Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST000539)

HILIC NEGATIVE ION MODE (Analysis AN000819)

Metabolite	Structure	F1	F2	F3	F4	F5	F6
sodium dodecyl sulfate	ME159428	0.24	0.23	0.16	4.85	0.30	0.22
uridine-5-diphosphate bromoacetol	ME159396	1.08	0.58	0.06	3.88	0.03	0.06
Norepinephrinesulfate	ME159424	1.93	1.83	1.49	0.17	0.06	0.20
D-Gluconic acid	ME159280	1.78	2.09	1.99	0.05	0.05	0.05
[FA trihydroxy(4:0)] 2,2,4-trihydroxy-butanoic acid	ME159479	1.66	2.04	1.88	0.03	0.02	0.03
(L-Seryl)adenylate	ME159435	1.91	1.90	1.72	0.15	0.15	0.17
D-Glucarate	ME159343	1.76	1.92	1.84	0.18	0.13	0.16
D-Mannose 6-phosphate	ME159342	1.84	1.99	1.83	0.11	0.07	0.16
D-Sorbitol	ME159274	1.79	1.97	1.90	0.10	0.09	0.15
2-Dehydro-3-deoxy-D-gluconate	ME159378	1.27	1.89	2.08	0.21	0.23	0.32
Sedoheptulose	ME159666	1.62	1.50	1.70	0.21	0.21	0.24
Glucosyl sphingosine	ME159663	1.70	1.55	1.91	0.30	0.22	0.32
D-Galacturonate	ME159357	1.60	1.85	1.86	0.20	0.21	0.28
D-Fructose	ME159265	1.70	1.71	1.77	0.30	0.23	0.28
melibionate	ME159688	1.69	1.74	1.85	0.24	0.19	0.29
N-Acetyl-D-glucosaminate	ME159472	1.49	1.77	1.59	0.58	0.16	0.41
N-Acetyl-D-fucosamine	ME159477	1.39	1.70	1.62	0.40	0.40	0.48
N-Acetyl-D-fucosamine 2	ME159520	1.39	1.70	1.62	0.40	0.40	0.48
[GP (16:0/18:1)] 1-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glycero-3-phosphate	ME159600	1.47	1.71	1.47	0.51	0.34	0.50
Ecgonine	ME159443	1.55	1.63	1.52	0.44	0.43	0.43
[GP (18:0/18:2)] 1-octadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate	ME159593	1.55	1.76	1.52	0.37	0.34	0.46
(R,R)-Tartaric acid	ME159270	1.68	1.79	1.57	0.30	0.25	0.41
hydrogen iodide	ME159460	1.56	1.76	1.64	0.37	0.35	0.31
Taurine	ME159271	1.58	1.70	1.70	0.30	0.39	0.33
L-Arabinonate	ME159540	2.04	1.52	1.36	0.34	0.31	0.42
Urate	ME159288	2.14	1.00	1.31	0.19	0.09	0.21
Thiopental	ME159697	0.44	0.47	2.10	NA	NA	NA
Galactinoldihydrate	ME159694	0.74	0.78	1.48	NA	NA	NA
nocardicin G	ME159709	0.71	0.82	1.47	NA	NA	NA
1-naphthalenesulfonamide, n-(6-aminohexyl)-5- chloro-	ME159721	1.03	1.25	0.72	NA	NA	NA
Glu-Thr-Thr	ME159699	1.18	1.29	0.53	NA	NA	NA
alpha-D-Mannoheptulopyranose	ME159473	0.89	1.07	1.05	NA	NA	NA
PA(36:1)	ME159719	0.92	1.10	0.98	NA	NA	NA
[FA hydroxy(7:1/2:0)] 2,4-dihydroxy-2-heptenedioc acid	ME159312	1.16	1.06	1.07	NA	NA	0.11
1-(5-Phosphoribosyl)-5-amino-4-imidazolecarboxamide	ME159544	1.11	0.91	0.98	NA	NA	NA
Clitidine 5-phosphate	ME159681	1.07	1.07	0.86	NA	NA	NA
