Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Systemic Metabolomic Changes in Blood Samples of Lung Cancer Patients Identified by Gas Chromatography Time-of-Flight Mass Spectrometry (Study ST000392)

GC POSITIVE ION MODE (Analysis AN000628)

Metabolite	Structure	F1	F2	F3	F4	F5	F6	F7	F8	F9	F10	F11	F12	F13	F14	F15	F16	F17
UDP-glucuronic acid	ME134059	0.53	1.09	0.64	0.85	7.71	0.61	0.71	1.21	0.57	1.08	0.65	0.85	7.31	0.47	0.64	1.15	0.99
galactitol	ME134152	9.39	0.34	0.59	0.77	0.67	0.37	0.38	3.01	0.15	0.39	0.58	0.75	0.65	0.38	0.38	1.94	0.66
1-monostearin	ME134210	0.20	0.28	1.10	4.05	0.20	0.22	0.21	0.20	0.28	1.25	0.62	0.78	0.10	0.32	0.25	2.64	0.21
xylitol	ME134054	0.74	1.32	0.75	1.13	4.61	0.86	0.84	1.20	0.76	1.31	0.72	0.69	4.46	0.56	0.81	1.18	0.75
arabitol	ME134184	0.42	1.27	0.95	1.09	3.46	0.80	0.86	0.95	0.58	1.13	0.93	0.98	3.01	0.74	0.95	0.92	0.95
levoglucosan	ME134121	0.32	1.12	0.90	1.06	3.80	0.83	0.92	0.88	0.35	1.29	0.86	1.09	3.70	0.81	0.84	0.87	0.99
pipecolinic acid	ME134085	0.62	0.32	0.66	0.60	0.19	0.33	1.48	0.44	0.92	0.61	1.05	1.04	0.36	0.59	4.25	0.86	0.53
2,4-diaminobutyric acid	ME134199	1.48	1.62	1.36	1.60	2.77	1.22	1.49	1.23	0.17	0.38	0.25	0.23	0.28	0.27	0.37	0.35	2.06
nicotinic acid	ME134102	1.78	1.94	1.42	2.03	2.57	1.61	1.81	1.32	0.09	0.09	0.08	0.08	0.07	0.08	0.10	0.08	1.94
N-acetylornithine	ME134105	1.30	1.69	1.82	1.69	1.79	2.71	1.70	1.59	0.06	0.06	0.05	0.05	0.06	0.07	0.06	0.06	1.67
N-acetyl-5-hydroxytryptamine	ME134107	1.78	1.72	1.71	1.63	1.94	1.98	1.82	2.01	0.01	0.01	0.01	0.01	0.00	0.01	0.01	0.01	1.79
oxalic acid	ME134097	1.43	1.52	1.51	1.94	2.07	1.95	1.75	1.54	0.01	0.03	0.03	0.04	0.04	0.03	0.02	0.03	2.16
adenosine-5-monophosphate	ME134189	0.97	2.52	2.54	2.53	0.99	1.46	0.65	0.47	0.24	0.41	0.29	0.55	0.24	0.29	0.53	0.33	0.98
pyruvic acid	ME134078	2.76	2.37	2.02	2.20	0.75	0.57	1.03	1.30	0.81	0.61	0.26	0.22	0.12	0.12	0.18	0.30	1.44
fructose	ME134156	1.21	0.34	0.44	0.60	0.04	2.40	1.12	0.73	1.25	0.43	0.60	0.69	0.07	3.07	2.43	0.55	1.05
2-hydroxyhippuric acid	ME134204	0.38	0.62	0.43	1.84	0.22	0.44	0.40	0.71	0.24	0.55	0.44	1.39	0.32	0.43	0.43	0.66	3.28
salicylaldehyde	ME134075	0.74	0.67	0.59	0.80	0.92	0.72	0.59	0.77	0.64	0.59	0.56	0.75	0.84	0.50	0.57	0.65	3.89
galactinol	ME134153	3.56	0.79	0.81	0.96	0.67	0.91	0.98	1.10	3.18	0.89	0.83	0.90	0.94	0.88	0.88	1.10	1.09
