Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002108)

HILIC NEGATIVE ION MODE (Analysis AN003449)

Metabolite	Structure	F1	F2
Ala/Gly/Ser	ME514559	2.81	0.20
Febrifugine	ME514637	2.67	0.17
Isoleucyl-Asparagine	ME514573	2.73	0.23
3-[4-amino-3-hydroxybutyl]-hydroxy-carbamoyl-propanoate	ME514541	2.26	0.16
N5-formyl-N5-hydroxy-L-ornithine	ME514483	2.16	0.42
gamma-Glutamylvaline	ME514576	2.24	0.45
N5-acetyl-N5-hydroxy-L-ornithine	ME514509	2.20	0.47
Alanyl-D-alanine	ME514461	2.41	0.37
Alanyl-Serine	ME514484	2.34	0.41
2-Phospho-D-glyceric acid	ME514503	0.58	1.19
nicotinamide guanine dinucleotide	ME514778	0.60	1.20
2-Dehydro-D-xylonate	ME514465	0.59	1.18
Uridine diphosphate glucuronic acid	ME514750	0.60	1.18
Allantoin	ME514460	0.60	1.18
2,3,4-trihydroxy-butanoic acid	ME514436	0.60	1.18
2,3-Diphosphoglyceric acid	ME514598	0.60	1.18
prebassianin A	ME514688	0.64	1.18
2,3,4,5,6,7-Hexahydroxyheptanoic acid	ME514548	0.61	1.17
Ribose 5-phosphate	ME514553	0.61	1.17
Pro/Gln/Gln/Trp/Trp	ME514793	0.62	1.17
Formylfusarochromanone	ME514660	0.62	1.17
2-C-Methyl-D-erythritol 4-phosphate	ME514537	0.62	1.17
Cys/Cys/Glu/Met/Met	ME514761	0.62	1.17
PE	ME514607	0.63	1.17
2-hydroxyparaconate	ME514444	0.64	1.16
4-Hydroxy-4-methylglutamate	ME514485	0.63	1.16
1-Stearoylglycerophosphoserine	ME514736	0.65	1.15
Asn/Lys/Met/Cys	ME514727	0.65	1.15
3,3^-Thiobispropanoic acid	ME514486	0.65	1.16
6-Phosphogluconic acid	ME514613	0.65	1.16
Xylose	ME514451	0.66	1.15
8-keto-7-aminoperlagonate	ME514502	0.67	1.14
N-acetylneuraminate	ME514643	0.67	1.15
D,L--methylphosphinothricin	ME514513	0.67	1.15
2-Dehydro-3-deoxy-D-arabino-heptonate 7-phosphate	ME514627	0.67	1.15
coptisine	ME514655	0.67	1.15
1,2-dibutyrin	ME514557	0.68	1.11
Taurine	ME514420	0.71	1.13
3-Deoxy-D-manno-octulosonate 8-phosphate	ME514659	0.71	1.13
N-Acetyl-L-aspartic acid	ME514481	0.71	1.13
Succinic acid	ME514416	0.70	1.13
Ile/Pro/Pro/Gln/Trp	ME514656	0.70	1.13
N-(4-oxoglutaryl)-L-cysteinylglycine	ME514641	0.70	1.13
1-(eicosatetraenoyl)-sn-glycero-3-phosphoserine	ME514742	0.72	1.14
1-O-Methyl-myo-inositol	ME514512	0.72	1.12
2,4,6/3,5-Pentahydroxycyclohexanone	ME514488	0.72	1.13
2-Carboxy-D-arabinitol 1-phosphate	ME514612	0.72	1.13
Monomethyl sulfate	ME514411	0.69	1.16
Phe/Phe/Pro/Val/Tyr	ME514775	0.69	1.14
4-bromodiphenyl ether	ME514579	0.69	1.14
2^-hydroxypyridoxol	ME514501	0.69	1.14
