Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002010)

(Analysis AN003276)

Metabolite	Structure	F1	F2	F3
N6-Acetyl-N6-hydroxy-L-lysine	ME463978	1.19	0.94	0.85
pyrithiamine phosphate	ME464102	NA	0.44	1.37
Leucine	ME463709	0.79	1.17	1.19
potassium dihydrogen phosphate	ME463929	0.58	1.05	1.37
Methyl cinnamate	ME464005	0.97	1.02	1.03
2-oxohexa-4,5-cyclopropyl-5-enoate	ME463836	0.69	1.10	1.05
N-Acetylneuraminate	ME463804	0.35	0.12	2.53
ATPA	ME464090	0.65	1.33	1.08
N-Acetyl-L-aspartic acid	ME463763	0.96	0.94	1.10
PS(18:0/18:2)	ME464017	0.80	0.85	1.25
gamma-Glutamylvaline	ME464048	0.28	0.61	2.21
hydrogen acetylphosphonate	ME463953	0.92	0.74	1.33
2,2,4,4,-Tetramethyl-6-(1-oxopropyl)-1,3,5-cyclohexanetrione	ME463960	1.09	0.90	0.94
Alanine	ME463808	0.99	0.58	1.44
indole-3-acetyl-isoleucine	ME463851	1.07	0.45	1.43
4-Hydroxymethylphenylhydrazine	ME464116	1.13	0.94	0.91
erucamide	ME463769	1.12	1.20	0.59
Pyruvic acid	ME463863	0.38	1.72	1.32
Heptadecanoic acid	ME463923	1.15	0.84	0.91
PA(35:6)	ME463870	0.84	NA	1.16
Lys/Lys/Lys/Met/Tyr	ME463969	1.09	0.26	1.37
N2-gamma-Glutamylglutamine	ME463975	1.25	0.12	NA
N-hydroxyisoleucine	ME463793	1.02	0.75	1.23
Allantoin	ME464015	1.65	0.65	0.59
Palmitoleic acid	ME463955	1.00	0.95	1.05
PC(16:0/22:5)	ME463813	0.69	0.98	1.38
5-Pyridoxolactone	ME464115	0.86	1.01	1.18
Linoelaidyl carnitine	ME463889	0.57	1.24	1.19
Citrulline	ME463794	2.01	0.29	0.53
1-Methylhistidine	ME463774	0.86	1.15	1.07
Pipecolic acid	ME463747	1.06	0.68	1.21
Palmitoylcarnitine	ME463768	0.53	1.12	1.36
1,2-dioctanoyl-1-amino-2,3-propanediol	ME463947	0.49	1.14	1.37
benzenamine sulfate	ME463995	0.95	1.07	0.95
hydroxypyridine N-oxide	ME464105	0.59	1.31	1.24
glucose	ME463821	1.13	1.08	0.76
Octaethylene glycol	ME463810	1.64	0.43	0.51
4-({2-[(3-{2-[2-(acetyloxy)propan-2-yl]-7-oxo-2H,3H,7H-furo[3,2-g]chromen-6-yl}-1-hydroxy-3-methylbutan-2-yl)sulfanyl]-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]ethyl}-C-hydroxycarbonimidoyl)-2-aminobutanoic acid	ME464003	NA	0.15	1.85
2-Dodecylbenzenesulfonic acid	ME463857	1.36	0.74	0.84
2-Methylacetophenone	ME463942	0.78	0.67	1.63
FA methyl(14:0)	ME463939	1.11	0.89	0.94
CAPS	ME463806	1.02	1.03	0.95
formylaminopyrimidine	ME463751	1.10	0.99	0.90
Ethiin	ME464076	1.42	0.33	0.90
Phytuberin	ME463854	0.80	1.15	1.17
Oleoylcarnitine	ME463756	0.58	1.32	1.07
octadecenoic acid	ME463841	1.02	0.88	1.09
Octadecyl fumarate	ME463812	1.17	0.85	1.01
Duloxetine	ME464053	1.91	0.45	0.30
Uridine diphosphate glucose	ME463925	1.07	0.92	1.04
3^^-Chloro-3^^-deoxytriphasiol	ME463727	1.35	0.34	1.25