2-(Hydroxymethyl)-3-(acetamidomethylene)succinate	ME159560	0.02	0.02	0.02	2.98	0.48	2.48
5-Deoxy-5-aminoshikimic acid	ME159418	0.07	0.07	0.07	2.77	0.50	2.51
2-Aminoacrylate	ME159551	0.10	0.09	0.09	2.63	0.62	2.46
3,4-Dihydroxypyridine	ME159678	0.05	0.05	0.05	2.73	0.66	2.46
3,7-Dimethyl-2E,6E-decadien-1,10-dioic acid	ME159765	0.28	0.65	0.28	2.51	0.49	1.78
N-hexanoyl-D,L-homoserine lactone	ME159750	0.30	0.48	0.22	2.70	0.29	2.02
Oxalosuccinate	ME159599	0.23	0.27	0.24	2.78	0.44	1.78
UDP-glucuronate	ME159327	0.32	0.32	0.28	2.31	0.58	2.19
[FA (18:3)] 13S-hydroperoxy-9Z,11E,14Z-octadecatrienoic acid	ME159595	0.50	0.57	0.28	1.96	0.48	1.98
N-Hydroxy-1-aminonaphthalene	ME159636	0.38	0.59	0.39	2.11	0.67	1.86
2,3-Bisphospho-D-glycerate	ME159250	1.41	0.25	0.21	2.59	0.03	1.51
[PC (7:0/8:0)] 1-heptanoyl-2-octanoyl-sn-glycero-3-phosphocholine	ME159731	0.37	0.47	0.16	3.29	0.43	0.99
Cyanuric acid	ME159632	0.65	0.57	0.68	2.75	0.67	0.68
3-Sulfino-L-alanine	ME159295	0.56	0.41	0.43	2.78	0.63	1.19
[FA hydroxy(18:2)] 9S-hydroxy-10E,12Z-octadecadienoic acid	ME159596	0.43	0.49	0.30	2.90	0.66	1.21
2-Oxooctadecanoic acid	ME159505	0.43	0.68	0.36	2.52	0.70	1.30
[FA oxo(16:0)] 3-oxo-hexadecanoic acid	ME159743	0.49	0.73	0.37	2.41	0.78	1.22
[FA dimethyl(13:0)] 2,5-dimethyl-2E-tridecenoic acid	ME159742	0.61	0.88	0.61	2.38	0.58	0.93
PG(P-16:0/15:1(9Z))	ME159682	0.65	0.65	0.38	2.25	0.62	1.03
Stealthin C	ME159752	0.71	1.14	0.50	2.06	0.32	1.27
(9Z)-Hexadecenoic acid	ME159597	0.78	0.90	0.66	1.95	0.69	1.03
Indole-5,6-quinone	ME159330	0.71	0.71	0.75	2.00	0.91	0.92
glutathione-sulfite	ME159495	0.86	1.19	0.62	2.80	0.08	0.45
CoA-glutathione	ME159444	0.58	0.63	0.46	2.53	NA	0.80
Sulmazole	ME159392	0.86	0.37	0.23	2.34	NA	0.70
UDP-glucose	ME159255	0.15	0.12	0.51	1.15	0.73	3.33
D-Fructose 1,6-bisphosphate	ME159252	1.05	0.49	0.86	1.27	0.12	2.22
3-acetyl pyridine adenine dinucleotide	ME159506	0.30	0.48	1.08	0.98	0.47	2.68
D-Sedoheptulose 7-phosphate	ME159301	0.35	0.29	1.74	0.71	0.39	2.52
L-Histidinol phosphate	ME159309	1.64	1.47	0.17	1.39	1.30	0.02
3-dimethylsulfoniopropionaldehyde	ME159660	1.12	0.99	NA	0.92	0.97	NA
Laudanosine	ME159434	1.22	1.21	NA	0.84	0.44	NA
2-Oxosuccinamate	ME159384	0.15	0.15	0.49	0.15	1.35	2.29
Nitrilotriacetic acid	ME159527	NA	NA	0.11	0.10	0.99	2.21
(R)-AMAA	ME159528	NA	NA	0.20	0.12	1.23	2.16
2-(sulfomethyl)thiazolidine-4-carboxylate	ME159395	0.50	0.24	0.42	0.76	1.74	2.33
Asp-Gln	ME159705	0.36	0.41	0.70	0.83	1.71	1.99
Glycylproline	ME159433	0.37	0.37	0.72	0.98	1.56	2.00