2-Hydroxy-3-(phosphonatooxy)propanoate	ME514504	0.69	1.14
1-thio--D-glucose	ME514514	0.69	1.14
2,3,4,5-Tetrahydroxypentanoic acid	ME514469	0.69	1.14
PHODiA-PE	ME514762	0.68	1.14
2-Hydroxystearic acid	ME514636	0.68	1.14
Arabinose	ME514449	0.68	1.14
Aspartic acid	ME514434	0.83	1.07
Phosphoenolpyruvic acid	ME514471	0.83	1.08
3b,12a-Dihydroxy-5a-cholanoic acid	ME514692	0.83	1.08
4-Oxoproline	ME514426	0.83	1.08
N-Glycolyl-D-glucosamine	ME514562	0.81	1.09
Sorbitol-6-phosphate	ME514595	0.81	1.09
N-Acetyl-D-fucosamine	ME514524	0.82	1.08
2-Octenoic acid	ME514442	0.82	1.08
Glu/Cys/Trp	ME514707	0.82	1.08
Quinaldic acid	ME514479	0.81	1.08
octadecenoic acid	ME514622	0.81	1.08
N-Acetyl-D-glucosaminate	ME514563	0.81	1.08
FA (18:3)	ME514617	0.81	1.08
kauralexin B1	ME514639	0.81	1.08
trans-Tetra-dec-2-enoic acid	ME514549	0.86	1.06
melibionate	ME514678	0.86	1.06
Arabinonate	ME514468	0.86	1.06
Ala/Lys/Lys/Val/Trp	ME514763	0.86	1.06
1,3-alpha-D-Mannosyl-(1,2-N-acetyl-alpha-D-glucosaminyl)-1,2-alpha- D-mannosyl-1,2-alpha-D-mannosyl-D-mannose	ME514832	0.86	1.06
2,5-Dioxopentanoate	ME514428	0.86	1.06
PIP(16:0/22:4)	ME514723	0.87	1.06
Malonic semialdehyde	ME514399	0.87	1.06
Lactic acid	ME514402	0.87	1.06
Itaconic acid	ME514427	0.87	1.06
Inosinic acid	ME514675	0.87	1.06
Glyceric acid	ME514408	0.87	1.06
Deoxycholic acid glycine conjugate	ME514711	0.87	1.06
Cysteic acid	ME514473	0.87	1.06
2-Keto-3-deoxy-D-gluconic acid	ME514487	0.87	1.06
4-Hydroxy-2-oxopentanoate	ME514431	0.87	1.06
Sambutoxin	ME514712	0.86	1.07
Fuculose 1-phosphate	ME514572	0.85	1.08
Traumatin	ME514535	0.85	1.07
Pyruvic acid	ME514401	0.85	1.07
LysoPE(18:1)	ME514716	0.85	1.07
glycero-L-galacto-Octulose	ME514566	0.85	1.07
Glycerol 3-phosphate	ME514477	0.85	1.07
Formylpyruvate	ME514415	0.85	1.07
Bergaptol	ME514518	0.85	1.07
AMPA	ME514505	0.85	1.07
Asp/Met/Phe/Ser	ME514729	0.85	1.07
Fagomine	ME514446	0.84	1.07
Inositol cyclic phosphate	ME514569	0.84	1.07
Methyl-5-thio-D-ribose 1-phosphate	ME514590	0.78	1.13
Orotic acid	ME514459	0.81	1.13
Threose	ME514418	0.75	1.11
rhamnitol-1-phosphate	ME514574	0.75	1.11
phosphinomethylisomalate	ME514534	0.75	1.11
O-mannopyranosyl-alpha-1,3-[O-mannopyranosyl-alpha-1,3-(O-mannopyranosyl-alpha-1,6)-O-mannopyranosyl-alpha-1,6]-O-mannopyranosyl-beta-1,4-N-acetyl-D-glucosamine	ME514836	0.75	1.11
Glucaric acid	ME514529	0.75	1.11
