Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Sprague Dawley rats Nicotine alters brain oxidative metabolism (Study ST000235)

ESI positive ion mode (Analysis AN000353)

Metabolite	Structure	F1	F2	F3	F4
NICOTINATE	ME699214	0.25	1.65	0.19	2.04
3-METHYLHISTAMINE	ME699268	0.31	1.60	1.74	0.26
5-AMINOLEVULINIC ACID	ME699263	1.69	0.68	0.79	0.82
CYTIDINE	ME699249	1.38	0.57	0.61	1.50
DEOXYCYTIDINE	ME699246	1.29	0.67	0.64	1.46
SUCCINATE	ME699201	0.87	1.56	0.80	0.73
CARNOSINE	ME699255	0.76	1.36	1.12	0.72
L-CYSTATHIONINE	ME699232	0.80	1.46	1.19	0.49
1,3-DIAMINOPROPANE	ME699272	0.80	1.18	1.14	0.87
L-ANSERINE	ME699237	0.88	1.16	1.04	0.91
SPERMIDINE	ME699202	0.87	1.16	1.08	0.87
CYTIDINE 5^-DIPHOSPHOCHOLINE	ME699248	0.74	1.13	1.16	0.97
Creatinine	ME699250	0.78	1.07	1.19	0.95
NALPHA-ACETYL-L-LYSINE	ME699217	0.78	1.02	1.22	0.97
CITRULLINE	ME699254	0.85	0.98	1.33	0.81
L-ORNITHINE	ME699227	0.89	1.00	1.22	0.87
LEUCINE	ME699231	0.88	1.05	1.17	0.89
L-HISTIDINE	ME699230	0.88	1.07	1.17	0.87
L-METHIONINE	ME699228	0.87	1.03	1.17	0.92
Proline	ME699206	0.90	1.02	1.17	0.90
Tryptophan	ME699198	0.79	1.08	1.30	0.80
Tryptophan-NH3	ME699195	0.80	1.08	1.31	0.79
L-ARGININE	ME699236	0.82	1.10	1.22	0.82
L-ASPARTATE	ME699234	0.83	1.12	1.19	0.84
Phenylalanine	ME699210	0.81	1.08	1.24	0.85
Phenylalanine-HCOOH	ME699209	0.81	1.08	1.27	0.83
L-LYSINE	ME699229	0.79	1.05	1.26	0.88
Tyrosine	ME699194	0.83	1.04	1.24	0.87
DEOXYCARNITINE	ME699247	0.90	0.95	0.94	1.23
5-OXO-L-PROLINE	ME699261	0.98	0.88	1.01	1.15
PYRIDOXAL	ME699204	0.93	0.99	0.98	1.11
THIAMINE MONOPHOSPHATE	ME699199	0.93	0.99	0.99	1.11
PYRIDOXAL 5^-PHOSPHATE	ME699203	1.07	1.06	1.01	0.84
5-AMINOPENTANOATE	ME699262	0.94	0.99	1.10	0.96
L-SERINE	ME699226	0.94	0.96	1.16	0.94
GLYCINE	ME699240	0.95	0.97	1.07	1.01
PIPECOLATE	ME699207	0.91	0.97	1.08	1.03
NICOTINAMIDE	ME699215	0.93	1.04	1.04	0.98
OROTIC ACID	ME699211	0.92	1.05	1.02	1.01
(R)-MALATE	ME699273	0.93	1.01	1.05	1.01
HYPOXANTHINE	ME699239	0.96	1.01	1.03	1.00
URACIL	ME699193	0.96	1.02	1.04	0.98
4-GUANIDINOBUTANOATE	ME699265	0.94	1.06	1.08	0.90
CMP	ME699253	0.88	1.07	1.04	1.00
L-CARNITINE	ME699233	0.87	1.07	1.06	1.00
L-ALLOTHREONINE	ME699238	0.84	1.08	1.11	0.96
5,6-DIHYDROURACIL	ME699264	0.89	1.07	1.10	0.93
L-THREONINE	ME699225	0.88	1.05	1.10	0.97
4-AMINOBUTANOATE	ME699266	0.91	1.05	1.08	0.96
N-ACETYL-DL-GLUTAMIC ACID	ME699221	0.92	1.03	1.08	0.96
NEPSILON,NEPSILON,NEPSILON-TRIMETHYLLYSINE	ME699216	1.12	0.98	0.96	0.93
1-AMINOCYCLOPROPANE-1-CARBOXYLATE	ME699271	1.07	0.92	1.02	0.99
D-GLUCOSE 6-PHOSPHATE	ME699245	1.12	0.90	1.02	0.95
BETA-ALANINE	ME699257	1.02	0.93	0.98	1.07
Creatine	ME699252	1.01	0.97	0.97	1.05
ETHANOLAMINE PHOSPHATE	ME699243	1.00	0.97	0.97	1.07
GLYCEROL	ME699241	1.03	0.96	0.98	1.03
N-ACETYLNEURAMINATE	ME699218	1.04	0.95	0.97	1.05
PUTRESCINE	ME699205	1.01	1.05	0.93	1.01
Creatine-D3	ME699251	1.02	1.04	1.02	0.91
Tryptophan-2,3,3-D3	ME699197	1.04	1.02	0.98	0.95
Tryptophan-2,3,3-D3-NH3	ME699196	1.03	1.02	1.00	0.93
2-HYDROXYPHENYLACETIC ACID	ME699270	1.04	0.98	0.99	0.99
Caffeine-D3	ME699256	1.03	1.01	0.98	0.98
L-ASPARAGINE	ME699235	1.00	0.97	1.05	0.97
N(PAI)-METHYL-L-HISTIDINE	ME699223	1.00	1.00	1.00	1.00
Glutamine	ME699242	0.99	0.99	1.03	1.00
MANNOSE	ME699224	1.00	0.99	1.02	0.99
URATE	ME699192	0.92	1.02	0.80	1.30
ALPHA-AMINOADIPATE	ME699258	1.13	0.79	0.80	1.33
ADENINE	ME699260	1.19	0.75	0.78	1.32
TAURINE	ME699200	1.23	0.75	0.77	1.29
N-ACETYL-D-GALACTOSAMINE	ME699222	1.10	1.01	0.85	1.05
O-ACETYL-L-SERINE	ME699213	1.20	0.81	0.85	1.16
3-HYDROXY-3-METHYLGLUTARATE	ME699269	1.09	0.85	0.95	1.13
ADENOSINE 5^-MONOPHOSPHATE	ME699259	1.10	0.91	0.87	1.13
O-PHOSPHO-DL-SERINE	ME699212	1.12	0.91	0.84	1.15
N-ACETYL-L-ASPARTIC ACID	ME699219	1.07	0.90	0.87	1.17
PHOSPHOCHOLINE	ME699208	1.09	0.88	0.90	1.15
3-UREIDOPROPIONATE	ME699267	1.18	0.92	1.63	0.16
D-RIBOSE 5-PHOSPHATE	ME699244	0.69	1.02	1.64	0.60
N-ACETYL-L-ALANINE	ME699220	0.93	0.71	1.60	0.72

Factors:

F1	Treatment:Nicotine \| Dosage:6mg/kg
F2	Treatment:Nicotine + Oral contraceptives \| Dosage:6mg/kg Nicotine
F3	Treatment:Oral contraceptives \| Dosage:1 mL
F4	Treatment:Saline \| Dosage:2 mL

Data matrix