Metabolomics Workbench : NIH Data Repository

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

Reversed phase NEGATIVE ION MODE (Analysis AN000850)

Metabolite	Structure	F1	F2	F3
Pantetheine	ME166491	0.45	4.99	0.42
CMP_R2	ME166423	0.80	2.77	0.73
S-HEXYL-GLUTATHIONE	ME166499	1.07	2.94	0.59
GLYCERIC ACID	ME166440	0.49	2.34	0.93
Fumaric Acid	ME166433	0.73	2.38	0.83
PYRIDOXAL	ME166494	0.82	2.33	0.80
CYS-GLY	ME166425	1.03	2.12	0.74
Mannitol	ME166470	0.87	2.17	0.82
GUANINE	ME166441	2.04	0.15	0.76
N-ACETYL-DL-GLUTAMIC ACID_R2	ME166475	1.90	0.19	0.80
DIHYDROXYACETONE PHOSPHATE	ME166429	1.10	0.36	1.09
LysoPE (20:4)_R2	ME166467	1.33	0.38	0.99
N-ACETYL-DL-GLUTAMIC ACID_R1	ME166474	1.32	0.39	0.99
LysoPE (20:4)_R1	ME166466	0.62	0.28	1.29
LysoPE (18:1)_R1	ME166464	0.58	0.36	1.30
LysoPE (22:6)	ME166468	0.54	0.34	1.31
LysoPE (16:0)	ME166462	0.35	0.13	1.43
LysoPE (18:0)	ME166463	0.35	0.12	1.43
Arachidonic Acid (20:4)	ME166413	0.35	0.22	1.42
Docosahexaenoic Acid (22:6)	ME166431	0.39	0.25	1.40
Plasmenyl-LysoPE (P-18:1)	ME166492	0.39	0.29	1.39
Linoleic Acid (18:2)	ME166453	0.45	0.38	1.35
LysoPE (18:1)_R2	ME166465	0.47	0.26	1.36
Mono-(2-Ethylhexyl) Phthalate Dimer	ME166471	0.48	0.29	1.35
2^-DEOXYCYTIDINE 5^-MONOPHOSPHATE	ME166398	1.31	1.68	0.74
GLUCONIC ACID/D-GULONIC ACID GAMA-LACTONE	ME166434	1.19	1.52	0.82
THYMIDINE 5^-MONOPHOSPHATE	ME166504	1.22	1.43	0.83
ADP	ME166412	0.93	1.37	0.96
N-ACETYLNEURAMINATE	ME166480	0.97	1.35	0.94
4-oxoproline	ME166408	0.93	1.43	0.94
HYPOXANTHINE	ME166443	0.89	1.40	0.96
GLUTATHIONE	ME166437	0.83	1.41	0.98
L-2-PHOSPHOGLYCERIC ACID	ME166446	0.81	1.32	1.01
L-GLUTAMINE	ME166451	0.88	1.33	0.98
INOSINE	ME166444	0.98	1.56	0.90
LL-2,6-DIAMINOHEPTANEDIOATE	ME166456	1.08	1.48	0.87
ASPARTATE	ME166415	1.02	1.43	0.90
L-GLUTAMIC ACID	ME166450	1.03	1.37	0.91
Guanosine	ME166442	1.37	1.20	0.81
C6H12O6-HEXOSE/KETOSE/INOSITOL	ME166418	1.19	1.28	0.87
URIDINE	ME166509	1.17	1.28	0.88
GLUCOSE/FRUCTOSE_R1	ME166435	1.14	1.21	0.90
CITRIC ACID-13C6	ME166421	1.10	1.24	0.91
GLUCOSE/FRUCTOSE_R2	ME166436	1.11	1.23	0.91
3-HYDROXY-3-METHYLGLUTARATE	ME166399	1.08	1.67	0.83
N-ACETYL-D-MANNOSAMINE	ME166476	0.99	1.81	0.84
CMP_R1	ME166422	1.14	1.75	0.79
L-CYSTATHIONINE	ME166448	1.14	1.82	0.78
D-GLUCURONIC ACID/D-GLUCURONOLACTONE/D-(+)-GALACTURONIC ACID	ME166428	1.11	1.83	0.79
TAURINE	ME166502	1.10	1.81	0.80
SARCOSINE/BETA-ALANINE	ME166498	0.86	1.82	0.89
URIDINE-5-MONOPHOSPHATE	ME166510	0.83	1.78	0.91
CREATINE	ME166424	0.86	1.92	0.87
NICOTINAMIDE	ME166487	0.95	2.01	0.82
SUCCINATE	ME166500	0.94	1.95	0.83
N-METHYL-L-GLUTAMATE_R1	ME166488	0.56	1.78	1.02