[PR] Tretinoin/All-Trans Retinoic Acid	ME159291	0.98	0.62	0.69	0.61	0.98	2.13
Maleamate	ME159548	0.76	0.67	0.88	0.28	1.39	2.02
Maleamate 2	ME159583	0.76	0.67	0.88	0.28	1.39	2.02
2-Oxoglutaramate	ME159305	0.22	0.20	0.71	0.26	2.14	2.48
3,6,8-Trimethylallantoin	ME159296	0.35	0.25	1.00	NA	1.36	2.04
4-(2-Aminophenyl)-2,4-dioxobutanoate	ME159293	0.39	0.26	0.90	NA	1.43	2.02
4-(2-Aminophenyl)-2,4-dioxobutanoate 2	ME159578	0.39	0.26	0.90	NA	1.43	2.02
2-Formaminobenzoylacetate	ME159300	0.50	0.42	1.04	0.26	1.48	2.31
Glu-Asp-Cys	ME159438	0.35	0.36	1.24	0.21	1.46	2.38
Progesterone	ME159344	0.35	0.38	0.77	0.40	1.62	2.48
N-Acetyl-L-glutamate 5-semialdehyde	ME159542	0.34	0.27	0.86	0.19	1.84	2.51
N-Acetyl-L-glutamate 5-semialdehyde 2	ME159592	0.34	0.27	0.86	0.19	1.84	2.51
5-Hydroxyectoine	ME159620	0.22	0.29	0.98	0.24	1.65	2.37
5-Phenyl-1,3-oxazinane-2,4-dione	ME159631	0.42	0.31	1.02	0.17	1.65	2.43
Iminoaspartate	ME159387	NA	NA	0.41	NA	1.21	1.38
cis-3-Chloroacrylic acid	ME159638	NA	NA	0.26	NA	1.89	0.85
Dichloroacetate	ME159639	NA	NA	0.34	NA	1.93	0.72
Cys-Met-Met-Phe	ME159525	NA	NA	0.09	0.20	1.74	1.36
[Fv Methyl,trimethoxy,hydrox] 3,4-Methylenedioxy-2,4,6-trimethoxy-beta-hydroxychalcone	ME159776	NA	NA	0.19	NA	1.67	1.14
Flaccidin B	ME159400	0.22	0.13	0.88	0.11	2.66	1.71
Phenol	ME159363	0.58	0.71	0.57	0.82	2.56	0.76
4-Nitroaniline	ME159463	0.80	0.92	1.26	0.52	1.95	0.56
Sulcatone	ME159414	0.76	0.65	1.02	0.87	1.65	1.05
L-Ala-L-Glu	ME159494	0.72	0.60	0.73	0.89	1.71	1.35
L-Ala-L-Glu 2	ME159652	0.72	0.60	0.73	0.89	1.71	1.35
4-Propylphenol	ME159510	0.48	0.87	0.76	0.76	2.04	1.09
[FA hydroxy(13:0)] 2-hydroxy-tridecanoic acid	ME159515	0.40	0.85	1.11	0.50	2.04	1.10
Cys-Thr-Ser-Tyr	ME159502	0.34	0.53	1.06	0.60	2.06	1.42
Hydroxymethylphosphonate	ME159671	0.66	0.63	0.69	0.47	2.02	1.53
N-oleoyl threonine	ME159771	NA	0.32	NA	1.74	NA	0.71
Diethofencarb	ME159521	NA	0.17	NA	2.32	0.36	1.15
UTP	ME159536	0.02	NA	NA	1.85	0.19	1.29
3-(ADP)-glycerate	ME159772	NA	0.17	0.13	1.60	0.50	1.47
CDP	ME159627	NA	NA	NA	1.45	0.38	1.17
Asn-Gly	ME159391	0.48	NA	NA	1.54	0.77	1.04
[PR] 2-methylbacteriohopane-32,33,34,35-tetrol	ME159762	0.57	0.57	NA	1.35	0.84	1.37
2-(alpha-D-Galactosyl)-sn-glycerol 3-phosphate	ME159779	NA	NA	NA	0.60	0.94	1.46
(-)-Medicocarpin	ME159526	NA	NA	NA	0.72	0.58	1.70
4-Nitrophenyl-3-ketovalidamine	ME159778	NA	NA	NA	0.59	1.27	1.14
PG(36:3)	ME159533	NA	NA	NA	0.98	1.11	0.91
PG(40:8)	ME159783	NA	NA	NA	1.07	1.17	0.76