3-nitro-2-pentanol	ME464086	1.01	0.80	1.19
Caprylic acid	ME463934	0.81	1.25	1.06
Secologanate	ME464057	NA	0.29	1.24
Pyrogallol-2-O-glucuronide	ME464084	0.97	1.40	0.81
1,6,8-trimethylallantoate	ME463910	1.33	0.78	0.84
Glycerol 3-phosphate	ME463908	0.68	0.80	1.52
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate	ME463888	0.11	0.21	2.09
Hydroxypyruvic acid	ME464089	0.88	0.61	1.79
Triethanolamine	ME463933	1.15	0.93	0.81
3-(methylsulfanyl)acryloate	ME464016	0.99	0.83	1.18
9^-Carboxy-alpha-chromanol	ME463758	0.62	1.24	1.39
Capric acid	ME463859	0.74	1.19	1.25
GDP-3,6-dideoxy-D-galactose	ME463993	0.90	0.52	1.64
Glucosylsphingosine	ME464062	0.54	1.26	1.21
(R) 2,3-Dihydroxy-3-methylvalerate	ME464065	0.61	1.08	1.38
2-O-Methylcytosine	ME463900	0.45	1.17	1.70
Hippuric acid	ME463775	0.95	1.05	1.01
Picolinamide	ME463725	0.96	1.21	0.85
PC(14:1/22:2)	ME463830	0.52	1.10	1.45
Uracil	ME463948	0.85	1.12	1.06
N-Undecylbenzenesulfonic acid	ME463829	1.28	0.78	0.85
4beta-Hydroxyobovatachromene	ME464072	0.69	0.40	1.91
Cys/Asp/Glu/Pro/Thr	ME464081	NA	0.47	1.53
Dihydrozeatin riboside monophosphate	ME463749	0.41	1.11	1.18
N3-hydroxyethylcytosine	ME463872	1.30	0.76	0.89
metoprine	ME464002	1.04	1.00	0.95
Oxidized glutathione	ME463856	1.05	0.93	1.04
2-Diethylaminoethanol	ME463848	1.01	0.84	1.14
stipitatonate	ME463827	0.75	0.98	1.31
Aspartic acid	ME463790	2.28	0.31	0.19
trans-Hexadec-2-enoyl carnitine	ME463817	0.52	1.15	1.33
2-Aceto-2-hydroxybutanoic acid	ME463703	0.70	1.17	1.34
PG(16:0/18:2)	ME464095	0.81	0.73	1.37
N-Acetyl-D-mannosaminolactone	ME463861	0.23	1.15	1.74
N6-Acetyl-L-lysine	ME463966	0.84	0.88	1.31
2-Methylbutyroylcarnitine	ME463743	0.49	1.37	1.23
Phenylacetylglycine	ME463764	0.88	1.04	1.10
sulfonic acid	ME464046	1.65	0.27	0.42
Succinic acid	ME463845	0.76	1.10	1.26
1,2-dioctanoyl-1,2,6-hexanetriol	ME463734	1.05	1.03	0.91
12-epi-hapalindole F (isothiocyanate)	ME464045	1.56	0.74	0.48
Cytosine	ME464018	1.94	0.29	0.49
PS(22:5/22:5)	ME463843	0.96	0.62	1.34
Stearic acid	ME463730	0.95	1.02	1.06
Cys/Lys/Lys/Gln/Arg	ME464093	1.32	0.44	1.07
3-Aminobenzenesulfonate	ME463906	0.84	1.17	0.91
Dihydrothymine	ME463773	1.07	0.74	1.18
2-Heptenal	ME464070	1.41	NA	0.18
Glu/Ile/Pro/Pro/Tyr	ME464025	1.30	0.95	0.70
1-Isothiocyanato-7-(methylsulfinyl)heptane	ME463954	1.23	0.83	0.90
3,4-Dimethyl-5-pentyl-2-furanundecanoic acid	ME463892	1.07	0.88	1.06
Cys/Met/Met/Met/Trp	ME463909	1.27	0.72	0.73
Slaframine	ME463894	0.74	1.26	1.18
Cystathionine	ME463990	0.86	1.58	0.70
Muramic acid	ME463860	0.19	0.16	3.73
Glutamic acid	ME464125	0.63	1.45	0.99
