Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST000956)

Reversed phase NEGATIVE ION MODE (Analysis AN001569)

Metabolite	Structure	F1	F2	F3	F4
UDP	ME237056	0.80	1.25	0.98	0.97
S-(5^-ADENOSYL)-L-HOMOCYSTEINE	ME237044	0.91	1.31	0.91	0.87
SARCOSINE/BETA-ALANINE_R1	ME237046	0.82	1.31	0.86	1.01
GLUCONIC ACID/D-GULONIC ACID GAMA-LACTONE	ME236993	1.06	0.39	1.27	1.27
N-METHYL-L-GLUTAMATE;ALPHA-AMINOADIPATE;L-2-Aminoadipic Acid	ME237041	0.82	1.52	0.81	0.85
L-Phenylalanine-13C6	ME237018	0.99	0.99	1.01	1.01
C12H22O11-DISACCHARIDE-(6C/6C; GLC-GLC/GLC-FRC/GAL-GLC)	ME236974	1.98	1.36	0.33	0.34
CYS-GLY	ME236983	0.77	1.64	0.76	0.84
GLYCEROL 2-PHOSPHATE/SN-GLYCEROL 3-PHOSPHATE	ME236998	1.28	0.31	0.88	1.52
N-ACETYL-HEXOSAMINE	ME237027	0.84	1.23	0.88	1.05
3^-CMP	ME236963	0.82	1.52	0.96	0.69
ISOCITRIC ACID	ME237003	0.75	1.22	0.90	1.12
N-BOC-L-Aspartic Acid_R1	ME237033	0.98	1.02	1.00	1.00
C6H12O6-HEXOSE/KETOSE/INOSITOL	ME236976	0.98	1.00	1.01	1.01
Cyclic ADP-ribose	ME236982	0.89	1.16	0.90	1.04
L-GLUTAMIC ACID;N-METHYL-D-ASPARTIC ACID;O-ACETYL-L-SERINE;O-Acetyl-L-Serine	ME237010	0.84	1.21	0.90	1.05
ADP	ME236968	0.90	0.89	0.96	1.24
MALATE;OXALOACETATE+2H-H	ME237024	0.57	1.78	0.83	0.81
N-BOC-L-Tryptophan_R1	ME237037	0.99	1.02	1.01	0.99
L-KYNURENINE	ME237014	1.14	0.55	1.19	1.07
LACTATE	ME237004	0.86	1.28	0.95	0.91
L-ISOLEUCINE	ME237013	0.83	1.22	0.98	0.97
6-PHOSPHOGLUCONIC ACID	ME236966	0.95	0.99	1.39	0.67
C5-SUGAR ALCOHOL	ME236975	1.06	0.69	1.23	1.02
CARNOSINE	ME236977	0.81	1.66	0.85	0.79
GLYCERIC ACID	ME236997	1.21	0.69	0.91	1.18
Fumaric Acid	ME236992	0.60	1.87	0.81	0.72
GLUCOSE/FRUCTOSE_R2	ME236995	0.69	1.52	0.90	0.89
GLYCOLATE	ME236999	1.14	0.93	0.98	0.94
Mannitol;HEXOSE ALCOHOL	ME237025	1.14	0.61	1.03	1.23
GLUCOSE/FRUCTOSE_R1	ME236994	0.71	1.48	0.92	0.89
2-AMINOETHYL DIHYDROGEN PHOSPHATE;ETHANOLAMINE PHOSPHATE	ME236960	1.68	0.06	0.54	1.71
D-SACCHARIC ACID	ME236991	1.23	1.26	0.77	0.73
N-BOC-L-tert-Leucine_R1	ME237035	0.98	1.03	0.98	1.01
3-Aminosalicylic acid	ME236962	1.07	0.97	1.02	0.93
3-SULFINO-L-ALANINE	ME236964	0.87	1.27	0.81	1.05
2-hydroxyglutarate	ME236961	0.72	1.53	0.92	0.83
Creatine-D3	ME236981	0.94	0.84	1.13	1.09
CITRATE	ME236978	0.73	1.22	0.91	1.14
GLUTATHIONE	ME236996	0.88	1.08	0.99	1.05
BOC-L-Tyrosine_R2	ME236973	0.99	1.01	1.00	1.00
CMP	ME236979	1.02	0.71	1.05	1.23
DIHYDROXYACETONE PHOSPHATE	ME236987	0.81	1.57	1.06	0.56
SARCOSINE/BETA-ALANINE_R2	ME237047	1.03	1.19	0.83	0.95
L-CYSTATHIONINE	ME237007	0.81	1.27	0.94	0.95
N-ACETYL-L-ASPARTIC ACID	ME237029	0.74	1.40	0.95	0.91
PHOSPHOCHOLINE	ME237043	0.71	1.76	0.70	0.82
LL-2,6-DIAMINOHEPTANEDIOATE	ME237015	0.57	2.37	0.56	0.50