[FA hydroxy,trihydroxy(3:0/2:0)] N-(1,3-dihydroxypropan-2-yl)-9S,11R,15S-trihydroxy-5Z,13E-prostadienoyl amine	ME159523	NA	0.12	NA	0.99	1.00	1.30
[FA (24:0)] 15Z-tetracosenoic acid	ME159626	NA	NA	NA	1.19	0.82	1.00
Asp-Gly-Tyr	ME159773	NA	NA	NA	0.85	1.04	1.10
Val-Asp-Ser	ME159785	NA	NA	NA	0.93	0.91	1.16
Leu-Asp-Gly	ME159532	NA	NA	NA	0.95	0.98	1.07
Asp-Gly-Ser	ME159780	NA	NA	NA	0.95	1.03	1.01
Leu-Ala-Asp	ME159774	NA	NA	NA	1.00	0.99	1.01
Asp-Met-Cys-Cys	ME159534	NA	NA	NA	0.98	0.99	1.03
Glu-Met-Cys-His	ME159531	NA	NA	NA	0.98	0.98	1.01
Asn-Asp-Asp-Pro	ME159775	NA	NA	NA	1.04	0.95	1.01
sinapoyltyramine	ME159784	NA	NA	NA	1.07	0.93	1.00
Melibiitol	ME159388	NA	NA	NA	1.01	0.90	1.09
Hymexazol O-glucoside	ME159777	NA	NA	NA	1.00	0.93	1.07
N-Acetylgalactosaminate	ME159781	NA	NA	NA	1.00	0.95	1.05
Pseudouridine	ME159629	0.37	0.27	0.09	0.67	1.83	1.26
Zoxazolamine	ME159519	0.26	0.55	0.35	0.54	1.81	1.57
2-(Acetamidomethylene)succinate	ME159625	NA	0.28	0.51	1.05	1.47	1.28
Glu-Ser	ME159757	0.09	0.09	0.02	1.01	1.72	1.51
CMP-N-acetylneuraminate	ME159619	0.05	0.06	0.06	2.10	1.50	1.91
dihomocitrate	ME159730	0.13	0.16	0.16	2.12	1.59	1.84
sn-Glycerol 3-phosphate	ME159277	0.13	0.15	0.16	1.78	1.51	2.27
[PI (18:0)] 1-octadecanoyl-sn-glycero-3-phospho-(1-myo-inositol)	ME159469	0.26	0.30	0.25	1.82	1.40	1.97
N-Acetylneuraminate	ME159302	0.21	0.18	0.25	1.91	1.44	2.01
(S)-Malate	ME159281	0.18	0.22	0.21	1.83	1.56	1.99
[PC acetyl(18:2)] 1-(9Z,12Z-octadecadienoyl)-2-acetyl-sn-glycero-3-phosphocholine	ME159767	0.28	0.72	0.21	1.82	0.99	1.98
Glutarylglycine	ME159746	0.22	0.32	0.26	1.88	1.04	2.28
UDP-N-acetyl-D-glucosamine	ME159278	0.30	0.35	0.30	1.92	1.12	2.01
A-Ketoglutaricacidoxime	ME159518	0.21	0.31	0.22	1.52	1.42	1.79
2,2-Iminodipropanoate	ME159440	0.34	0.34	0.28	1.61	1.46	1.97
N-hydroxyisoleucine	ME159734	0.30	0.26	0.25	1.49	1.52	1.96
4-Oxoglutaramate	ME159552	0.43	0.39	0.35	1.74	1.24	1.86
Succinate	ME159370	0.36	0.47	0.40	1.59	1.34	1.84
6-Acetyl-D-glucose	ME159677	0.40	0.40	0.40	1.53	1.49	1.78
6-Acetyl-D-glucose 2	ME159695	0.40	0.40	0.40	1.53	1.49	1.78
Sulfoacetaldehyde	ME159313	0.38	0.35	0.41	1.66	1.46	1.74
Sulfoacetaldehyde 2	ME159566	0.38	0.35	0.41	1.66	1.46	1.74
N2-Acetyl-L-aminoadipate	ME159371	0.53	0.39	0.44	1.34	1.41	1.89
N2-Acetyl-L-aminoadipate 2	ME159539	0.53	0.39	0.44	1.34	1.41	1.89
2-Aminomalonate semialdehyde	ME159517	0.34	0.47	0.39	1.21	1.31	1.84
n-Acetylasparagine	ME159769	0.31	0.45	0.58	1.17	1.19	1.84
