Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Lung Cancer Cells 4 (Study ST000010)

LC/Electro-spray /QTOF negative ion mode (Analysis AN000026)

Metabolite	Structure	F1	F2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12	F13
PYRIDINE-2,3-DICARBOXYLATE	ME643596	11.11	6.46	0.12	0.18	0.21	0.32	0.30	0.26	0.16	0.19	0.24	0.11	0.03
4-PYRIDOXATE	ME643489	4.37	5.11	0.20	0.19	0.22	0.21	0.27	0.21	0.20	0.41	0.35	0.28	0.20
DOCOSAPENTAENOATE	ME643528	4.23	6.12	0.12	0.06	0.12	NA	0.12	0.17	0.12	0.09	0.13	0.05	0.07
THREONATE	ME643611	5.21	0.38	0.83	0.08	0.21	0.10	0.17	2.68	1.59	2.30	0.52	0.07	0.27
N-BENZYLOXYCARBONYLGLYCINE	ME643571	1.27	0.77	NA	NA	NA	0.85	0.55	0.99	NA	0.72	0.60	4.78	0.31
PALMITOLEIC ACID	ME643582	NA	6.09	0.66	0.33	0.85	0.76	0.91	0.75	0.68	1.09	1.38	1.02	0.85
4-HYDROXYPHENYLACETATE	ME643485	NA	3.39	1.33	0.63	1.58	0.98	1.32	NA	0.65	NA	0.50	NA	0.43
CARNOSINE	ME643513	NA	4.17	NA	0.16	0.17	NA	0.07	0.11	0.15	NA	0.19	NA	0.04
THYROXINE	ME643613	2.86	4.00	NA	NA	0.25	0.25	0.12	NA	0.25	0.20	0.22	0.16	0.32
TAUROCHENODEOXYCHOLATE	ME643607	3.18	3.55	NA	0.04	0.05	NA	NA	NA	0.07	0.06	0.05	0.06	NA
GLYCERIC ACID	ME643539	3.34	3.11	0.17	0.09	0.16	0.28	NA	0.13	0.20	0.17	NA	NA	0.11
HIPPURATE	ME643550	3.03	2.94	NA	NA	NA	0.01	0.01	0.01	NA	0.01	0.00	0.01	0.01
6-PHOSPHOGLUCONIC ACID	ME643495	3.42	2.26	0.54	0.70	0.29	0.74	0.59	0.60	0.48	0.28	1.22	0.81	0.93
URACIL	ME643615	2.81	2.10	NA	0.41	0.43	0.55	0.58	NA	0.28	1.24	0.89	0.39	0.22
15(S)-HETE	ME643452	2.51	2.84	0.92	0.59	0.63	NA	0.65	0.57	0.46	0.40	0.66	0.55	0.02
2-HYDROXYBUTYRIC ACID	ME643462	2.63	2.70	0.32	0.62	0.46	0.09	NA	NA	0.38	0.62	0.71	0.53	0.32
INOSINE	ME643553	2.83	2.59	0.65	0.23	0.36	0.27	0.51	0.83	0.95	1.20	0.88	0.17	0.46
17BETA-HYDROXYANDROSTAN-3-ONE	ME643453	3.59	3.00	0.70	0.37	0.58	0.38	0.50	0.43	0.79	0.69	0.51	0.59	0.46
TAURINE	ME643606	3.44	3.28	0.41	0.39	0.48	0.64	0.54	0.50	0.46	0.79	0.67	0.42	0.34
B-ALANYL-N(PAI)-METHYL-L-HISTIDINE	ME643509	2.08	1.95	NA	NA	NA	0.31	0.38	0.65	0.85	0.41	0.26	0.14	NA
PHYTIC ACID	ME643591	1.74	3.16	0.42	NA	NA	NA	0.71	0.35	0.43	1.11	0.81	0.41	0.68
OROTATE	ME643578	4.66	1.80	NA	0.21	0.12	0.13	NA	0.51	0.44	0.56	0.28	0.14	NA
3-(4-HYDROXYPHENYL)LACTATE	ME643467	3.62	NA	NA	NA	0.42	0.53	NA	0.41	0.31	1.48	NA	0.74	NA