cellobiose	ME134171	1.87	0.72	1.19	1.22	0.66	0.77	0.91	0.99	2.15	0.81	1.22	1.23	0.67	0.60	0.85	0.95	0.85
mannitol	ME134114	2.50	0.58	0.79	1.03	0.35	0.73	0.76	1.55	2.68	0.64	0.78	1.05	0.44	0.79	0.81	1.59	0.86
conduritol-beta-epoxide	ME134167	0.26	1.91	1.19	1.67	0.27	0.38	0.58	0.62	0.30	1.90	1.32	1.64	0.25	0.33	0.61	0.60	0.83
3-hydroxybutyric acid	ME134195	0.15	0.59	0.79	2.06	0.25	0.60	0.96	0.69	0.18	0.61	0.81	2.18	0.28	0.62	0.99	0.71	0.88
salicylic acid	ME134074	0.09	0.85	0.40	2.90	0.13	0.31	0.37	0.85	0.08	0.84	0.40	2.78	0.10	0.33	0.38	0.81	0.91
shikimic acid	ME134072	0.55	0.23	0.46	0.32	0.50	0.27	0.43	0.50	2.64	1.56	1.67	2.06	0.61	1.95	1.55	1.42	0.62
aspartic acid	ME134180	0.45	0.48	0.53	0.48	0.67	0.35	0.30	0.31	1.51	1.57	2.88	2.72	1.08	1.02	0.97	0.86	0.44
taurine	ME134068	0.62	0.85	0.94	0.68	0.75	0.44	0.30	0.27	1.90	1.76	2.05	1.79	2.20	1.35	1.28	1.07	0.44
azelaic acid	ME134179	0.79	0.59	0.62	0.59	0.60	0.62	0.54	0.55	0.90	1.74	1.40	2.19	1.00	1.70	1.16	1.11	0.62
hypoxanthine	ME134133	0.87	0.70	0.59	0.66	0.42	0.36	0.44	0.52	1.73	1.66	1.84	2.04	1.66	1.12	1.00	1.44	0.51
indoxyl sulfate	ME134130	0.63	0.51	0.54	0.59	0.53	0.48	0.55	0.61	1.24	1.69	1.86	2.22	1.33	0.94	1.13	1.25	0.53
maltose	ME134116	0.49	1.06	0.94	1.76	0.66	0.76	0.44	0.45	1.25	0.77	2.62	0.88	0.56	1.93	0.41	0.90	0.60
inosine	ME134129	0.31	0.43	0.40	0.45	0.43	0.49	0.54	1.22	0.83	1.18	1.05	1.05	1.36	2.06	1.41	2.22	0.65
lactamide	ME134125	0.20	1.01	1.37	1.48	0.11	1.39	0.38	0.43	0.24	1.27	1.23	1.58	0.18	1.94	0.63	0.59	0.88
behenic acid	ME134178	0.64	0.85	0.85	0.82	1.03	1.01	1.25	0.82	0.82	0.74	0.84	0.67	0.76	2.98	1.49	0.78	0.92
diglycerol	ME134160	0.85	0.81	0.81	0.94	0.70	1.63	0.80	0.76	0.73	0.94	1.14	1.17	0.76	2.79	1.02	0.73	0.72
glycerol-alpha-phosphate	ME134143	0.36	0.54	0.72	0.74	0.62	1.69	0.73	0.65	0.73	0.96	1.22	1.35	0.32	3.27	1.18	0.85	0.65
pyrophosphate	ME134080	1.00	2.09	1.97	2.03	1.07	1.24	0.58	0.64	0.66	0.81	0.61	0.57	0.88	0.45	0.65	0.39	1.27
3-phosphoglycerate	ME134194	1.45	1.38	1.69	1.68	0.91	1.16	0.78	0.87	0.47	0.70	0.71	0.67	0.51	0.68	0.66	0.70	1.30
alpha-ketoglutarate	ME134186	1.35	1.58	1.42	1.51	1.30	0.96	1.19	1.15	0.86	0.86	0.56	0.71	0.52	0.48	0.56	0.57	1.30
2-ketoglucose dimethylacetal NIST	ME134202	0.82	1.08	1.27	1.03	0.93	1.85	1.07	1.19	0.78	0.74	0.78	0.71	0.85	0.66	0.58	0.64	1.54
arachidic acid	ME134183	1.20	1.35	1.46	1.11	1.47	1.28	1.52	1.25	0.61	0.53	0.56	0.42	0.73	1.31	0.51	0.58	1.33