D-Glyceraldehyde 3-phosphate	ME159575	0.40	0.40	0.63	0.96	1.89	1.72
nonulose 9-phosphate	ME159437	0.35	0.36	0.41	1.20	1.83	1.84
nonulose 9-phosphate 2	ME159787	0.35	0.36	0.41	1.20	1.83	1.84
Asp-Ser	ME159665	0.39	0.35	0.44	1.35	1.94	1.53
Lys-Asp	ME159668	0.37	0.35	0.45	1.23	1.97	1.64
Glu-Cys-Cys	ME159398	0.64	0.38	0.55	1.16	1.63	1.64
Glu-Cys-Cys 2	ME159522	0.64	0.38	0.55	1.16	1.63	1.64
N-Formyl-L-aspartate	ME159622	0.28	0.59	0.35	1.45	1.63	1.70
Ala-Asn-Asp	ME159737	0.43	0.57	0.48	1.49	1.50	1.54
Glycerophosphoglycerol	ME159708	0.48	0.55	0.51	1.41	1.45	1.61
PS(15:0/22:4(7Z,10Z,13Z,16Z))	ME159661	0.44	0.39	0.54	1.44	1.67	1.52
Asp-Asp	ME159442	0.42	0.43	0.47	1.40	1.63	1.66
Asp-Asp 2	ME159529	0.42	0.43	0.47	1.40	1.63	1.66
omega-Cyclohexylundecanoic acid	ME159732	0.40	0.51	0.41	1.37	1.71	1.61
Thr-Ala-Ala	ME159722	0.41	0.51	0.45	1.41	1.72	1.51
Cer(d18:2/16:0)	ME159738	0.24	0.16	0.26	1.34	1.51	1.46
N-(L-Arginino)succinate	ME159614	0.21	0.17	0.24	1.53	1.48	1.57
Arg-Leu-Val-Asn	ME159452	0.26	0.29	0.28	1.73	1.77	1.67
N-Acetyl-D-glucosamine 6-phosphate	ME159561	0.31	0.30	0.27	1.73	1.75	1.65
Asp-Leu-Lys-Lys	ME159467	0.30	0.35	0.35	1.59	1.75	1.66
myo-Inositol	ME159262	0.34	0.33	0.35	1.50	1.71	1.77
PS(19:1(9Z)/22:2(13Z,16Z))	ME159416	0.31	0.28	0.39	1.61	1.93	1.48
(S)-3-Methyl-2-oxopentanoic acid	ME159335	0.34	0.36	0.38	1.74	1.75	1.43
Ala-Asp	ME159690	0.16	0.16	0.17	1.23	2.33	1.94
Phosphodimethylethanolamine	ME159623	0.11	0.21	0.12	1.64	1.70	1.93
Hydantoin-5-propionate	ME159358	0.14	0.16	0.17	1.74	1.86	1.93
sn-glycero-3-Phospho-1-inositol	ME159711	0.18	0.21	0.18	1.73	1.87	1.82
Asn-Asp-Gly	ME159725	0.18	0.22	0.17	1.54	2.08	1.81
Ala-Asp-Asp	ME159430	0.07	0.07	0.07	1.63	2.26	1.90
Aspartyl-L-proline	ME159446	0.05	0.06	0.06	1.67	2.14	2.01
Brassicanal A	ME159749	0.52	0.80	0.46	0.95	0.51	2.76
[FA oxo(5:1/5:0/4:0)] (1R,2R)-3-oxo-2-(2Z-pentenyl)-cyclopentanebutanoic acid	ME159753	0.57	0.96	0.50	0.70	0.75	2.52
[FA oxo(7:0)] 2-oxo-heptanoic acid	ME159754	0.60	1.02	0.28	0.89	0.90	2.32
hydroxypyruvaldehyde phosphate	ME159640	0.30	0.19	0.59	1.53	0.77	2.08
Furfural diethyl acetal	ME159511	0.32	0.63	0.32	1.43	0.75	2.55
N-Glycolyl-D-glucosamine	ME159718	0.22	0.26	0.33	1.77	0.86	2.57
Aspidinol	ME159770	NA	0.63	0.30	0.93	0.37	1.89
Abscisic aldehyde	ME159624	0.19	0.74	0.21	1.01	1.03	2.02
Tauropine	ME159514	0.29	0.59	NA	1.37	0.66	2.09
[FA (22:0)] 13Z-docosenoic acid	ME159386	NA	0.83	0.59	1.51	1.07	1.01
LysoPE(0:0/20:2(11Z,14Z))	ME159654	0.32	0.27	0.18	2.27	0.96	1.72