XANTHOSINE 5^-MONOPHOSPHATE	ME643621	3.91	0.47	0.84	0.56	NA	0.80	0.70	NA	0.68	0.89	1.42	0.29	0.35
PHOSPHO(ENOL)PYRUVIC ACID	ME643587	4.81	0.74	1.05	0.85	0.43	0.74	0.82	0.42	0.41	0.56	0.57	0.79	0.66
FRUCTOSE 1,6-BIPHOSPHATE	ME643533	3.84	0.41	0.72	0.82	0.68	1.05	0.67	0.60	0.70	1.14	0.79	0.70	0.76
GUANOSINE 5`-DIPHOSPHATE	ME643545	3.68	1.01	0.43	0.61	0.60	0.79	0.61	0.24	0.48	0.84	0.19	0.98	0.97
N-ACETYL-D-TRYPTOPHAN	ME643567	NA	0.13	1.17	NA	NA	0.75	0.18	0.20	0.35	3.15	1.51	0.22	1.08
ACETYLENEDICARBOXYLATE	ME643498	0.22	NA	NA	1.74	0.22	NA	0.29	NA	1.99	0.25	NA	1.56	NA
ADENINE	ME643500	0.90	1.72	NA	0.71	0.65	NA	1.31	1.19	1.17	1.11	0.60	0.86	NA
PHOSPHOETHANOLAMINE	ME643589	NA	2.52	NA	0.53	0.56	0.11	0.29	1.37	1.51	NA	0.18	NA	0.15
AZELAIC ACID	ME643508	1.04	1.28	0.41	0.59	0.63	0.74	0.44	1.70	2.87	1.05	0.62	1.29	0.13
XANTHINE	ME643620	0.60	1.34	1.60	NA	NA	NA	0.19	2.09	2.66	0.29	0.05	0.08	NA
ADENOSINE 5`-DIPHOSPHATE	ME643502	0.07	2.27	0.66	1.82	0.37	0.45	0.34	0.70	0.66	1.38	0.74	2.35	0.35
3-HYDROXYBENZYL ALCOHOL	ME643475	1.49	NA	1.22	0.59	1.57	NA	0.84	0.58	0.60	1.09	NA	0.77	NA
THIAMINE PYROPHOSPHATE	ME643610	0.39	NA	NA	0.73	0.57	1.48	1.23	1.06	1.47	1.48	0.68	1.18	0.72
PHENYLPYRUVATE	ME643585	0.90	0.27	NA	NA	1.25	0.86	1.09	NA	1.27	0.79	0.83	1.02	1.20
BILIVERDIN	ME643511	0.67	NA	NA	NA	1.00	1.30	0.89	NA	1.00	1.02	NA	1.06	NA
HYPOXANTHINE	ME643551	1.69	NA	NA	0.62	0.86	1.02	0.82	0.59	0.55	1.39	NA	1.14	NA
CYTIDINE 5`-TRIPHOSPHATE	ME643522	1.04	0.76	0.85	0.57	0.70	0.98	0.99	0.45	0.49	1.28	2.01	1.09	1.80
URIDINE 5`-TRIPHOSPHATE	ME643619	1.16	0.54	NA	0.45	0.58	0.90	0.56	0.10	0.45	1.24	1.83	1.37	2.05
GERANYL PYROPHOSPHATE	ME643536	0.85	0.73	1.09	NA	NA	1.13	NA	NA	NA	0.94	0.97	0.87	1.36
FORMYL-L-METHIONINE	ME643532	1.31	0.98	0.61	NA	0.80	1.01	1.23	NA	NA	0.89	0.56	1.58	1.13
INDICAN	ME643552	1.39	1.94	0.46	NA	NA	0.68	0.54	NA	NA	0.70	0.69	1.21	0.53
GUANOSINE 5`-TRIPHOSPHATE	ME643546	2.48	1.19	0.50	0.68	0.61	1.06	1.46	0.19	0.63	1.43	1.01	1.06	2.00
4-METHYL-2-OXO-PENTANOIC ACID	ME643486	1.86	0.63	0.22	0.34	0.80	1.29	1.51	0.27	0.23	1.93	1.38	1.35	0.96
URIDINE 5`-DIPHOSPHOGLUCOSE	ME643617	2.55	0.69	0.60	0.36	0.87	1.36	0.48	0.65	0.40	1.80	0.60	1.32	1.10
N-ACETYL-D-GALACTOSAMINE	ME643566	2.33	1.32	0.46	0.36	NA	0.54	0.77	0.54	NA	1.86	NA	0.77	0.90