aureothricin	ME464121	0.78	0.83	1.22
Glutathione	ME463871	0.89	1.33	0.86
2-Aminoheptanoate	ME463753	0.52	1.37	1.43
4-Guanidinobutanoic acid	ME463823	0.80	0.83	1.41
Neryl formate	ME463937	0.99	0.86	1.15
Indoleacetaldehyde	ME463844	0.63	0.96	1.23
PI(18:1/20:4)	ME464049	0.97	0.73	1.28
N-(2-hydroxypentadecanoyl)-phytosphingosine	ME464043	1.53	0.85	0.53
3-hydroxypyridine	ME464060	0.81	1.14	1.18
Dodecanoic acid	ME463840	0.90	1.07	1.09
Glutamine	ME463715	2.10	0.37	0.35
2-Hydroxycaproic acid	ME463855	0.63	1.20	1.30
Propionylcarnitine	ME463713	0.79	1.00	1.25
6,11-dihydroxy-3-(hydroxymethyl)-7-(3,4,5-trihydroxyphenyl)-2,8-dioxatricyclo[7.3.1.0,]trideca-1,3,5(13),6,9,11-hexaen-2-ylium	ME463826	0.92	0.81	1.28
N2,N2-Dimethylguanosine	ME464022	0.67	1.08	1.30
Glyceryl lactopalmitate	ME464119	0.45	0.91	1.64
PC(16:0/22:6)	ME463849	0.71	0.93	1.40
FA methyl(8:0)	ME463807	0.92	0.97	1.16
Tetracosahexaenoic acid	ME463907	1.53	0.19	0.75
Indolelactic acid	ME463796	1.04	0.85	1.11
N1,N8-Diacetylspermidine	ME463868	0.47	1.01	1.52
PGP(a-13:0/i-22:0)	ME464101	0.46	1.06	1.50
Piperidine	ME463770	0.86	1.05	1.13
2-Hydroxy-4-(methylthio)butanoic acid	ME463771	1.54	0.81	0.83
3,5-dibromocatechol	ME463952	NA	2.36	0.32
Ala/Met/Pro/Tyr	ME463932	1.00	0.93	1.06
3-Hydroxy-N6,N6,N6-trimethyl-L-lysine	ME463980	0.92	0.98	1.06
N6,N6,N6-Trimethyl-L-lysine	ME463780	0.90	0.96	1.16
Tiglylcarnitine	ME463918	0.57	0.90	1.60
Tridecanoic acid	ME464014	0.92	1.07	1.06
Glutarylcarnitine	ME463919	0.56	1.12	1.48
aminocaproamide	ME463755	1.62	0.14	0.12
LysoPC(18:1)	ME463834	1.79	0.44	0.64
sn-glycero-3-Phosphoethanolamine	ME464036	1.10	0.84	1.11
Malic acid	ME463744	0.54	1.32	1.22
N-(2-hydroxytridecanoyl)-4,8-sphingadienine	ME464039	0.50	0.85	1.65
Carnitine	ME463721	0.61	1.09	1.43
Ile/Lys/Pro	ME464023	0.68	1.01	1.26
N-Acetylvanilalanine	ME463972	0.99	1.00	1.01
Adenine	ME463961	0.50	1.14	1.53
Oxoglutaric acid	ME463798	0.35	0.90	1.75
2-{4-[-1,2-diphenylbut-1-en-1-yl]phenoxy}acetic acid	ME464067	1.31	0.87	0.72
Arg-OEt	ME463784	0.75	1.07	1.22
1-Pyrroline-5-carboxylic acid	ME463935	0.28	0.74	2.19
Butyrylcarnitine	ME463719	0.43	1.71	1.24
Phenylalanine	ME463707	0.90	1.12	1.00
PC(18:1/18:1)	ME463776	0.49	0.90	1.69
trans-Dodec-2-enoic acid	ME463971	0.87	1.04	1.02
Threonine	ME463746	1.87	0.35	0.64
3-Ethylmalate	ME463915	1.09	0.92	0.98
4-Hydroxybutyric acid	ME463994	0.69	1.27	1.15
2-Hydroxyglutaric acid	ME463883	0.63	0.76	1.61
Asp/Arg/Arg/Thr/Tyr	ME464047	1.70	0.31	0.28
N-Acetyl-D-glucosaminate	ME464068	0.85	NA	1.15
eicoseneoylcarnitine	ME463842	0.53	1.16	1.31
