Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Determine metabolomics signatures important for the ability of Streptococus gallolyticus to promote colon cancer cell proliferation (Study ST000956)

Reversed phase POSITIVE ION MODE (Analysis AN001568)

Metabolite	Structure	F1	F2	F3	F4
D-(+)-RAFFINOSE	ME236865	0.46	3.44	0.27	0.14
CYTIDINE	ME236861	0.19	3.38	0.17	0.27
Isocytosine	ME236885	0.21	3.32	0.19	0.29
ETHANOLAMINE PHOSPHATE;2-AMINOETHYL DIHYDROGEN PHOSPHATE	ME236871	1.65	0.05	0.49	1.81
HEXOSE-DISACCHARIDE;Lactose+Na	ME236880	1.72	1.58	0.37	0.34
ALPHA-AMINOADIPATE/N-METHYL-L-GLUTAMATE;L-2-Aminoadipic Acid	ME236840	0.60	2.51	0.41	0.49
5^-DEOXYADENOSINE	ME236829	0.64	2.24	0.59	0.54
ISOCITRIC ACID_R2	ME236884	0.47	2.24	0.79	0.49
S-CARBOXYMETHYL-L-CYSTEINE	ME236948	0.60	1.47	1.35	0.58
5-AMINOLEVULINIC ACID;4-HYDROXYPROLINE;trans-4-Hydroxy-L_Proline	ME236828	0.75	1.77	1.01	0.47
Allopurinol	ME236839	0.64	1.98	0.97	0.42
PUTRESCINE	ME236940	0.60	1.96	0.84	0.60
4-AMINOBUTANOATE (GABA);2-AMINO-2-METHYLPROPANOATE;3-AMINOISOBUTANOATE	ME236826	0.62	1.82	0.77	0.79
6C-SUGAR ALCOHOL_R1	ME236835	0.66	1.83	0.68	0.83
Isovalerylcarnitine;Valerylcarnitine	ME236886	0.59	1.82	0.88	0.71
(R)-MALATE	ME236821	0.55	1.77	0.86	0.82
L-PROLINE	ME236905	0.66	1.61	0.91	0.83
BUTYROBETAINE	ME236846	0.64	1.69	0.82	0.85
PHOSPHOCHOLINE	ME236938	0.71	1.64	0.78	0.87
Glycyl-L-leucine_R1	ME236878	0.73	1.75	0.76	0.76
URIDINE	ME236959	0.74	1.71	0.87	0.68
5-HYDROXYINDOLEACETATE	ME236830	0.70	1.73	0.88	0.69
N-ACETYL-L-ALANINE;3-AMINO-5-HYDROXYBENZOIC ACID	ME236916	0.71	1.71	0.86	0.72
3^-CMP	ME236824	0.76	1.71	0.94	0.59
GLUCOSE/FRUCTOSE-PHOSPHATE	ME236874	0.78	1.62	0.92	0.68
N-ALPHA-ACETYL-L-LYSINE	ME236921	0.76	1.59	0.94	0.71
LysoPC (16:1)	ME236909	0.63	1.82	0.59	0.97
Phe-Phe	ME236937	0.66	2.04	0.63	0.66
CYS-GLY	ME236860	0.70	1.88	0.71	0.72
L-CYSTATHIONINE	ME236889	0.68	1.97	0.64	0.71
SEROTONIN-NH3	ME236949	0.67	1.94	0.66	0.73
DIETHANOLAMINE	ME236866	1.13	0.79	0.55	1.52
L-GLUTAMINE	ME236894	0.74	1.21	1.00	1.05
Citrate source fragment (+NH3)_R1	ME236851	0.76	1.19	0.91	1.15
Citrate+Na;CITRATE	ME236853	0.74	1.19	0.90	1.16
Citrate+NH3	ME236854	0.75	1.19	0.90	1.16
Citrate source fragment (+H and + NH3)	ME236850	0.74	1.19	0.91	1.15
Citrate source fragment (+NH3)_R2	ME236852	0.74	1.19	0.92	1.15
ASPARTATE	ME236842	0.90	1.13	0.98	0.98
L-HISTIDINE	ME236895	0.87	1.10	0.99	1.05