phosphoethanolamine	ME134086	0.75	1.38	1.06	1.45	1.42	0.87	0.86	0.70	0.61	0.70	0.69	0.60	0.71	0.63	0.70	0.58	2.32
phosphate	ME134087	1.30	1.46	1.55	1.47	1.62	1.41	1.45	1.43	0.32	0.41	0.43	0.40	0.47	0.44	0.40	0.46	1.49
pyrrole-2-carboxylic acid	ME134079	1.28	1.34	1.01	1.67	1.47	1.24	1.21	1.12	0.39	0.48	0.35	0.46	0.46	0.40	0.46	0.44	2.25
alloxanoic acid NIST	ME134187	1.06	1.70	1.17	1.64	1.86	1.52	1.34	1.14	0.50	0.41	0.44	0.35	0.52	0.54	0.43	0.36	1.85
parabanic acid NIST	ME134092	1.03	1.56	1.15	1.63	1.71	1.31	1.34	1.24	0.43	0.40	0.38	0.37	0.41	0.33	0.50	0.51	1.90
hexitol	ME134139	0.46	1.09	0.44	0.67	1.89	1.54	1.59	0.88	0.35	1.29	0.49	0.74	0.35	1.64	2.06	1.06	0.60
quinic acid	ME134077	0.14	0.89	0.74	0.66	1.40	1.50	1.97	0.62	0.16	0.83	0.76	0.69	1.38	1.47	2.05	0.64	0.93
5-hydroxynorvaline NIST	ME134193	0.38	0.95	0.66	0.82	1.73	1.05	1.51	0.87	0.38	0.99	0.79	0.91	1.64	1.09	1.61	0.92	0.96
nornicotine	ME134101	0.37	0.98	0.63	0.82	1.69	1.03	1.53	0.85	0.37	1.00	0.80	0.92	1.60	1.12	1.66	0.89	0.95
5-methoxytryptamine	ME134192	0.99	0.77	1.57	1.31	0.31	0.60	0.38	0.37	1.62	1.19	1.37	1.12	0.36	0.59	0.87	1.29	1.22
glutamine	ME134147	1.24	0.72	0.83	0.64	1.71	0.61	1.26	1.36	1.14	0.95	1.04	0.82	1.77	0.68	1.27	1.34	0.80
3-(3-hydroxyphenyl)propionic acid	ME134198	0.70	1.48	0.78	0.65	1.04	0.70	1.70	0.93	0.59	1.44	0.72	0.59	0.85	0.68	1.75	1.00	1.00
erythritol	ME134157	0.65	0.68	0.78	1.27	0.66	0.72	1.71	0.67	0.67	0.70	0.77	1.31	0.62	0.69	1.76	0.69	0.97
hippuric acid	ME134137	0.80	1.12	0.79	0.72	0.42	1.27	0.93	1.09	0.50	1.17	0.78	0.89	0.30	1.53	1.76	1.17	0.67
arachidonic acid	ME134182	0.46	0.90	0.68	0.85	0.94	1.54	0.77	0.76	0.37	1.33	1.15	1.29	1.08	2.08	1.13	0.80	0.80
threonic acid	ME134066	0.40	0.63	0.68	0.89	0.51	1.18	0.87	1.04	0.45	0.84	1.03	1.43	0.82	1.62	1.07	1.20	0.84
methanolphosphate	ME134112	0.60	0.95	0.87	0.82	0.84	1.18	0.92	0.85	0.79	1.13	1.24	1.06	0.96	1.66	1.04	1.16	0.75
methionine sulfoxide	ME134110	0.84	0.75	0.67	0.81	0.68	1.27	1.05	1.02	0.60	0.89	1.02	1.01	0.88	1.56	1.28	1.03	1.02
tartaric acid	ME134069	0.68	0.60	1.08	1.25	0.47	2.12	0.80	0.98	0.79	0.61	0.93	0.95	0.59	2.02	0.65	0.90	0.91
piperidone	ME134084	0.57	0.76	0.65	1.21	0.45	1.67	1.24	0.84	0.69	0.69	0.70	1.02	0.37	1.57	1.16	0.97	1.06
oxoproline	ME134096	0.31	1.14	0.92	1.33	0.45	1.79	0.70	0.70	0.36	1.08	0.93	1.27	0.48	1.72	0.78	0.74	0.99