LIGNOCERIC ACID	ME643556	2.59	1.53	0.87	0.48	NA	1.03	1.15	0.89	1.02	0.90	0.63	0.68	0.61
ACONITATE	ME643499	1.46	1.73	0.48	0.51	0.49	0.85	0.77	0.48	0.49	1.86	1.77	1.02	0.95
5-PHOSPHO-ALPHA-D-RIBOSE	ME643494	1.56	1.70	0.76	0.62	0.86	0.72	0.88	0.75	0.64	1.56	1.22	0.79	0.95
PYRUVATE	ME643599	1.57	1.70	0.54	0.77	0.65	0.82	0.69	0.63	0.68	1.58	1.38	0.94	0.88
4-OXOGLUTARAMATE	ME643488	2.02	1.47	0.93	NA	1.00	0.68	0.65	0.97	0.97	1.00	0.69	0.82	0.55
HEXADECANEDIOATE	ME643548	1.48	1.47	0.87	NA	0.73	1.03	0.86	0.93	0.89	1.04	0.63	1.08	0.92
3-(2-HYDROXYPHENYL)PROPANOATE	ME643466	2.52	1.30	1.07	0.76	0.52	0.84	0.60	0.68	0.59	1.12	0.84	0.93	1.03
(S)-LACTATE	ME643447	2.15	1.46	0.81	0.70	0.79	0.80	0.87	0.68	0.59	1.06	1.04	0.85	0.82
STACHYOSE	ME643604	1.83	1.47	1.12	0.52	0.32	1.12	1.09	1.08	0.59	1.65	0.91	0.61	0.73
GULONO-1,4-LACTONE	ME643547	1.81	1.51	1.03	0.74	0.81	0.94	0.79	0.87	0.76	1.93	0.38	0.95	0.49
PHOSPHOCREATINE	ME643588	2.02	1.42	0.71	0.67	0.82	0.89	0.76	0.90	0.98	1.55	0.96	0.68	0.57
HEXANOATE	ME643549	2.11	2.16	0.79	0.77	0.62	0.70	0.77	0.93	0.93	0.99	0.61	0.80	0.82
MYRISTIC ACID	ME643564	1.72	2.11	0.79	0.97	0.73	0.80	0.98	0.86	0.88	0.48	0.73	0.86	1.09
THYMIDINE	ME643612	2.33	1.98	0.66	0.43	0.45	0.51	0.62	0.79	NA	1.19	0.87	0.66	1.12
URIDINE	ME643616	2.41	2.10	0.55	0.25	0.48	0.61	0.68	0.71	0.64	1.54	1.03	0.47	1.06
1-AMINOCYCLOPROPANE-1-CARBOXYLATE	ME643454	2.27	1.13	NA	NA	0.78	0.72	0.66	1.00	0.64	1.03	1.01	0.97	0.58
DIHYDROXYACETONE PHOSPHATE	ME643525	3.00	1.27	NA	0.72	0.49	0.57	0.67	NA	1.03	0.79	1.04	0.39	0.51
OROTIDINE 5`-MONOPHOSPHATE	ME643579	3.03	1.10	NA	0.92	0.62	0.45	0.56	1.04	0.89	0.82	0.78	0.41	0.58
NADP	ME643570	1.01	NA	0.98	0.62	0.51	1.66	0.25	0.56	0.51	1.96	1.14	1.77	0.78
URIDINE 5`-DIPHOSPHOGLUCURONIC ACID	ME643618	1.55	0.33	0.86	0.81	0.83	1.19	0.70	0.84	0.96	1.69	1.30	1.02	0.83
ADENOSINE-5`-DIPHOSPHOGLUCOSE	ME643503	1.79	0.83	0.86	0.58	0.92	0.90	0.30	0.93	0.88	1.78	0.67	1.70	0.62
FLAVIN ADENINE DINUCLEOTIDE	ME643531	1.76	0.18	1.19	1.04	0.74	0.59	0.43	1.18	1.13	2.26	0.67	1.32	0.45
5-AMINOLEVULINIC ACID	ME643491	NA	1.53	0.33	0.63	0.97	0.65	0.90	0.68	1.38	1.24	1.25	1.24	0.67
CITRATE	ME643515	NA	1.63	0.57	0.56	0.65	0.90	0.75	0.59	0.63	2.14	1.64	1.14	1.09