Leu Pro_R2	ME236893	0.84	1.12	1.07	0.97
L-Isoleucine	ME236896	0.86	1.10	1.02	1.02
GLYCINE	ME236877	0.85	1.11	1.04	1.00
THREONINE/HOMOSERINE	ME236954	0.85	1.12	1.04	0.99
L-SERINE	ME236906	0.86	1.20	0.99	0.95
Phenylalanine	ME236936	0.85	1.20	0.99	0.96
2-Hydroxyphenylalanine;L-TYROSINE	ME236823	0.84	1.24	0.96	0.96
D-SACCHARIC ACID	ME236870	0.83	1.24	0.99	0.95
ISOCITRIC ACID_R1	ME236883	0.82	1.21	0.90	1.07
ALDO/KETO-HEXOSE	ME236838	0.83	1.18	0.98	1.01
5-OXO-L-PROLINE;Pyroglutamic Acid	ME236834	0.86	1.14	0.94	1.05
Cyclic-ADP Ribose	ME236859	0.86	1.16	0.94	1.03
L-Cystine	ME236891	0.99	1.22	0.93	0.86
5-HYDROXY-L-TRYPTOPHAN	ME236831	0.99	1.15	1.02	0.84
5-Hydroxymethyl-2-furaldehyde	ME236832	0.90	1.18	1.04	0.87
Methionine Sulfoxide	ME236910	1.01	0.78	1.13	1.08
Creatine-D3	ME236858	0.92	0.87	1.17	1.04
N-ACETYLNEURAMINATE	ME236919	0.91	0.77	1.25	1.07
L-LYSINE_R2	ME236902	0.85	0.97	0.92	1.25
Pantothenic Acid	ME236934	0.94	0.85	1.08	1.13
CYTOSINE_R2	ME236864	0.96	0.83	1.02	1.18
ORNITHINE	ME236932	1.01	0.86	0.97	1.16
N-ACETYL-DL-GLUTAMIC ACID	ME236914	0.91	0.92	0.98	1.19
PYRIDOXINE	ME236943	0.87	0.91	1.04	1.18
Anthranilate	ME236841	0.98	0.93	0.95	1.13
CYTIDINE 5^-DIPHOSPHOCHOLINE	ME236862	0.92	1.01	0.95	1.12
CYTOSINE_R1	ME236863	0.93	0.96	0.97	1.13
NICOTINAMIDE;NIACINAMIDE	ME236930	0.94	1.04	1.12	0.90
Orthophosphate	ME236933	0.98	0.99	1.07	0.97
Tryptophan	ME236956	0.92	1.02	1.09	0.97
Formylkynurenine	ME236873	1.09	0.97	0.95	0.99
Formyl-5-hydroxykynurenamine	ME236872	1.11	0.97	1.01	0.92
5-Hydroxy-N-formylkynurenine	ME236833	1.09	0.95	1.01	0.96
TRANS-CINNAMATE	ME236955	1.06	0.97	1.00	0.97
SPERMIDINE	ME236951	1.02	0.92	1.02	1.03
N-BOC-L-Aspartic Acid_R2	ME236923	1.03	0.97	1.00	1.01
Caffeine-D3	ME236848	1.03	0.96	0.98	1.03
Hippuric Acid	ME236881	1.05	0.95	0.98	1.02
BOC-L-Tyrosine_R2	ME236845	1.01	1.00	1.01	0.98
N-BOC-L-Aspartic Acid_R1	ME236922	1.01	0.97	1.02	1.00
Tryptophan-2,3,3-D3	ME236957	1.00	0.98	1.02	1.00
N-Butylbenzenesulfonamide	ME236927	1.03	0.97	1.02	0.98
BOC-L-Tyrosine_R1	ME236844	1.02	0.98	1.01	0.98
L-Leucine 13C6	ME236899	1.01	0.98	1.01	0.99
N-BOC-L-tert-Leucine	ME236924	1.00	1.03	0.98	1.00
N-BOC-L-Tryptophan_R1	ME236925	0.98	1.00	1.01	1.00
BOC-D-Phenylalanine	ME236843	1.00	0.99	1.00	1.01
L-Phenylalanine 13C6	ME236904	0.99	1.00	1.00	1.01
L-Leucine-D10	ME236900	0.99	1.01	1.00	1.00
L-Tyrosine 13C6	ME236907	1.00	1.01	0.99	1.00
SPERMINE	ME236952	0.96	1.05	1.00	0.98