L-Cysteate	ME159382	0.37	0.63	0.37	2.19	1.05	1.39
[PC (17:0)] 1-(10Z-heptadecenoyl)-sn-glycero-3-phosphocholine	ME159648	0.54	0.42	0.51	1.96	0.93	1.47
Tetracosanoic acid	ME159364	0.45	0.55	0.28	1.83	1.17	1.48
P-DPD	ME159642	0.78	0.44	0.84	1.60	0.75	1.59
6-Phospho-D-gluconate	ME159259	0.69	0.65	0.60	1.56	0.52	1.97
octulose 8-phosphate	ME159656	0.84	0.72	0.90	1.35	0.50	1.69
GDP-mannose	ME159261	0.76	0.73	0.78	1.54	0.39	1.81
N-Glycosyl-L-asparagine	ME159420	0.86	0.80	0.83	1.57	0.34	1.60
(+/-)-6-Hydroxy-3-oxo-alpha-ionone	ME159758	0.46	0.84	0.50	1.65	0.82	1.72
[FA (8:1)] 2Z-octenoic acid	ME159745	0.55	0.81	0.42	1.57	0.70	1.94
FAD	ME159283	0.43	0.63	0.54	1.60	0.98	1.82
[FA trihydroxy(4:0)] 2,3,4-trihydroxy-butanoic acid	ME159292	0.62	0.41	0.56	1.58	0.90	1.92
[FA (18:2)] 9S-hydroperoxy-10E,12Z-octadecadienoic acid	ME159345	0.82	0.90	0.63	1.51	0.72	1.42
momilactone A	ME159450	0.74	0.81	0.69	1.72	0.79	1.25
Traumatic acid	ME159618	0.49	0.89	0.38	2.11	0.50	1.62
16-hydroxypalmitate	ME159747	0.65	0.97	0.55	1.72	0.64	1.47
Cyclohexane-1,3-dione	ME159741	0.61	0.88	0.45	1.88	0.71	1.46
N-Acetyl-D-glucosamine 1,6-bisphosphate	ME159413	0.78	0.67	0.53	1.81	0.58	1.63
3-Phosphonopyruvate	ME159362	0.56	0.68	0.58	1.82	0.80	1.56
UMP	ME159320	0.63	0.61	0.47	2.05	0.69	1.56
Dodecanedioic acid	ME159768	0.32	0.98	1.25	0.67	0.80	1.97
Neuraminic acid	ME159766	0.34	0.85	1.09	1.26	0.68	1.78
cis-1,2-Dihydro-3-ethylcatechol	ME159634	1.04	1.08	0.90	0.34	0.93	1.71
N-Acetylmuramate	ME159380	0.78	1.20	0.96	0.24	0.58	1.99
3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestan-26-al	ME159379	0.99	1.51	1.33	0.28	0.62	1.27
7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one	ME159621	0.71	1.43	1.05	0.57	0.64	1.59
PI(36:2)	ME159461	0.99	1.11	1.01	1.00	0.90	NA
3-hydroxyacyl group of bacterial toxin	ME159611	1.41	1.96	1.24	0.32	0.39	0.67
[PE (16:1)] 1-(1Z-hexadecenyl)-sn-glycero-3-phosphoethanolamine	ME159724	1.35	1.67	1.08	0.36	0.77	0.77
2-Deoxymugineic acid	ME159439	1.70	1.71	0.95	0.42	0.48	0.63
N-Succinyl-L-glutamate	ME159598	1.49	1.72	0.94	0.48	0.49	0.88
N-Succinyl-L-glutamate 2	ME159630	1.49	1.72	0.94	0.48	0.49	0.88
ADP	ME159322	1.55	1.51	1.27	0.73	0.25	0.68
Indoxylsulfate	ME159650	1.61	1.27	1.27	0.82	0.25	0.53
2-hydroxymethanesulfonate	ME159492	1.25	1.68	1.44	0.46	0.48	0.69
Homogentisate	ME159356	1.28	1.48	1.30	0.72	0.38	0.43
PA(36:3)	ME159676	1.46	1.43	1.38	0.70	0.48	0.56
PA(36:4)	ME159672	1.51	1.44	1.33	0.72	0.50	0.49