Altronate	ME514515	0.75	1.11
(2,6-anhydro-3-deoxy-D-arabino-heptulopyranosid)onate 7-phosphate	ME514608	0.75	1.11
3-Hydroxypropenoate	ME514400	0.75	1.11
4-Pyridoxolactone	ME514467	0.76	1.11
PKOOA-PE	ME514757	0.76	1.11
3a,7a,12b-Trihydroxy-5b-cholanoic acid	ME514694	0.73	1.12
Malic acid	ME514435	0.73	1.12
6,7-Dihydroxy-5,4^-dimethoxy-flavylium	ME514635	0.74	1.12
Hippuric acid	ME514489	0.74	1.12
Clavulanate	ME514517	0.79	1.09
kauralexin A1	ME514640	0.79	1.09
CMP-2-aminoethylphosphonate	ME514705	0.80	1.09
Ile/Ala/Ser	ME514626	0.80	1.09
Ala/Phe/Tyr/Tyr	ME514747	0.77	1.11
Palmitoleic acid	ME514584	0.77	1.10
Galactinoldihydrate	ME514685	0.77	1.10
Cys/Phe/Gly/Gly	ME514690	0.77	1.10
Asp/Glu/Phe/Met/Arg	ME514779	0.77	1.10
2^-phospho-cyclic ADP-ribose	ME514647	0.77	1.10
10-methyl-hexadec-7-enoate	ME514602	0.77	1.10
15(R)-hydroperoxy-EPE	ME514564	0.77	1.10
Phosphodimethylethanolamine	ME514474	0.78	1.10
Erythrose	ME514419	0.78	1.10
2(alpha-D-Mannosyl)-D-glycerate	ME514601	0.78	1.10
A-Ketoglutaric acid oxime	ME514463	0.78	1.10
Melleolide D	ME514722	1.32	0.86
PA(O-38:5)	ME514784	1.34	0.85
Pyrogallol-2-O-glucuronide	ME514638	1.33	0.85
2,5-dihydroxybenzoate 2-O--D-glucoside	ME514654	1.28	0.88
methanofuran biosynththesis intermediate MF3	ME514570	1.30	0.87
Asp/Glu/Glu/Met/Gln	ME514768	1.16	0.89
PS(39:4)	ME514825	1.16	0.93
PA(14:0/20:1)	ME514777	1.16	0.93
1-(4-Hydroxy-3-methoxyphenyl)-3-decanone	ME514616	1.16	0.93
O-Acetylneuraminic acid	ME514642	1.16	0.93
6-[2-carboxy-2-(hydroxymethyl)-2-methylethoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid	ME514646	1.15	0.93
Margaroyl-EA	ME514651	1.15	0.93
6-{3-[3-(3,4-dihydroxyphenyl)-3-oxopropyl]-6-hydroxy-2-methoxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid	ME514721	1.19	0.92
Sphinganine 1-phosphate	ME514689	1.18	0.92
Phe/Ile/Lys/Lys/Asn	ME514766	1.18	0.92
{2-hydroxy-5-[-3-phenylprop-2-enoyl]phenyl}oxidanesulfonic acid	ME514657	1.18	0.92
Galactosylglycerol	ME514582	1.18	0.92
Mangiferin	ME514701	1.16	0.92
Uridine diphosphate-N-acetylglucosamine	ME514758	1.17	0.92
Ile/Ile/Ile/Ile/Gln	ME514753	1.17	0.92
Methocarbamol	ME514567	1.17	0.92
alpha-Amino-gamma-oxalylaminobutyric acid	ME514508	1.26	0.88
6-deoxy-5-ketofructose-1-phosphate	ME514568	1.24	0.89
Dichamanetin	ME514718	1.25	0.89
6-(5-ethyl-2,3-dihydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid	ME514664	1.25	0.89