N-Nitrosoproline	ME464077	1.23	0.39	1.58
glutamyl-L-alaninol	ME463982	1.48	0.62	0.71
N2-Fructopyranosylarginine	ME463736	1.02	0.23	1.90
Dimethylglycine	ME463878	1.02	0.90	1.06
Methionine	ME463722	1.06	0.88	1.05
CHAPS	ME463945	0.90	1.10	1.01
PE(15:0/20:2)	ME463828	0.89	0.99	1.07
N-phosphocreatinate(2-)	ME464069	0.89	0.81	1.25
N,N-dihydroxyhomomethionine	ME463922	1.37	0.27	0.63
Pyridoxal	ME463874	0.75	1.31	0.94
Ala/Glu/Glu/His/Arg	ME464097	0.40	1.13	1.47
2-(Hydroxymethyl)-3-(acetamidomethylene)succinate	ME464019	0.83	1.03	1.05
Acetylcarnitine	ME463723	0.53	1.07	1.48
Uridine diphosphate-N-acetylglucosamine	ME464044	0.73	1.50	0.72
Ala/Phe/Lys/Arg/Arg	ME463921	1.10	0.97	0.96
Isoleucylproline	ME463899	0.95	0.98	1.08
Palmitic acid	ME463728	0.98	1.00	1.04
Theanine	ME463853	1.14	0.73	1.10
Glycerophosphocholine	ME463706	0.57	0.94	1.78
10-hydroxy-undecanoic acid	ME463704	0.55	0.68	2.07
3-Indoleglycolaldehyde	ME463795	1.63	0.68	0.58
Ala/Asn/Ser	ME464075	1.09	0.90	1.01
Imidazoleacetic acid	ME463992	0.67	1.10	1.28
Indolepyruvate	ME463991	1.11	1.20	0.77
3b,12a-Dihydroxy-5a-cholanoic acid	ME463799	2.06	0.18	0.38
N-acetyl-L-2-aminoadipate(2-)	ME463902	0.89	0.90	1.23
Fructosamine	ME463865	1.49	0.79	0.64
Trifluoroacetic acid	ME463998	0.89	1.14	1.02
Serine	ME463803	1.55	0.17	1.08
Chloropyramine	ME463920	0.86	1.11	0.96
NAD	ME463831	1.12	1.00	0.94
PE(16:0/16:0(9Cp))	ME463862	0.88	0.99	1.08
FMPP	ME464104	0.86	1.27	0.96
Ornithine	ME463791	1.35	0.83	0.76
alpha-Irone	ME463963	1.59	0.56	0.46
PS(16:0/18:0)	ME464064	0.85	0.73	1.35
Pseudouridine	ME464009	1.10	0.86	1.02
Carnosine	ME464042	1.65	0.61	0.63
Arginine	ME463733	1.01	0.99	0.99
DL-2-Aminooctanoic acid	ME463800	0.60	1.18	1.29
3,4-dichloro-tridecanoic acid	ME463951	0.41	0.25	3.18
Arg/Thr/Pro/Pro	ME464074	NA	0.37	1.21
PI(16:0/20:2)	ME463997	0.75	0.72	1.40
1-carboxymethylpyridinium	ME464098	1.44	0.20	0.09
5^-Methylthioadenosine	ME463745	0.64	1.09	1.09
ascr#24	ME463928	1.16	0.89	0.92
2-Methyl-4-amino-5-hydroxymethylpyrimidine diphosphate	ME464051	0.96	0.86	1.17
biolumazine	ME464028	0.67	1.34	0.99
N-Acetylglutamic acid	ME463880	1.69	0.59	1.06
Voglibose	ME464118	1.28	0.16	NA
Galactose	ME463876	1.08	1.12	0.79
Glu/Ser/Val	ME464050	0.30	0.35	1.68
7-(4-Hydroxy-3-methoxyphenyl)-5-methoxy-1-phenyl-3-heptanone	ME463976	1.04	0.95	1.00
Isoputreanine	ME464058	1.34	0.78	0.83
Hydroxybutyrylcarnitine	ME463984	0.88	1.11	0.95
furaneol glucopyranoside	ME464092	NA	0.16	1.28
Glyceric acid	ME464100	1.03	0.77	1.20
Met/Phe/Gly	ME464052	0.66	0.45	1.98
Secobarbital	ME464112	1.37	0.73	0.65