L-METHIONINE	ME237017	0.79	1.47	0.92	0.82
L-HISTIDINE	ME237012	0.87	1.13	0.98	1.02
N-ACETYL-L-LEUCINE	ME237030	0.69	1.43	0.68	1.21
CYTIDINE	ME236984	0.23	3.31	0.20	0.26
L-CYSTEINE	ME237008	0.96	1.20	0.89	0.95
Guanosine	ME237000	1.04	1.01	0.81	1.14
N-BOC-L-Aspartic Acid_R2	ME237034	0.99	1.02	1.00	1.00
L-ARGININE	ME237006	0.98	1.27	0.90	0.86
URIDINE	ME237058	0.78	1.60	0.89	0.73
CREATINE	ME236980	0.80	1.31	0.86	1.03
N-ACETYL-L-ALANINE	ME237028	0.67	1.80	0.83	0.70
N-BOC-L-tert-Leucine_R2	ME237036	0.97	1.03	0.99	1.01
N-ACETYLNEURAMINATE	ME237031	0.95	0.77	1.18	1.09
NALPHA-ACETYL-L-LYSINE	ME237032	0.77	1.50	0.98	0.76
ASPARAGINE	ME236970	0.93	1.27	0.96	0.84
N-formyl-L-methionine	ME237039	0.77	1.39	0.91	0.94
MALATE	ME237023	0.64	1.36	1.08	0.92
L-VALINE	ME237022	0.82	1.28	0.98	0.92
ASCORBIC ACID-2H	ME236969	1.53	0.87	0.77	0.83
LACTATE-dimer	ME237005	0.97	1.13	0.94	0.96
L-GLUTAMINE	ME237011	0.75	1.37	0.86	1.02
THREONINE/HOMOSERINE	ME237053	1.06	0.82	0.99	1.12
TAURINE	ME237052	0.76	1.40	0.85	0.99
S-CARBOXYMETHYL-L-CYSTEINE	ME237048	1.07	0.81	1.02	1.10
Uracil	ME237057	1.17	0.33	1.48	1.02
N-BOC-L-Tryptophan_R2	ME237038	0.98	1.02	1.01	0.99
L-SERINE	ME237019	1.07	0.85	1.07	1.01
L-Tyrosine-13C6	ME237021	1.00	0.99	1.00	1.00
ASPARTATE	ME236971	0.85	1.32	0.84	0.99
N-ACETYL-DL-GLUTAMIC ACID	ME237026	0.91	0.90	1.04	1.15
BOC-L-Tyrosine_R1	ME236972	1.00	1.00	1.00	1.00
L-TYROSINE	ME237020	0.85	1.23	0.96	0.96
HOMOCYSTEINE	ME237001	0.93	1.12	1.06	0.89
INDOLE-3-ACETATE	ME237002	1.06	0.24	1.14	1.18
D-GLUCURONIC ACID/D-GLUCURONOLACTONE/D-(+)-GALACTURONIC ACID_R2	ME236986	1.14	1.00	1.07	0.80
LEUCINE	ME237009	0.84	1.27	0.97	0.92
Tryptophan	ME237054	0.91	1.05	1.07	0.97
ADENINE	ME236967	1.22	0.33	1.18	1.27
D-GLUCURONIC ACID/D-GLUCURONOLACTONE/D-(+)-GALACTURONIC ACID_R1	ME236985	0.94	1.18	0.87	1.01
Pantothenic Acid	ME237042	0.90	0.88	1.09	1.12
Salicylic Acid-D4	ME237045	0.98	1.01	1.00	1.02
Sulfoacetaldehyde	ME237051	1.01	0.93	1.05	1.01
Docosahexaenoic Acid (22:6);Docosahexanoic Acid	ME236989	0.48	0.71	0.48	1.98
Succinic-2,2,3,3-D4 Acid	ME237050	1.00	1.01	0.99	1.00
SUCCINATE	ME237049	0.70	1.66	0.84	0.80
4-oxoproline;5-OXO-L-PROLINE	ME236965	0.89	1.16	0.92	1.03
L-LYSINE	ME237016	0.73	1.76	0.81	0.70
Nicotinamide ribotide	ME237040	1.16	0.56	1.23	1.05
DISACCHARIDE (6C/6C)/2-alpha-D-glucosyl-D-glucose	ME236988	0.98	1.76	0.71	0.55
D-RIBOSE 5-PHOSPHATE/RIBULOSE 5-PHOSPHATE	ME236990	1.12	0.82	1.35	0.71
Tryptophan-2,3,3-D3	ME237055	0.99	1.00	1.00	1.01
XANTHINE	ME237059	0.93	1.12	1.07	0.88

Factors:

F1	Treatment:Condition-1
F2	Treatment:Condition-2
F3	Treatment:Condition-3
F4	Treatment:Control

Data matrix