5-hydroxy-9-methoxycamptothecin	ME514693	1.25	0.89
1-deoxy-1-morpholino-D-fructose	ME514581	1.25	0.89
2-amino-3-(4-hydroxy-3-methoxyphenyl)-2-methylpropanoic acid	ME514547	1.25	0.89
1-(sn-Glycero-3-phospho)-myo-inositol	ME514666	1.23	0.90
PA(16:0/22:6)	ME514789	1.22	0.90
beta-aspartyl-L-glutamic acid	ME514596	1.22	0.90
Ganglioside GA1 (d18:1/24:1)	ME514774	1.22	0.90
Ala/Asp/His/Ser/Thr	ME514739	1.19	0.90
PI(O-34:0)	ME514824	1.20	0.91
Trihexosylceramide (d18:1/24:1)	ME514837	0.95	1.03
PS(18:1/20:4)	ME514820	0.96	1.02
Phenolsulfonphthalein	ME514677	0.96	1.02
PGP(a-13:0/i-16:0)	ME514799	0.96	1.02
N-Acetylanthranilate	ME514490	0.96	1.02
N2-hydroxy-L-tryptophan	ME514540	0.96	1.02
Miroestrol	ME514679	0.96	1.02
Kaempferol 3-(4^^-acetyl-6^^-p-coumarylglucoside)	ME514764	0.96	1.02
Isradipine	ME514683	0.96	1.02
3-Phosphonopyruvate	ME514470	0.96	1.02
Cholesterol sulfate	ME514717	0.96	1.02
Sphingosine 1-phosphate	ME514686	0.95	1.02
Sedoheptulose	ME514530	0.95	1.02
Quinalphos	ME514631	0.95	1.02
PS(20:3/18:3)	ME514819	0.95	1.02
Mannitol	ME514499	0.95	1.02
Gallicynoic acid A	ME514583	0.95	1.02
Galactose	ME514494	0.95	1.02
beta-D-Sedoheptulopyranose	ME514531	0.95	1.02
beta-methylenecyclopropyl pyruvate	ME514441	0.95	1.02
sulfoquinovosyl-1-O-dihydroxyacetone	ME514653	0.97	1.01
PG(16:0/22:5)	ME514818	0.97	1.01
glycerophosphoserine	ME514589	0.97	1.01
glutathione-sulfite	ME514691	0.97	1.01
Dopamine	ME514457	0.97	1.01
Asn/Asp/Asp/Pro	ME514714	0.97	1.01
5-{[-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-3-hydroxy-4-(sulfooxy)cyclohex-1-ene-1-carboxylic acid	ME514699	0.97	1.01
Aliarin 4^-methyl ether	ME514706	0.97	1.01
PS(18:0/18:2)	ME514815	0.98	1.01
PE(14:1/22:2)	ME514792	0.98	1.01
19-dimethylarsinoyl-nonadecanoic acid	ME514700	0.98	1.01
1-Oleoylglycerophosphoserine	ME514734	0.98	1.01
Ureidosuccinic acid	ME514482	0.99	1.01
2-Aceto-2-hydroxybutanoic acid	ME514445	0.99	1.01
PA(O-42:4)	ME514802	0.99	1.01
sn-glycero-3-phospho-N-(arachidonoyl)ethanolamine	ME514731	0.93	1.03
Rhamnose	ME514466	0.93	1.03
Pyroglutamic acid	ME514425	0.93	1.03
Phe/Phe/Phe/Pro/Thr	ME514771	0.93	1.03
PG(18:0/18:2)	ME514807	0.93	1.03
PE(P-18:1/22:5)	ME514808	0.93	1.03
Hydroxyphenylacetylglycine	ME514528	0.93	1.03
Glucuronate	ME514511	0.93	1.03
Docosapentaenoic acid (22n-6)	ME514665	0.93	1.03
Arachidic acid	ME514649	0.93	1.03