PA(30:3)	ME464096	0.88	1.13	1.01
Citric acid	ME463897	1.06	1.06	0.83
Pentadecanoylcarnitine	ME463832	0.91	0.92	1.18
N-Desmethylzopiclone	ME463905	0.96	1.18	0.86
Targinine	ME464000	0.67	1.15	1.24
Phenolsulfonphthalein	ME463724	0.92	0.79	1.30
malyl alpha-D-glucosaminide	ME464032	0.37	0.24	2.39
N-a-Acetyl-L-arginine	ME464038	1.23	0.63	1.10
N-Acetylaspartylglutamic acid	ME463797	1.88	0.57	0.99
Hydroxyphenyllactic acid	ME463759	0.83	0.98	1.23
N(6)-Methyllysine	ME463869	0.73	1.16	1.15
2-trans,6-trans-Farnesal	ME463873	0.69	1.34	1.17
4-Imidazolone-5-propionic acid	ME463767	0.79	0.44	1.80
hydroxy-N-acetyl-(L)-arginine	ME463847	1.36	0.88	0.69
Malonic semialdehyde	ME464103	0.83	1.13	1.13
Carmustine	ME464083	0.44	0.86	1.75
xi-gamma-Undecalactone	ME463716	0.72	1.03	1.39
UDP-2-acetamido-3-acetamidino-2,3-dideoxy--D-mannuronate	ME463891	0.07	1.21	1.71
2-Hydroxy-2,4-pentadienoate	ME463965	1.26	0.89	0.81
Argenonic acid	ME463839	0.83	0.51	1.63
Heptaethylene glycol	ME463809	1.96	0.41	0.47
1-Nitrohexane	ME463750	0.71	1.22	1.27
Valine	ME463717	0.91	0.96	1.19
N-(1-Deoxy-1-fructosyl)valine	ME463778	0.27	0.61	2.24
Oxomemazine	ME464055	0.36	0.13	1.50
3,3^-Thiobispropanoic acid	ME464027	0.83	0.91	1.29
Pimelic acid	ME463867	0.70	1.04	1.46
Ala/Ile/Ile/Val/Val	ME464114	1.37	0.73	0.65
Methyl5-(but-3-en-1-yl)amino-1,3,4-oxadiazole-2-carboxylate	ME463779	0.93	1.04	1.03
triethylene glycol	ME463996	0.65	1.28	1.31
Taurine	ME463762	0.47	1.31	1.31
Hypoxanthine	ME463814	1.97	0.03	0.03
myo-Inositol	ME463789	0.93	1.07	1.01
Uridine diphosphate glucuronic acid	ME463964	0.85	1.02	1.06
N-(1-Deoxy-1-fructosyl)tyrosine	ME463837	0.32	0.24	3.61
phenyl sulfoxide	ME463819	0.72	1.34	1.30
Koryoginsenoside R1	ME463981	0.69	0.56	2.05
PS(18:0/18:0)	ME463949	0.72	0.63	1.45
Quercetin 3^-sulfate	ME464117	NA	0.97	1.03
Uridine triphosphate	ME463985	0.98	1.12	0.90
Fasoracetam	ME463968	1.06	0.84	1.10
Acetylcarnosine	ME464013	1.84	0.48	0.30
Adenosine triphosphate	ME463956	1.45	0.97	0.80
casuarine	ME464108	0.60	1.31	1.08
Norepinephrine sulfate	ME464111	0.51	1.18	1.31
Phenyllactic acid	ME463757	1.28	0.65	1.03
Creatine	ME463705	0.65	1.13	1.29
Phe/Ile/Met/Arg/Val	ME464007	1.82	0.53	0.51
N-(1-Deoxy-1-fructosyl)phenylalanine	ME463748	0.14	0.40	2.60
Pyridoxine	ME463714	0.86	0.97	1.19
tunicamine	ME463974	1.80	0.46	0.20
3-Dehydroquinate	ME463962	0.99	0.70	1.32
Undecanoic acid	ME463895	0.81	1.03	1.28
Lysine	ME463741	0.76	1.07	1.24
PG(16:0/18:1)	ME464024	0.83	0.55	1.53
Aminoadipic acid	ME463913	1.74	0.48	0.58
Tryptophan	ME463735	0.89	0.71	1.41