5-AMINOLEVULINIC ACID	ME166409	0.61	1.43	1.07
OROTIC ACID	ME166490	0.58	1.47	1.07
4-METHYL-2-OXO-PENTANOIC ACID_R1	ME166406	0.64	1.49	1.04
4-METHYL-2-OXO-PENTANOIC ACID_R2	ME166407	0.66	1.46	1.04
3-METHYL-2-OXOVALERIC ACID	ME166401	0.61	1.54	1.05
(S)-DIHYDROOROTATE	ME166396	0.65	1.53	1.03
N-ACETYL-HEXOSAMINE	ME166477	0.85	1.64	0.93
S-(5^-ADENOSYL)-L-HOMOCYSTEINE	ME166496	0.89	1.59	0.93
PYRIDOXINE	ME166495	0.72	1.68	0.98
Glyceraldehyde	ME166438	0.80	1.60	0.96
URACIL	ME166507	0.78	1.60	0.97
MALATE	ME166469	0.79	1.68	0.95
URATE	ME166508	0.79	1.64	0.95
CYTIDINE	ME166426	0.97	0.62	1.09
Monobutyl phthalate	ME166472	0.79	0.47	1.19
L-ARGININE	ME166447	0.74	0.58	1.19
3-methyladipic acid	ME166402	0.81	0.61	1.15
Proline	ME166493	0.81	0.69	1.14
GLYCERALDEHYDE/LACTATE	ME166439	0.57	0.89	1.19
ISOCITRIC ACID	ME166445	0.45	0.83	1.25
CITRATE	ME166420	0.64	1.18	1.11
XANTHINE	ME166511	0.64	1.26	1.09
ADENINE	ME166410	0.85	0.80	1.10
N-ACETYL-L-ALANINE	ME166478	0.80	0.82	1.12
ADENOSINE 5^-MONOPHOSPHATE	ME166411	0.93	0.79	1.07
ASPARAGINE	ME166414	0.93	0.82	1.07
L-Tryptophan-13C11	ME166458	0.92	0.83	1.07
SUCCINIC ACID-13C4	ME166501	0.86	0.92	1.07
Caffeic Acid	ME166419	0.93	0.97	1.03
L-CYSTEINE	ME166449	0.98	0.87	1.04
4-HYDROXYBENZALDEHYDE	ME166405	0.93	0.90	1.05
L-HISTIDINE	ME166452	0.94	0.90	1.05
L-METHIONINE	ME166457	0.69	1.00	1.13
L-TYROSINE	ME166459	0.71	0.91	1.13
Tryptophan	ME166505	0.74	0.91	1.12
N-BOC-L-Tryptophan_R1	ME166485	0.86	1.17	1.02
N-BOC-L-Tryptophan_R2	ME166486	0.87	1.16	1.02
N-BOC-L-tert-Leucine_R1	ME166483	0.89	1.06	1.03
BOC-L-Tyrosine_R1	ME166416	0.92	1.10	1.01
BOC-L-Tyrosine_R2	ME166417	0.89	1.12	1.02
N-BOC-L-tert-Leucine_R2	ME166484	0.88	1.09	1.03
Salicylic Acid-D4	ME166497	0.89	1.10	1.02
2^,4^-DIHYDROXYACETOPHENONE	ME166397	0.96	1.06	1.00
3-tert-Butyladipic acid	ME166404	0.98	1.14	0.98
L-VALINE	ME166460	0.74	1.06	1.09
L-ISOLEUCINE_R2	ME166455	0.75	1.12	1.07
LysoPC (18:1)	ME166461	0.74	1.10	1.09
Dinoterb (herbicide)	ME166430	0.83	1.11	1.05
L-ISOLEUCINE_R1	ME166454	0.81	1.08	1.06
3-Hydroxydecanoic acid	ME166400	0.82	0.97	1.08
N-BOC-L-Aspartic Acid_R1	ME166481	0.84	1.05	1.06
N-BOC-L-Aspartic Acid_R2	ME166482	0.84	1.03	1.06
N-METHYL-L-GLUTAMATE_R2	ME166489	0.80	1.01	1.08
THREONINE/HOMOSERINE	ME166503	0.80	1.03	1.08
N-ACETYL-L-ASPARTIC ACID	ME166479	1.72	1.08	0.70
3-SULFINO-L-ALANINE	ME166403	1.13	0.98	0.95
DEOXYCYTIDINE	ME166427	1.43	0.90	0.85
D-RIBOSE 5-PHOSPHATE/RIBULOSE 5-PHOSPHATE	ME166432	1.34	0.89	0.89
N-Acetylaspartylglutamic acid	ME166473	3.09	0.13	0.34
UDP	ME166506	2.34	1.63	0.34

Factors:

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

Data matrix