trans-4-hydroxyproline	ME134062	0.58	1.03	1.02	1.16	0.48	1.49	0.78	0.74	0.66	1.09	1.16	1.17	0.61	1.44	0.90	0.86	0.90
beta-alanine	ME134176	1.15	1.24	1.00	0.86	0.64	0.89	0.64	0.78	1.54	1.92	1.32	1.18	0.81	1.07	0.88	0.97	0.83
dehydroascorbic acid	ME134162	0.57	0.67	0.83	0.74	0.65	0.70	0.77	0.81	1.85	0.78	1.70	0.92	1.54	0.78	1.33	1.73	0.76
glucoheptulose	ME134151	0.47	0.86	0.78	0.78	0.51	0.90	0.92	0.94	1.64	0.77	1.31	1.11	1.77	0.83	1.35	1.35	0.80
butyrolactam NIST	ME134174	0.67	0.57	0.63	1.28	0.66	0.72	0.63	0.65	1.47	1.34	1.19	1.72	1.42	0.82	1.04	1.33	0.70
creatinine	ME134166	0.65	0.62	0.65	0.61	0.45	0.61	0.71	0.76	1.23	1.57	1.44	1.38	1.30	1.44	1.44	1.48	0.55
ornithine	ME134098	1.08	0.82	0.93	0.83	0.72	0.62	0.87	0.91	1.21	1.22	1.31	1.29	1.00	1.05	1.13	1.16	0.78
fumaric acid	ME134154	0.77	0.78	0.78	0.71	0.64	0.89	0.76	0.78	1.30	1.22	1.35	1.16	0.94	1.36	1.19	1.31	0.90
asparagine	ME134181	0.83	0.70	0.64	0.68	0.80	0.79	0.86	0.88	1.26	1.21	1.30	1.27	1.10	1.38	1.37	1.31	0.71
citrulline	ME134168	0.85	0.62	0.68	0.66	0.86	0.66	1.04	0.93	1.08	1.19	1.46	1.36	1.02	1.24	1.27	1.24	0.64
histidine	ME134136	1.05	0.80	0.78	0.88	0.99	0.49	0.96	1.07	1.36	1.49	1.07	1.27	1.61	0.99	1.11	1.27	0.63
cysteine	ME134165	0.81	0.77	0.92	0.70	0.79	0.62	0.57	1.09	1.72	1.20	1.13	1.03	1.65	1.10	1.28	1.45	0.86
proline	ME134083	1.40	0.74	0.90	0.71	0.98	0.82	0.82	0.86	1.84	1.15	1.20	1.19	1.46	1.22	1.23	1.24	0.73
gluconic acid	ME134150	1.03	0.75	0.67	1.14	1.03	0.71	0.77	1.00	1.22	0.77	0.80	1.83	1.08	0.60	0.78	0.96	1.35
sucrose	ME134070	1.22	1.01	0.97	1.37	0.67	0.53	0.81	1.22	1.29	0.97	0.66	1.04	0.63	0.45	0.82	1.03	1.41
deoxypentitol	ME134161	0.95	0.85	1.14	0.88	0.78	0.58	0.81	1.03	0.68	1.00	1.59	1.38	0.76	0.75	0.91	0.92	0.92
glutamic acid	ME134148	0.78	0.85	1.10	0.96	0.60	0.46	0.79	1.00	0.89	0.97	1.67	1.40	0.68	0.62	0.99	1.00	0.85
lactic acid	ME134124	0.91	1.06	1.31	1.03	0.33	0.66	0.62	0.69	1.32	1.25	1.43	1.22	0.73	1.02	0.98	0.99	0.89
phenol	ME134090	0.89	1.05	1.13	1.04	0.37	0.65	0.65	0.72	1.21	1.32	1.33	1.28	0.77	1.08	0.98	0.93	0.99
2-hydroxyvaleric acid	ME134203	0.52	0.83	1.46	1.01	0.49	0.83	1.01	0.78	1.01	0.83	1.34	0.98	0.73	0.77	1.09	1.10	0.89
ribose	ME134076	0.78	0.80	1.18	0.82	0.53	0.91	0.85	0.72	0.80	1.15	1.48	1.20	0.79	1.13	0.96	1.28	0.76
tocopherol alpha-	ME134064	0.77	0.87	1.08	0.97	0.63	1.13	1.19	1.22	0.69	0.75	0.97	0.83	0.53	1.03	1.05	1.14	0.88