4-methylmorpholine N-oxide	ME463760	0.61	1.18	1.47
Ala/Leu/Arg/Arg	ME463846	1.37	0.72	0.66
Montalicin A	ME463903	1.00	0.82	1.19
Myristic acid	ME463802	1.08	0.91	0.96
Phosphorylcholine	ME463711	0.72	1.72	0.61
PC(12:0/20:1)	ME463781	0.60	1.00	1.47
PS(37:1)	ME463983	1.46	NA	0.54
benzodiazepinedione	ME463884	0.32	0.20	3.38
Gallagic acid	ME464020	NA	0.81	1.19
tyrosinal	ME463752	0.61	1.19	1.32
Glutarylglycine	ME463930	0.75	0.97	1.64
8-Oxocoformycin	ME464031	0.91	1.05	1.06
1,8-Diazacyclotetradecane-2,9-dione	ME463742	1.00	1.02	0.99
N-hydroxy-L-pipecolate	ME463944	1.14	0.81	0.95
Phenol sulphate	ME463988	0.55	0.89	1.64
2,3-Diaminosalicylic acid	ME464040	0.88	1.09	0.99
Nalpha-Methylhistidine	ME463787	1.20	0.84	0.92
Imidazoleacetic acid riboside	ME463938	1.02	0.74	1.24
Penicilloic acid	ME463737	1.11	0.93	0.94
2-Hydroxy-3-(4-hydroxyphenyl)propenoic acid	ME463852	0.95	0.98	1.04
FA (13:2) tridecadienoic acid	ME463911	1.45	0.63	0.62
tembetarine	ME464088	1.40	0.86	0.67
trans-2-Tetradecenoylcarnitine	ME463959	0.46	1.19	1.52
N-(2-hydroxyundecanoyl)-4,8-sphingadienine	ME463999	0.57	0.93	1.50
Methylimidazoleacetic acid	ME463914	0.99	0.92	1.08
3-(Cystein-S-yl)acetaminophen	ME463879	1.00	1.42	0.50
Pantothenic acid	ME463732	0.66	1.17	1.23
PG(22:6/22:6)	ME463885	0.91	0.59	1.39
Met/Cys/Pro	ME463898	0.20	1.78	2.10
Betaine	ME463718	0.76	1.21	1.19
PC(MonoMe(11,3)/MonoMe(11,3))	ME463904	0.88	0.71	1.35
Allysine	ME463858	0.85	1.17	1.08
Homo-L-arginine	ME463973	0.91	0.98	1.13
Cys/Met/Phe/His	ME463801	1.09	0.43	1.53
HETE di-endoperoxide	ME463927	0.92	1.20	0.89
O-Acetylserine	ME463822	0.60	1.05	1.41
FA (18:2)	ME463916	1.20	0.78	0.89
2,5,6-Trihydroxy-5,6-dihydroquinoline	ME463912	0.64	1.71	0.82
(2R,4S)-2,4-Diaminopentanoate	ME464011	1.29	0.80	0.86
Folic acid	ME464061	1.08	0.79	1.11
Alanyl-Serine	ME464085	1.46	0.78	0.67
N-Desmethylaminopyrine	ME463893	1.04	0.95	1.00
5-Sulfoxymethylfurfural	ME463805	0.68	0.99	1.17
N-acetyl -D- glucosaminitol	ME464035	1.03	0.81	1.15
Ile/Thr/Ser/Ser	ME463838	0.19	0.58	3.32
Arachidonic acid	ME463943	1.65	0.22	0.27
Ne,Ne dimethyllysine	ME463835	0.72	0.96	1.37
norcisapride	ME463833	0.64	1.05	1.57
Proline	ME463708	0.84	1.04	1.23
Guanidoacetic acid	ME463792	0.52	0.94	1.62
2-Amino-5-(methylthio)pentanoic acid	ME464029	0.97	0.97	1.06
ADP-Mannose	ME464113	0.84	1.03	1.05
Brassicanal B	ME464124	1.40	0.69	0.63
N-Acetyl-L-glutamate 5-semialdehyde	ME463875	0.69	1.21	1.15
Histidine	ME463739	1.37	0.38	1.01
N-acetyl-9-O-acetylneuraminate	ME464079	0.62	1.02	1.36
Adrenochrome o-semiquinone	ME463731	1.18	0.65	1.14