N-BOC-L-Tryptophan_R2	ME236926	0.97	1.02	1.02	0.99
Source Fragment TRP	ME236950	0.94	1.01	1.03	1.01
3-UREIDOPROPIONATE	ME236825	0.79	1.06	1.14	1.01
N-ACETYL-L-ASPARTIC ACID_R2	ME236918	0.87	1.02	1.08	1.02
Glutathione Disulfide	ME236875	0.89	0.97	1.04	1.10
N-Acetyl-Arginine	ME236913	0.87	1.01	1.05	1.07
4-GUANIDINOBUTANOATE	ME236827	0.87	1.00	1.06	1.07
Glycerophosphocholine	ME236876	0.87	0.99	1.07	1.07
DIHYDROXYACETONE PHOSPHATE	ME236867	0.89	1.33	1.10	0.69
D-Ribose;ALDOPENTOSE	ME236869	0.89	1.20	1.22	0.68
CITRULLINE	ME236855	0.99	1.41	0.89	0.71
Butyrylcarnitine	ME236847	0.72	1.42	0.77	1.10
N(PAI)-METHYL-L-HISTIDINE	ME236912	0.66	1.49	0.88	0.97
Proprionylcarnitine	ME236939	0.73	1.47	0.83	0.96
TAURINE	ME236953	0.74	1.46	0.85	0.95
NEPSILON,NEPSILON,NEPSILON-TRIMETHYLLYSINE	ME236928	0.90	1.35	0.92	0.83
L-LYSINE_R1	ME236901	0.86	1.38	0.94	0.82
PYRIDOXAMINE	ME236942	0.88	1.38	0.95	0.79
L-LEUCINE	ME236898	0.82	1.29	0.98	0.91
QUINATE	ME236944	0.80	1.28	1.01	0.90
L-ASPARAGINE	ME236888	0.81	1.36	0.98	0.85
L-ARGININE	ME236887	0.88	1.28	0.94	0.90
L-CYSTEINE	ME236890	0.84	1.35	0.93	0.88
PYRIDOXAL	ME236941	0.85	1.32	0.94	0.88
ALANINE/SARCOSINE	ME236837	0.75	1.40	0.98	0.88
N-ACETYL-L-ASPARTIC ACID_R1	ME236917	0.75	1.37	0.96	0.93
CREATINE	ME236857	0.77	1.35	0.90	0.99
HYPOTAURINE	ME236882	0.76	1.30	0.95	0.99
N-METHYL-D-ASPARTIC ACID;O-ACETYL-L-SERINE;L-GLUTAMIC ACID;O-Acetyl-L-Serine	ME236931	0.77	1.27	0.95	1.00
N-ACETYL-HEXOSAMINE	ME236915	0.84	1.52	0.80	0.84
Leu Pro_R1	ME236892	0.80	1.42	1.03	0.75
L-METHIONINE	ME236903	0.77	1.45	0.95	0.83
N-ACETYLPUTRESCINE	ME236920	0.79	1.51	0.91	0.79
2-hydroxyglutarate+Na	ME236822	0.82	1.47	0.95	0.75
Glycyl-L-leucine_R2	ME236879	0.82	1.52	0.92	0.74
Ribulose 5-Phosphate	ME236947	1.26	0.66	1.33	0.76
Choline	ME236849	1.13	0.37	1.19	1.31
L-VALINE/5-AMINOPENTANOATE/L-NORVALINE;BETAINE	ME236908	1.12	0.21	1.34	1.32
URACIL;Uracil	ME236958	1.16	0.33	1.51	1.00
NICOTINAMIDE MONONUCLEOTIDE	ME236929	1.19	0.53	1.30	0.98
RIBOFLAVIN_R1	ME236945	1.10	0.43	1.34	1.13
RIBOFLAVIN_R2	ME236946	1.08	0.60	0.97	1.51
METHYL BETA-D-GALACTOSIDE	ME236911	1.25	0.48	1.01	1.26
PEG n5	ME236935	1.22	0.59	1.12	1.06
DL-5-HYDROXYLYSINE	ME236868	1.12	0.57	1.11	1.16
L-KYNURENINE	ME236897	1.09	0.66	1.11	1.15
6C-SUGAR ALCOHOL_R2	ME236836	1.09	0.77	0.98	1.13
CMP	ME236856	0.99	0.70	1.07	1.24

Factors:

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

Data matrix