indole-3-acetate	ME134132	0.64	0.60	0.97	1.07	0.62	0.86	1.14	0.91	0.59	0.71	1.06	1.19	0.63	1.08	1.39	1.04	0.88
phenylethylamine	ME134088	0.67	0.64	0.97	0.85	0.90	0.93	1.25	0.95	0.52	0.79	1.06	1.03	0.81	1.01	1.74	1.14	0.67
3-hydroxybutanoic acid	ME134196	0.91	0.86	0.74	0.88	0.67	0.85	1.08	1.03	1.12	0.85	0.81	0.91	0.71	0.89	1.17	1.14	1.48
acetoacetate	ME134191	0.99	0.80	1.09	1.16	0.99	0.83	1.14	1.27	0.92	0.73	0.78	0.86	0.84	0.62	1.02	1.02	1.15
urea	ME134058	1.00	1.01	0.91	1.16	0.87	0.88	1.06	1.06	0.74	0.95	0.82	1.07	0.79	0.78	1.01	0.87	1.24
epsilon-caprolactam	ME134158	0.65	1.05	1.18	0.88	1.55	0.94	1.01	0.93	0.91	0.84	1.10	0.92	0.89	0.81	1.35	1.13	0.82
caprylic acid	ME134172	0.78	0.93	0.91	1.10	0.97	1.12	1.20	1.02	0.79	1.08	1.09	1.02	0.99	1.00	0.97	0.91	0.83
pelargonic acid	ME134091	0.65	0.97	0.90	1.09	0.97	0.93	1.18	0.97	0.66	1.21	1.03	1.12	0.98	0.94	1.01	1.09	0.73
hexuronic acid	ME134138	0.64	0.78	1.09	1.13	0.80	0.79	1.17	0.72	0.72	0.88	1.16	1.31	0.84	0.85	1.26	0.85	0.89
indole-3-lactate	ME134131	0.68	0.84	1.01	1.00	0.88	0.95	1.23	0.92	0.59	0.93	0.99	1.02	0.82	0.94	1.31	0.90	1.00
mannose	ME134113	0.76	0.89	1.10	1.03	1.16	0.92	1.19	0.91	0.75	0.84	1.11	1.00	1.03	0.87	1.17	0.87	0.98
malic acid	ME134117	1.18	1.14	1.18	1.12	0.74	1.02	0.83	0.90	0.99	1.02	1.15	1.09	0.77	0.80	0.81	0.83	1.11
2-deoxytetronic acid	ME134207	0.72	1.15	1.03	1.11	0.72	0.67	0.99	0.84	0.92	1.20	1.24	1.18	0.85	0.89	1.06	0.85	0.90
isothreonic acid	ME134126	0.75	0.94	1.22	1.17	0.91	0.82	0.80	0.89	0.85	0.98	1.23	1.16	0.88	0.90	0.90	0.92	0.98
2-hydroxybutanoic acid	ME134206	0.89	1.03	0.90	0.89	0.60	0.79	0.99	1.08	1.08	1.17	1.02	1.01	0.78	0.88	1.20	1.22	0.88
1,5-anhydroglucitol	ME134209	0.87	0.91	1.07	0.94	0.83	0.86	1.01	1.13	0.90	0.89	1.09	0.91	0.82	0.77	1.04	1.17	1.01
butane-2,3-diol NIST	ME134175	0.95	1.05	1.19	1.00	0.64	0.83	0.96	0.80	0.89	1.05	1.27	1.00	0.66	0.78	1.00	1.16	0.94
hydroxylamine	ME134134	0.89	0.75	0.84	0.83	1.34	1.00	0.87	0.81	1.05	1.29	1.24	1.15	1.47	1.32	1.06	1.02	0.94
serine	ME134073	0.69	0.80	0.88	0.89	1.22	0.98	0.91	0.84	0.93	1.01	1.28	1.29	1.26	1.19	1.10	0.98	0.87
tryptophan	ME134061	0.87	0.85	0.94	0.75	0.98	0.97	1.06	0.94	1.04	1.07	1.13	1.01	1.14	1.24	1.20	1.14	0.84
cystine	ME134163	0.98	0.93	0.82	0.86	1.25	0.81	1.08	1.13	0.96	1.05	0.99	1.09	1.20	0.92	1.11	1.17	0.86
alanine	ME134188	1.00	1.05	0.86	0.89	1.14	0.90	0.91	1.02	1.16	1.16	1.02	1.07	1.26	1.02	1.04	1.17	0.88