2`-DEOXYURIDINE 5`-TRIPHOSPHATE	ME643459	0.33	1.00	0.91	1.54	1.29	1.19	1.37	0.38	NA	0.91	1.05	1.09	0.29
3,4-DIHYDROXYBENZOATE	ME643468	0.60	0.87	1.68	0.82	0.82	1.35	1.62	1.47	NA	0.67	0.54	0.92	0.62
3-HYDROXY-3-METHYLGLUTARATE	ME643472	0.70	0.66	2.10	1.34	0.61	0.78	1.26	1.50	0.58	0.83	0.69	0.68	1.27
LAURIC ACID	ME643555	1.17	1.31	0.76	1.20	0.59	0.60	0.90	1.21	0.97	0.72	0.69	1.22	1.51
PANTOATE	ME643583	1.01	1.14	NA	1.37	0.47	NA	1.06	1.38	1.07	0.80	0.54	1.16	1.06
3-HYDROXYANTHRANILATE	ME643473	1.26	0.70	0.90	1.00	1.02	NA	1.03	1.14	1.23	1.33	0.97	0.90	0.69
GLYOXYLATE	ME643543	0.97	1.11	NA	1.42	0.73	0.89	0.94	0.83	0.71	1.27	1.31	0.91	1.26
DECANOATE	ME643523	0.98	0.70	0.70	0.97	0.75	0.72	0.73	0.98	0.86	1.12	1.39	1.30	1.62
2-OXO-3-HYDROXY-4-PHOSPHOBUTANOATE	ME643464	1.14	1.07	0.52	1.18	0.66	1.22	1.05	0.98	1.02	0.99	1.42	1.14	0.63
ASPARTATE	ME643507	0.85	1.09	0.73	0.85	0.83	0.95	0.89	0.84	0.79	1.31	1.33	1.10	1.30
FUMARIC ACID	ME643534	1.18	0.99	0.62	0.94	0.80	1.20	0.94	0.83	0.80	1.19	1.31	1.03	1.09
MALATE	ME643557	1.27	1.03	0.75	0.91	0.72	1.18	0.91	0.73	0.72	1.30	1.37	1.10	1.03
CAPRYLIC ACID	ME643512	1.32	1.23	0.63	0.88	0.80	1.04	0.52	1.29	1.01	1.23	1.12	0.90	0.85
GLUTAMIC ACID	ME643537	1.49	1.12	0.78	0.57	0.74	0.72	0.77	0.99	0.87	1.36	1.53	0.84	1.06
5-HYDROXYINDOLE-3-ACETIC ACID	ME643492	0.86	0.91	1.06	0.98	1.01	1.03	1.03	1.03	NA	1.04	1.04	1.02	0.98
PHTHALATE	ME643590	0.72	1.20	1.14	1.36	0.95	0.82	0.94	0.80	NA	0.94	0.94	1.06	1.02
GLUTAMINE	ME643538	0.31	0.73	1.44	1.12	1.31	1.18	0.86	1.30	0.96	0.77	0.68	1.07	1.28
SERINE	ME643602	0.50	0.56	1.36	1.18	1.22	1.10	1.04	1.29	0.99	0.88	0.84	1.14	1.17
N-ACETYLNEURAMINATE	ME643569	1.14	1.24	1.23	1.02	1.15	1.09	1.00	1.00	0.80	0.80	0.88	0.63	1.02
MYO-INOSITOL	ME643563	1.13	1.41	1.04	0.99	1.03	0.92	0.91	1.00	0.84	0.87	0.81	0.97	1.02
TRYPTOPHAN	ME643614	1.19	1.16	1.02	1.03	0.97	0.95	0.96	0.85	0.79	0.95	0.83	1.21	1.07
11BETA,21-DIHYDROXY-5BETA-PREGNANE-3,20-DIONE	ME643449	0.71	0.97	1.16	1.06	0.83	1.15	0.96	0.78	0.78	0.91	1.03	1.29	1.12
PYRIDOXINE	ME643598	0.59	0.91	1.23	1.20	1.13	1.02	1.13	0.89	0.87	0.77	0.79	1.27	1.25
NONANOATE	ME643576	0.84	0.86	0.75	1.11	0.95	0.86	0.91	1.10	0.95	1.01	1.18	1.16	1.24
