalate	ME166303	1.05	0.99	0.98
METHYL JASMONATE	ME166353	1.06	0.98	0.98
L-HISTIDINE	ME166333	1.04	1.00	0.99
N-BOC-L-Aspartic Acid	ME166360	1.02	1.01	0.99
Bis(2-ethylhexyl) phthalate	ME166287	1.00	0.95	1.01
Diphenylamine	ME166304	1.00	0.93	1.01
3,5-Di-tert-butylbenzaldehyde	ME166272	1.02	0.98	1.00
2^,4^-DIHYDROXYACETOPHENONE	ME166269	1.02	0.96	1.00
Caffeine-D3	ME166290	1.02	0.96	1.00
GLYCINE	ME166313	1.02	0.91	1.01
Palmitoleic acid	ME166366	1.00	0.89	1.02
L-Leucine-D10	ME166336	1.08	0.93	0.98
Dipropyleneglycol dibenzoate	ME166306	1.05	0.93	0.99
ADENINE	ME166279	1.06	0.92	0.99
Creatine-D3	ME166297	1.06	0.92	0.99
L-Tryptophan 13C11	ME166342	1.08	0.86	1.00
Tryptophan-2,3,3-D3	ME166389	1.07	0.89	1.00
Tryptophan-2,3,3-D3-NH3	ME166390	1.04	0.89	1.00
Tetrahydrothiophene-1-oxide	ME166383	1.06	1.05	0.97
N-BOC-L-Tryptophan	ME166361	1.01	1.10	0.98
3,4-Dimethylbenzoic acid	ME166271	0.97	1.05	1.00
BOC-D-Phenylalanine	ME166288	0.96	1.09	1.00
BOC-L-Tyrosine	ME166289	1.01	1.04	0.99
TRANS-CINNAMATE	ME166386	0.97	1.01	1.01
Tryptophan-NH3	ME166391	0.86	0.99	1.06
Phenylalanine	ME166370	0.89	0.97	1.05
Tryptophan	ME166388	0.89	0.96	1.05
L-2-PHOSPHOGLYCERIC ACID_R1	ME166324	0.86	1.12	1.03
LEUCINE	ME166331	0.88	1.07	1.04
L-GLUTAMINE	ME166332	0.87	1.09	1.03
L-METHIONINE	ME166338	0.93	1.06	1.02
L-PROLINE	ME166340	0.92	1.04	1.03
L-VALINE/5-AMINOPENTANOATE/L-NORVALINE	ME166344	0.89	1.01	1.04
Leu Pro	ME166330	0.89	1.04	1.04
Pantothenic Acid	ME166367	0.89	1.04	1.03
Glutathione Disulfide	ME166311	0.63	1.08	1.13
METHYL BETA-D-GALACTOSIDE	ME166352	0.61	0.86	1.18
L-LYSINE	ME166337	0.72	0.94	1.12
ALANINE/SARCOSINE	ME166281	0.70	0.84	1.15
CITRATE	ME166294	0.69	0.88	1.15
LysoPC (18:0)	ME166347	0.66	0.76	1.18
LysoPE (22:4)	ME166351	0.66	0.62	1.21
THREONINE/HOMOSERINE	ME166384	0.70	0.66	1.19
Taurocholic acid (TCA)	ME166382	0.19	0.11	1.50
LysoPE (20:4)	ME166350	0.77	0.47	1.20
Isobutyrylcarnitine	ME166321	0.70	0.31	1.26
PHENETHYLAMINE	ME166369	0.74	0.35	1.23
LysoPC (16:0)	ME166345	0.58	0.54	1.26
LysoPE (18:1)_R2	ME166349	0.43	0.54	1.32

Factors:

F1	Treatment:5mM Disodium acetate
F2	Treatment:6mM Sodium Citrate
F3	Treatment:Untreated

Data matrix