lysine	ME134119	1.16	0.87	0.88	0.82	1.21	0.91	0.93	1.03	1.23	1.14	1.11	1.08	1.27	1.16	1.00	1.16	0.86
tocopherol gamma-	ME134063	1.11	0.90	1.19	0.84	1.24	0.95	1.23	1.14	1.01	0.85	1.16	0.76	1.07	0.88	1.11	1.02	0.82
tyrosine	ME134060	1.29	0.90	0.90	0.97	1.02	1.21	0.98	0.97	1.33	0.98	0.96	1.05	1.00	1.29	0.96	1.00	0.93
glucose	ME134149	1.09	0.97	1.00	0.96	1.08	1.03	1.11	1.06	1.06	0.93	0.99	0.90	0.99	0.95	1.02	1.03	0.99
p-cresol	ME134095	0.98	1.00	0.99	0.97	1.11	1.13	1.08	1.03	0.92	0.98	1.01	0.86	1.03	1.05	1.02	0.99	1.00
isoleucine	ME134127	1.25	0.96	1.08	0.99	0.92	1.11	0.91	0.98	1.23	0.96	1.07	0.98	0.89	1.08	0.91	0.98	1.00
leucine	ME134122	1.20	1.00	1.08	1.03	0.99	1.04	0.94	1.01	1.10	0.89	1.05	1.00	0.89	1.00	0.89	0.98	1.02
methionine	ME134111	1.03	1.05	0.91	0.98	0.98	0.95	0.94	1.03	1.19	1.08	0.94	1.05	0.94	0.99	1.02	1.06	0.98
valine	ME134055	1.15	0.92	0.98	0.95	1.06	1.01	0.98	1.01	1.17	0.94	1.02	1.00	1.05	1.05	1.02	1.07	0.96
phenylalanine	ME134089	0.97	0.91	0.88	0.96	0.81	1.08	0.85	0.88	1.10	1.06	1.21	1.26	0.87	1.20	0.96	1.01	0.90
myo-inositol	ME134109	0.69	0.99	1.03	1.09	0.84	1.06	0.94	0.91	0.74	0.99	1.07	1.07	0.87	1.08	1.01	0.97	0.97
dodecanol	ME134159	0.89	1.09	0.93	0.97	0.90	1.14	1.01	1.00	1.14	0.97	1.03	1.02	0.99	1.04	0.90	0.90	1.11
propane-1,3-diol NIST	ME134082	0.85	0.97	1.10	1.06	0.97	0.98	0.90	0.94	0.96	1.06	1.14	1.03	0.94	1.03	0.98	0.96	0.93
threitol	ME134067	0.94	1.12	1.04	1.03	1.02	1.14	0.86	0.89	0.99	1.15	1.06	1.08	0.96	1.15	0.90	0.91	0.95
hydroxycarbamate NIST	ME134135	1.03	1.14	1.03	0.99	1.40	1.12	1.05	0.96	0.86	1.04	1.03	0.89	1.25	0.83	0.99	0.89	1.04
uridine	ME134056	1.13	1.29	1.01	1.00	1.16	1.19	1.10	0.97	0.87	0.95	0.94	0.94	1.16	0.72	0.89	0.94	1.08
3-aminoisobutyric acid	ME134197	0.83	1.25	0.99	0.96	1.24	1.03	0.86	1.02	0.99	1.06	1.00	1.01	1.25	0.97	0.94	1.06	0.95
capric acid	ME134173	0.95	1.25	0.94	1.08	1.09	0.81	1.04	1.05	0.97	1.09	0.90	0.99	1.10	0.83	0.98	0.99	1.00
2,3-dihydroxybutanoic acid NIST	ME134200	1.16	0.95	1.11	1.03	1.01	1.03	0.92	1.04	0.72	0.93	1.01	0.82	1.05	0.98	1.01	1.05	1.07
lyxitol	ME134118	0.98	0.96	1.14	1.07	1.18	0.93	0.96	0.93	0.94	0.97	1.12	1.05	1.15	0.91	1.01	0.93	0.92
pseudo uridine	ME134081	0.86	1.05	1.22	1.17	1.29	1.00	1.01	0.92	0.77	0.84	1.09	0.94	1.07	0.92	0.85	0.79	1.11
cysteine-glycine	ME134164	0.87	0.97	1.30	0.93	1.14	0.89	0.79	0.94	1.06	0.87	1.07	0.86	1.45	1.01	0.98	1.18	1.03