4-Amino-4-deoxychorismate	ME514545	0.93	1.03
1-(2-methoxy-octadecanyl)-sn-glycero-3-phosphoserine	ME514741	0.93	1.03
(2R,3S)-2-hexyl-3-hydroxydecanoate	ME514610	0.93	1.03
Stearic acid	ME514623	0.94	1.03
PS(16:0/18:1)	ME514800	0.94	1.03
PG(18:0/18:0)	ME514811	0.94	1.03
Palmitic acid	ME514587	0.94	1.03
Flunitrazepam	ME514650	0.94	1.03
Cys/Gly/His/Ser/Ser	ME514725	0.94	1.03
1-carboxymethylpyridinium	ME514438	0.94	1.03
2-amino-2-deoxy-isochorismate	ME514546	0.94	1.03
PE(P-16:0e/0:0)	ME514709	0.92	1.04
Hydrogen phosphate	ME514404	0.92	1.04
Cys/Asp/Asp/Gly/Asn	ME514733	0.92	1.04
Axillarin 7-sulfate	ME514702	0.92	1.04
beta-aspartyl-L-alanine	ME514520	0.92	1.04
Cysteinosuccinic acid	ME514561	0.92	1.03
N-Acetoxyarylamine	ME514455	0.92	1.03
Ribose	ME514452	0.89	1.05
Met/Met/Met	ME514696	0.89	1.05
Hydroxyphenyllactic acid	ME514498	0.89	1.05
Asp/Ile/Ile/Ile/Ile	ME514752	0.89	1.05
1-[(3-Carboxypropyl)amino]-1-deoxyfructose	ME514597	0.89	1.05
3-carboxy-2,3-dihydroxypropanoate	ME514448	0.89	1.05
Hydroxymethylphosphonate	ME514412	0.88	1.05
4-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde	ME514552	0.88	1.05
2,7-Anhydro-alpha-N-acetylneuraminic acid	ME514629	0.88	1.05
2-Hydroxyglutaric acid	ME514447	0.88	1.05
LysoPE(0:0/20:5)	ME514730	0.88	1.06
Trihexosylceramide (d18:1/16:0)	ME514835	0.89	1.06
sn-glycero-3-phospho-N-(oleoyl)ethanolamine	ME514720	0.91	1.04
PG(16:0/18:1)	ME514797	0.91	1.04
LysoPA(0:0/18:1)	ME514708	0.91	1.04
FA methyl(14:0)	ME514571	0.91	1.04
Dulcoside A	ME514816	0.91	1.04
DGCC(20:5/20:5)	ME514823	0.91	1.04
Arabitol	ME514456	0.91	1.04
1-(2-methoxy-eicosanyl)-sn-glycero-3-phosphoserine	ME514749	0.91	1.04
3-hydroxy-3-methyl-2-oxo-butanoic acid	ME514430	0.91	1.04
Myristic acid	ME514551	0.90	1.04
Heptadecanoic acid	ME514606	0.90	1.04
Glucosylsphingosine	ME514715	0.90	1.04
fumiquinazoline F-indoline-3^-ol	ME514684	0.90	1.04
Dide-O-methylsimmondsin	ME514674	0.90	1.04
2-Hydroxy-2-ethylsuccinic acid	ME514464	0.90	1.04
cyclo(glycyl-L-prolyl)	ME514458	0.90	1.04
Tetrahydrodipicolinate	ME514476	0.90	1.05
PA	ME514550	0.90	1.05
Ala/Cys/Cys/Cys/Glu	ME514738	0.90	1.05
3-Oxooctadecanoic acid	ME514632	0.90	1.05
6-Heptenyl glucosinolate	ME514698	0.90	1.05
Adenosine diphosphate ribose	ME514746	0.91	1.05
LysoPE(0:0/18:2)	ME514719	0.91	1.05
2-C-methyl-D-erythritol-2,4-cyclodiphosphate	ME514614	1.03	0.98