METHIONINE	ME643561	0.60	0.86	1.07	1.12	1.15	1.01	1.01	1.04	0.98	1.03	0.86	1.21	1.07
PHOSPHATE	ME643586	0.70	0.98	1.18	1.14	1.12	1.04	1.08	1.09	1.13	0.87	0.90	0.96	0.97
5,6-DIHYDROURACIL	ME643490	0.91	0.88	1.05	0.99	0.97	1.02	1.02	0.96	0.92	1.07	1.04	1.12	1.08
ARGININE	ME643506	0.72	0.79	0.89	1.01	1.11	1.11	1.12	0.95	1.16	1.07	1.14	1.01	0.99
[C13] PHENYLALANINE	ME643448	0.73	0.79	0.94	1.01	1.13	1.09	1.13	0.97	1.18	1.09	1.09	1.03	0.86
1-HYDROXY-2-NAPHTHOATE	ME643455	0.16	0.37	1.38	0.89	1.84	1.30	0.96	1.36	1.31	0.79	0.69	0.87	0.64
3,4-DIHYDROXYPHENYL GLYCOL	ME643469	NA	0.28	0.92	NA	1.40	1.19	1.07	1.31	1.56	0.90	0.66	0.73	0.40
4-AMINOBENZOATE	ME643481	0.68	0.84	1.87	0.67	0.72	1.28	0.66	1.50	1.94	0.33	0.36	0.66	1.15
ORNITHINE	ME643577	1.06	0.93	1.30	0.65	1.24	0.69	0.62	1.93	1.36	1.05	0.75	0.54	0.49
3-HYDROXYBENZALDEHYDE	ME643474	0.91	0.90	1.24	1.07	1.27	1.17	0.59	1.33	1.74	0.96	0.58	0.78	0.57
4-NITROPHENOL	ME643487	0.77	0.82	1.56	0.91	1.12	1.01	1.01	1.44	1.46	0.81	0.65	0.58	0.87
MALONATE	ME643558	0.61	0.92	0.57	1.33	1.23	0.74	0.63	1.71	1.92	0.75	0.79	0.81	0.49
OXALATE	ME643580	0.32	0.82	0.95	1.14	1.57	0.82	1.25	1.42	1.82	0.47	0.76	0.63	0.88
2-HYDROXYGLUTARATE	ME643463	NA	NA	1.56	0.78	1.17	0.48	1.83	0.66	1.11	NA	NA	NA	NA
ISOLEUCINE/LEUCINE	ME643554	NA	0.46	1.47	1.01	NA	1.13	0.94	0.87	NA	NA	0.68	NA	1.36
4-(2-AMINO-3-HYDROXYPHENYL)-2,4-DIOXOBUTANOATE	ME643479	NA	1.74	0.79	0.73	NA	1.41	NA	0.59	0.58	NA	0.90	NA	1.36
5-OXO-PROLINE	ME643493	NA	1.17	1.17	0.83	NA	1.11	0.99	NA	0.76	NA	0.88	NA	0.98

Factors:

F1	FCS:FCS \| Hours:72 \| REFED:NO_REFED \| TGF:NO_TGF
F2	FCS:FCS \| Hours:72 \| REFED:NO_REFED \| TGF:TGF
F3	FCS:NO_FCS \| Hours:0 \| REFED:NO_REFED \| TGF:NO_TGF
F4	FCS:NO_FCS \| Hours:12 \| REFED:NO_REFED \| TGF:NO_TGF
F5	FCS:NO_FCS \| Hours:12 \| REFED:NO_REFED \| TGF:TGF
F6	FCS:NO_FCS \| Hours:24 \| REFED:NO_REFED \| TGF:NO_TGF
F7	FCS:NO_FCS \| Hours:24 \| REFED:NO_REFED \| TGF:TGF
F8	FCS:NO_FCS \| Hours:2 \| REFED:NO_REFED \| TGF:NO_TGF
F9	FCS:NO_FCS \| Hours:2 \| REFED:NO_REFED \| TGF:TGF
F10	FCS:NO_FCS \| Hours:72 \| REFED:NO_REFED \| TGF:NO_TGF
F11	FCS:NO_FCS \| Hours:72 \| REFED:NO_REFED \| TGF:TGF
F12	FCS:NO_FCS \| Hours:72 \| REFED:REFED_48 \| TGF:NO_TGF
F13	FCS:NO_FCS \| Hours:72 \| REFED:REFED_48 \| TGF:TGF

Data matrix