lauric acid	ME134123	0.62	1.26	1.04	0.98	1.11	0.84	1.02	0.98	0.65	1.24	1.01	0.94	1.18	0.75	0.99	1.05	1.01
myristic acid	ME134108	0.54	1.18	0.93	0.89	1.11	0.87	1.11	1.03	0.51	1.29	0.85	0.86	1.27	0.84	1.22	1.03	1.07
fucose	ME134155	0.69	1.08	1.04	0.92	1.47	0.95	1.09	0.93	0.88	1.12	1.09	0.93	1.55	0.92	1.08	0.93	0.94
palmitic acid	ME134094	0.64	1.09	1.07	0.95	1.09	0.96	1.13	1.00	0.67	1.06	1.03	0.88	1.21	0.94	1.02	0.97	1.02
heptadecanoic acid	ME134140	0.72	1.01	1.06	0.96	1.08	0.90	1.07	1.01	0.84	1.01	1.04	0.90	1.33	0.97	1.03	1.02	1.00
stearic acid	ME134071	0.78	1.05	1.14	0.96	1.12	0.93	1.16	0.98	0.88	0.97	1.02	0.82	1.38	0.94	0.97	0.95	1.09
uric acid	ME134057	0.52	0.86	0.78	0.97	1.41	1.13	1.16	1.05	0.62	0.91	0.85	0.96	1.36	1.02	1.16	1.05	1.04
N-methylalanine	ME134104	0.74	0.98	0.78	0.93	1.12	0.88	1.13	1.22	0.74	0.98	0.76	0.94	1.10	0.90	1.15	1.27	0.96
octadecanol	ME134100	0.95	0.79	0.89	0.81	1.18	0.97	0.97	1.16	0.76	0.88	0.98	0.89	1.12	0.99	0.91	1.29	1.20
threonine	ME134065	0.86	0.92	0.95	0.93	1.33	1.16	0.94	1.09	0.84	0.91	0.97	0.93	1.27	1.15	0.96	1.09	1.01
citric acid	ME134169	0.93	1.33	1.18	1.18	1.38	1.36	1.19	1.24	0.53	0.79	0.70	0.71	0.81	0.80	0.71	0.74	1.19
isocitric acid	ME134128	1.12	1.50	1.31	1.30	1.15	1.34	1.23	1.27	0.62	0.78	0.66	0.63	0.59	0.70	0.60	0.65	1.20
2-ketoisocaproic acid	ME134201	1.18	1.08	1.24	0.98	1.03	1.07	1.28	1.24	1.22	0.87	0.81	0.63	0.65	0.67	0.88	0.88	1.19
glycolic acid	ME134141	1.06	1.12	1.24	1.14	1.10	1.32	1.09	1.11	0.62	0.75	0.87	0.75	0.44	0.91	0.82	0.83	1.18
cholesterol	ME134170	1.14	1.03	1.13	1.02	1.21	1.22	1.20	1.06	1.00	0.81	0.82	0.72	0.87	0.88	0.95	0.93	1.17
aconitic acid	ME134190	1.12	1.14	1.15	1.01	1.03	1.21	1.07	1.13	0.87	0.83	0.90	0.85	0.66	0.98	0.87	0.93	1.05
xylose	ME134053	1.21	1.27	1.00	1.17	1.00	1.20	1.14	0.99	0.90	0.94	0.86	0.80	0.65	0.99	0.91	0.75	1.18
aminomalonate	ME134185	0.69	1.26	1.03	1.04	1.48	1.43	1.20	0.95	0.61	0.91	0.91	0.79	1.09	0.79	0.97	0.80	1.15
N-acetylglycine NIST	ME134106	0.53	1.23	0.95	1.04	1.19	1.30	1.21	1.01	0.67	0.83	0.90	0.78	0.92	1.20	0.98	0.81	1.14
benzoic acid	ME134177	0.84	0.95	0.93	1.00	0.97	1.29	1.09	1.04	0.74	0.97	0.89	0.89	0.93	1.18	0.93	0.95	1.11
glycine	ME134142	0.73	1.18	0.91	0.99	1.05	1.59	1.03	0.92	0.68	0.99	0.87	0.92	0.95	1.46	0.97	0.81	1.04
glycerol-3-galactoside	ME134144	1.01	1.39	0.70	0.94	0.78	1.37	1.11	1.07	0.93	1.05	0.75	0.93	0.73	1.31	1.01	1.04	0.93