Pyridoxine 5^-phosphate	ME514580	1.03	0.99
PI(18:1/20:4)	ME514833	1.03	0.99
PG(16:0/20:3)	ME514805	1.03	0.99
PE(P-18:1/20:3)	ME514798	1.03	0.99
N6-Acetyl-N6-hydroxy-L-lysine	ME514523	1.03	0.99
Ile/Met/Thr/Tyr	ME514737	1.03	0.99
erythro-L-galacto-Nonulose	ME514604	1.03	0.99
2-Deoxy-2,3-dehydro-N-acetylneuraminic acid	ME514628	1.03	0.99
2-Hydroxyethanesulfonate	ME514421	1.03	0.99
PS(16:0/20:3)	ME514814	1.04	0.98
PE(18:1/P-18:0)	ME514791	1.04	0.98
N-D-Glucosylarylamine	ME514585	1.04	0.98
Ketoleucine	ME514429	1.04	0.98
Hydantoin-5-propionic acid	ME514478	1.04	0.98
His/His/Pro/Pro/Gln	ME514760	1.04	0.98
diazaborine	ME514634	1.04	0.98
Cyclic ADP-ribose	ME514740	1.04	0.98
2-hexyl-3-oxodecanoate	ME514605	1.04	0.98
Ala/Asp/Asp/Phe/Trp	ME514769	1.04	0.98
Xylobiose	ME514621	1.05	0.98
Ile/Ile/Ile/Ile/Met	ME514756	1.05	0.98
Ala/Met/Asp/Tyr	ME514728	1.05	0.98
Fenugreekine	ME514772	1.05	0.98
selenium dioxide	ME514410	0.99	1.00
PS(18:2/22:6)	ME514826	0.99	1.00
Phosphoramidate	ME514403	0.99	1.00
PG(18:4/22:6)	ME514822	0.99	1.00
Lomustine	ME514558	0.99	1.00
FA (18:2)	ME514620	0.99	1.00
2-O-alpha-L-Rhamnopyranosyl-D-glucopyranose	ME514663	0.99	1.00
(2R,4S)-2,4-Diaminopentanoate	ME514433	0.99	1.00
Trigonelline	ME514440	1.00	1.00
Thymine	ME514423	1.00	1.00
PS(18:0/20:4)	ME514821	1.00	1.00
PI(12:0/18:2)	ME514810	1.00	1.00
Phe/Gly/Tyr/Tyr	ME514743	1.00	1.00
PE(18:0(11Cp)/16:0(9Cp))	ME514794	1.00	1.00
PE(16:0(9Cp)/16:0(9Cp))	ME514786	1.00	1.00
PE(14:0/20:1)	ME514787	1.00	1.00
Nicotinuric acid	ME514491	1.00	1.00
Glucose 6-phosphate	ME514593	1.00	1.00
8-Chloro-5,7,4^-trihydroxy-3-C-methylflavanone	ME514658	1.00	1.00
9,10-dibromo-stearic acid	ME514710	1.00	1.00
PS(18:0/22:4)	ME514828	1.01	1.00
PS(16:0/20:4)	ME514813	1.01	1.00
PG(18:0/18:1)	ME514809	1.01	1.00
PE(16:0/22:4)	ME514803	1.01	1.00
N-Nitrosoproline	ME514443	1.01	1.00
LysoPA(0:0/16:0)	ME514695	1.01	1.00
Imidazole-4-acetaldehyde	ME514409	1.01	1.00
Hydroxyoctanoic acid	ME514462	1.01	1.00
Gln/Leu/Lys/Tyr	ME514745	1.01	1.00
5^-Oxoinosine	ME514599	1.01	1.00
AICAR	ME514669	1.01	1.00
Tuberculostearic acid	ME514633	1.02	0.99
PI(16:0/20:2)	ME514830	1.02	0.99
PC(MonoMe(11,3)/MonoMe(11,3))	ME514827	1.02	0.99
PC(13:0/20:2)	ME514795	1.02	0.99
His/Lys/Met/Pro/Val	ME514759	1.02	0.99
Gluconic acid	ME514516	1.02	0.99
1-Stearoylglycerophosphoinositol	ME514755	1.02	0.99