Ala/Cys/His/Asn/Gln	ME464001	0.81	1.01	1.21
Ala/Thr/Ser/Tyr	ME463931	NA	0.22	1.26
Ribitol 5-phosphate	ME463967	1.85	0.19	0.11
5-Acetamidovalerate	ME464034	0.77	1.36	1.02
alpha-Ketoisovaleric acid	ME463729	0.41	1.52	1.45
5-Dehydro-4-deoxy-D-glucarate	ME463754	1.11	0.75	1.06
5,7-Dihydroxyflavone 7-benzoate	ME463958	0.62	0.59	1.91
Lysyl-Valine	ME463785	0.54	1.19	1.35
PS(20:1/22:6)	ME464059	0.56	1.01	1.43
Glycerophosphoglycerol	ME463887	0.77	0.99	1.24
Phlorin	ME463926	0.36	0.75	1.88
PC(16:0/22:4)	ME463824	0.79	1.00	1.24
5-Hydroxypentanoic acid	ME463765	0.94	1.00	1.10
1-thio--D-glucose	ME464078	0.82	0.51	1.60
4-Nitroaniline	ME464021	1.10	0.85	0.98
psicoselysine	ME463818	0.15	0.34	3.63
4-Oxoproline	ME463710	0.70	1.21	1.29
Arabitol	ME464033	1.14	0.95	0.89
2-methylaminoacrylate	ME463882	1.37	0.78	0.78
N-Acetyl-beta-alanine	ME463866	0.82	0.92	1.29
Lenticin	ME464082	0.74	1.20	1.06
Mannitol	ME463782	1.49	0.71	0.71
Lactic acid	ME463726	0.44	1.48	1.45
3,4-Dehydrothiomorpholine-3-carboxylate	ME463987	0.90	1.37	0.68
Ergothioneine	ME463901	1.33	0.39	1.21
3-Oxooctadecanoic acid	ME464010	1.15	0.88	0.94
Aspartyl-L-proline	ME464012	NA	0.53	1.31
Indoxyl	ME463886	0.98	0.94	1.08
N-hydroxyvaline	ME464063	1.88	NA	0.12
2-Hydroxyundecanoate	ME463702	0.73	1.28	1.17
Cyclovariegatin	ME464006	1.54	0.74	0.36
a phenothiazine	ME463970	0.15	3.13	0.47
Arbutin	ME463881	1.11	0.93	0.95
sodium dodecyl sulfate	ME463712	1.67	0.53	0.36
Phosphohydroxypyruvic acid	ME464041	1.12	1.09	0.83
PI(16:0/22:4)	ME463940	0.77	0.93	1.29
5-guanidino-3-methyl-2-oxo-pentanoate	ME463877	0.34	0.74	2.80
6,9,12,15,18,21-Tetracosahexaynoic acid	ME464030	1.04	1.12	0.83
Asparagine	ME464126	2.23	0.26	0.30
4-Hydroxyglutamate semialdehyde	ME463989	1.15	0.74	1.11
PC(14:0/20:2)	ME463783	0.47	1.12	1.50
PC(18:1/22:6)	ME463864	1.05	0.76	1.22
Tyrosine	ME463761	0.92	0.83	1.27
PG(18:1/22:6)	ME463941	0.82	0.68	1.41
Creatinine	ME463720	1.01	1.00	0.99
dodecyltrimethylammonium	ME463772	2.14	0.25	0.42
Dopamine quinone	ME463936	0.32	1.08	1.60
cis-Acetylacrylate	ME464080	1.09	1.00	0.87
PC(14:0/22:4)	ME463850	0.64	1.09	1.34
2-C-Methyl-D-erythritol 4-phosphate	ME463738	1.76	0.54	0.57
4^-methoxycyclopenine	ME464107	1.05	1.00	0.93
FA oxo(16:0)	ME464056	0.96	0.97	1.09
Adenosine	ME463788	0.93	0.81	1.24
N-lactoyl-Tryptophan	ME463950	0.68	1.97	0.87
Cytidine	ME463917	2.18	0.15	0.47
Dehydrophytosphingosine	ME464071	1.19	0.91	0.77
5-Methylcytosine	ME463896	1.30	0.61	0.70

Factors:

F1	Chemoresistance Status:N/A
F2	Chemoresistance Status:Resistant
F3	Chemoresistance Status:Sensitive

Data matrix