2-deoxyerythritol	ME134208	0.93	1.20	0.88	1.20	0.44	1.45	1.04	0.81	0.85	1.01	0.77	1.04	0.65	1.26	0.93	0.77	1.16
glyceric acid	ME134146	0.73	0.90	0.82	1.24	0.64	1.29	0.84	0.92	0.78	0.83	0.97	1.16	0.75	1.06	1.00	0.97	1.11
palmitoleic acid	ME134093	0.21	1.51	1.13	0.82	1.12	0.79	1.20	0.78	0.25	1.54	1.16	0.85	1.09	0.89	1.18	0.78	1.03
linoleic acid	ME134120	0.18	1.31	0.94	0.92	1.17	0.96	1.12	0.98	0.17	1.32	0.94	0.92	1.18	1.09	1.12	0.94	0.96
oleic acid	ME134099	0.12	1.31	1.00	0.99	1.04	0.85	1.09	1.00	0.14	1.28	1.01	1.00	1.02	0.95	1.05	0.95	0.96
glycerol	ME134145	0.88	1.90	0.99	0.90	1.49	1.09	1.04	1.11	0.60	1.54	0.78	0.71	1.15	0.93	0.74	0.90	1.05
maltotriose	ME134115	0.72	1.78	1.02	1.37	1.39	0.99	0.92	0.85	0.78	0.90	1.43	0.83	0.74	0.98	0.73	0.68	0.92
2-hydroxyglutaric acid	ME134205	0.64	0.52	0.83	1.84	0.39	6.33	0.55	0.45	0.47	0.64	0.63	0.51	0.59	0.94	0.71	0.54	0.87
naproxen	ME134103	0.03	0.04	0.03	0.29	0.04	5.44	1.50	0.77	0.03	0.04	0.04	0.25	0.03	5.64	1.43	0.90	0.73

Factors:

F1	Organ:Plasma \| Disease State:cancer \| Gender:F \| Smoking Status:Current
F2	Organ:Plasma \| Disease State:cancer \| Gender:F \| Smoking Status:Former
F3	Organ:Plasma \| Disease State:cancer \| Gender:M \| Smoking Status:Current
F4	Organ:Plasma \| Disease State:cancer \| Gender:M \| Smoking Status:Former
F5	Organ:Plasma \| Disease State:control \| Gender:F \| Smoking Status:Current
F6	Organ:Plasma \| Disease State:control \| Gender:F \| Smoking Status:Former
F7	Organ:Plasma \| Disease State:control \| Gender:M \| Smoking Status:Current
F8	Organ:Plasma \| Disease State:control \| Gender:M \| Smoking Status:Former
F9	Organ:Serum \| Disease State:cancer \| Gender:F \| Smoking Status:Current
F10	Organ:Serum \| Disease State:cancer \| Gender:F \| Smoking Status:Former
F11	Organ:Serum \| Disease State:cancer \| Gender:M \| Smoking Status:Current
F12	Organ:Serum \| Disease State:cancer \| Gender:M \| Smoking Status:Former
F13	Organ:Serum \| Disease State:control \| Gender:F \| Smoking Status:Current
F14	Organ:Serum \| Disease State:control \| Gender:F \| Smoking Status:Former
F15	Organ:Serum \| Disease State:control \| Gender:M \| Smoking Status:Current
F16	Organ:Serum \| Disease State:control \| Gender:M \| Smoking Status:Former
F17	Organ:Serum or Plasma \| Disease State:- \| Gender:- \| Smoking Status:-

Data matrix