2-octenal	ME514424	1.02	0.99
Pyrimidine 5^-deoxynucleotide	ME514615	1.01	0.99
PE(P-18:1/22:6)	ME514806	1.01	0.99
PE(18:1/16:0)	ME514788	1.01	0.99
PE(14:1/22:0)	ME514796	1.01	0.99
Glu/Ile/Ile/Ile/Ile	ME514754	1.01	0.99
Beta-Tyrosine	ME514497	1.01	0.99
4-Pyridoxic acid	ME514500	1.01	0.99
2-{[(3,5-dimethoxyphenyl)(hydroxy)methylidene]amino}acetic acid	ME514565	1.01	0.99
2-Keto-6-acetamidocaproate	ME514507	1.01	0.99
Ganglioside GA1 (d18:1/22:0)	ME514770	1.08	0.96
Ile/Lys/Gln/Tyr	ME514744	1.08	0.96
Hexanal	ME514405	1.09	0.96
Lofexidine	ME514588	1.09	0.96
Urocanic acid	ME514439	1.06	0.97
PS(18:0/18:1)	ME514817	1.06	0.97
PI(14:0/22:1)	ME514831	1.06	0.97
PA(14:0/18:0)	ME514767	1.06	0.97
Ala/Glu/Phe/Pro/Trp	ME514765	1.06	0.97
Ile/Ile/Ile/Ile/Asn	ME514751	1.06	0.97
Uridine diphosphate glucose	ME514748	1.07	0.97
PE(P-18:0/22:4)	ME514812	1.07	0.97
N-Benzyloxycarbonylglycine	ME514527	1.07	0.97
Cys/Cys/Gly/Gly	ME514670	1.07	0.97
Asn/Asn/Asp/Pro	ME514713	1.07	0.97
Acetoacetic acid	ME514406	1.07	0.97
2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate	ME514510	1.07	0.97
4-Hydroxyphenylacetaldehyde-oxime	ME514454	1.07	0.97
PC(15:0/20:5)	ME514801	1.08	0.97
N-Ethylglycocyamine	ME514525	1.08	0.97
N-acetyl -D- glucosaminitol	ME514544	1.08	0.97
3-O-alpha-L-rhamnopyranosyl-3-hydroxynonanoyl-3-hydroxydecanoic acid	ME514726	1.08	0.97
myo-Inositol	ME514496	1.08	0.97
sulfonic acid	ME514661	1.13	0.94
PI(16:0/20:4)	ME514829	1.13	0.94
PC(P-16:0/20:3)	ME514804	1.13	0.94
2-Amino-9,10-epoxy-8-oxodecanoic acid	ME514536	1.13	0.94
Patientoside A	ME514697	1.13	0.94
PE(16:0/P-18:1)	ME514782	1.14	0.94
PA(16:1/22:4)	ME514790	1.14	0.94
2-{[hydroxy(2,3,4-trimethoxyphenyl)methylidene]amino}acetic acid	ME514603	1.14	0.94
indole-3-acetyl-proline	ME514609	1.14	0.94
Cys/Asp/Asp/Glu/Trp	ME514773	1.09	0.94
P-DPD	ME514533	1.10	0.96
2-(Methylthio)pyrazine	ME514422	1.10	0.96
PA(14:1/20:1)	ME514776	1.10	0.96
ancymidol	ME514586	1.10	0.95
Avenic acid A	ME514662	1.10	0.95
PA(14:1/22:2)	ME514780	1.12	0.95
6-Methoxy-3-(2-thiazolyl)-1H-indole	ME514554	1.12	0.95
9,10-DHOME	ME514652	1.12	0.95
1-Methoxyspirobrassinin	ME514618	1.11	0.94
PI(16:0/22:4)	ME514834	1.11	0.95
PA(16:1/20:1)	ME514781	1.11	0.95
PA(14:1/22:0)	ME514783	1.11	0.95
N-Succinyl-L-glutamate	ME514578	1.11	0.95
3,4,5-trihydroxy-6-[(3-methoxy-3-oxopropanoyl)oxy]oxane-2-carboxylic acid	ME514630	1.11	0.95
Cys/Cys/Ser/Ser/Ser	ME514724	1.11	0.95
Fructose 2,6-bisphosphate	ME514671	0.07	1.41
3-(ADP)-glycerate	ME514732	0.56	1.20
Guanosine 2^,3^-cyclic phosphate	ME514673	0.55	1.20
ADP	ME514703	0.49	1.23
Hexose phosphate	ME514591	0.49	1.23
{2-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-6-yl]-4-hydroxy-6-methyl-5-oxooxan-3-yl}oxidanesulfonic acid	ME514735	0.51	1.22
Digitalin	ME514785	0.51	1.22
Garcinia acid	ME514526	0.50	1.22
Indoleacrylic acid	ME514506	0.50	1.22
Ribulose	ME514450	0.53	1.21
Ribose 1,5-bisphosphate	ME514645	0.53	1.21
Erythronic acid	ME514437	0.53	1.21
Fructose 6-phosphate	ME514592	0.53	1.21
Glu/Ser/Thr	ME514667	0.52	1.21
phosphinomethylmalate	ME514532	0.52	1.21
Ala/Ala/Asp/Ser	ME514680	0.54	1.23
Indolepyruvate	ME514519	0.53	1.24
Oxopurpureine	ME514687	0.52	1.24
Hydroxypyruvic acid	ME514407	0.40	1.20
2-Hydroxy-2,4-pentadienoate	ME514414	0.43	1.25
2-Acetolactate	ME514432	0.44	1.25
Dihydroxyacetone phosphate	ME514475	0.44	1.25
Dehydroascorbic acid	ME514480	0.47	1.23
hydroxypyruvaldehyde phosphate	ME514472	0.46	1.24
tunicamine	ME514648	0.46	1.24
Erythrulose	ME514417	0.37	1.28
Fructose	ME514495	0.37	1.28
7-Hydroxymethyl-12-methylbenz[a]anthracene sulfate	ME514676	0.33	1.30
Mannose	ME514493	0.33	1.30
Fructose 1,6-bisphosphate	ME514672	0.35	1.29
Glucose	ME514492	0.35	1.29
Hydrocinnamic acid	ME514453	0.27	1.33
Sedoheptulose 1,7-bisphosphate	ME514681	0.22	1.35
Ala/Asp/Gly	ME514594	1.41	0.82
D-galactopyranosyl trimethylammonium bromide	ME514542	1.38	0.83
Alanyl-Aspartic acid	ME514521	1.51	0.78
gamma-Glutamylglycine	ME514522	1.44	0.81
Aspartyl-L-proline	ME514555	1.46	0.80
Ala/Gly/Tyr	ME514644	1.47	0.79
Glycerophosphoglycerol	ME514575	1.47	0.79
Ile/Gly/Val	ME514624	1.91	0.39
erucamide	ME514668	1.63	0.72
beta-aspartyl-L-serine	ME514539	1.69	0.69
N2-gamma-Glutamylglutamine	ME514611	1.67	0.70
beta-aspartyl-L-threonine	ME514560	1.95	0.58
Uracil	ME514413	1.81	0.64
beta-aspartyl-L-leucine	ME514577	1.83	0.63
Orotidine	ME514625	1.84	0.63
Isoleucyl-Valine	ME514556	1.43	0.13
Phenylalanyl-Glycine	ME514543	1.58	0.22
Valyl-Valine	ME514538	1.00	NA
Phenylalanyl-Threonine	ME514600	1.00	NA
Thioridazine	ME514682	1.00	NA
Arg/Val/Gly/Pro	ME514704	1.19	0.22
N-carbobenzyloxy-L-glutamine	ME514619	1.21	0.16

Factors:

F1	cell_type:iRBC \| treatment:Compound 3
F2	cell_type:iRBC \| treatment:DMSO

Data matrix