[PE (18:0/18:2)] 1-octadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine	ME159571	1.35	1.33	1.41	0.66	0.57	0.68
alpha-D-Glucosamine 1-phosphate	ME159329	1.45	1.45	1.40	0.50	0.58	0.61
alpha-D-Glucosamine 1-phosphate 2	ME159352	1.45	1.45	1.40	0.50	0.58	0.61
PI(36:4)	ME159702	1.28	1.42	1.41	0.61	0.52	0.65
Fagomine	ME159459	1.34	1.50	1.40	0.57	0.57	0.61
Fagomine 2	ME159703	1.34	1.50	1.40	0.57	0.57	0.61
[PS (18:0/22:6)] 1-octadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoserine	ME159311	1.51	1.37	1.61	0.56	0.50	0.45
2-Oxoglutarate	ME159275	1.26	1.42	1.56	0.59	0.62	0.55
[FA (18:2)] 9Z,11E-octadecadienoic acid	ME159349	1.36	1.53	1.58	0.56	0.46	0.50
Docosahexaenoicacid	ME159604	0.91	1.10	1.27	1.13	0.87	0.73
L-Noradrenaline	ME159376	1.02	1.41	0.97	0.94	0.72	0.95
GDP-L-fucose	ME159334	1.20	1.24	1.13	0.91	0.53	0.99
Oxalate	ME159269	1.15	1.22	1.00	1.06	0.59	0.98
2-trans,6-trans-Farnesal	ME159481	1.03	1.27	1.20	0.85	0.87	0.77
4-Amino-4-deoxychorismate	ME159608	0.91	1.20	1.29	0.83	0.88	0.90
Arg-Cys-Gln-Tyr	ME159474	0.98	1.18	1.24	0.87	0.89	0.85
Demethyltorosaflavone D	ME159698	1.14	1.25	1.38	0.73	0.73	0.77
homovanillate	ME159369	1.04	1.34	1.25	0.76	0.69	0.92
ancymidol	ME159458	1.10	1.23	1.32	0.61	1.03	0.71
PE(22:4(7Z,10Z,13Z,16Z)/P-18:0)	ME159589	1.15	1.22	1.27	0.67	1.01	0.68
[PC (15:1)] 1-(1Z-pentadecenyl)-sn-glycero-3-phosphocholine	ME159707	1.14	1.29	1.08	0.60	0.88	1.01
L-Erythrulose	ME159410	1.35	1.12	1.37	0.68	0.79	0.69
Pyruvate	ME159258	1.37	1.21	1.30	0.67	0.77	0.68
2-Hydroxy-1,3-dimethoxy-8,9-methylenedioxycoumestan	ME159679	1.27	1.26	1.16	0.72	0.81	0.77
Indole-3-acetaldehyde	ME159326	1.27	1.27	1.14	0.71	0.87	0.73
3-(4-Hydroxyphenyl)pyruvate	ME159351	1.20	1.36	1.08	0.71	0.80	0.85
Phenolsulfonphthalein	ME159453	1.21	1.33	1.14	0.73	0.80	0.79
Met-Gly-Arg	ME159415	1.36	1.20	1.14	0.75	0.73	0.86
(R)-2,3-Dihydroxy-3-methylbutanoate	ME159314	1.29	1.20	1.23	0.72	0.76	0.81
3beta-Hydroxyandrost-5-en-17-one 3-sulfate	ME159553	1.26	1.15	1.04	0.78	0.88	0.89
Benzofuran	ME159673	1.23	1.17	1.17	0.74	0.84	0.86
(S)-1-Pyrroline-5-carboxylate	ME159298	1.45	1.06	1.27	0.73	0.56	0.94
Phenylacetylglycine	ME159273	1.13	1.25	1.52	0.73	0.53	0.85
Sorbitol 6-phosphate	ME159579	1.37	1.38	1.24	0.74	0.50	0.77
Camoensine	ME159683	1.25	1.27	1.25	0.85	0.51	0.87
Cardiospermin	ME159449	1.16	1.27	1.32	0.88	0.56	0.73
Glu-Met-Met-His	ME159455	1.10	1.22	1.25	0.30	1.31	0.83
Glutathione	ME159263	1.21	1.19	1.31	0.25	1.24	0.80
Glu-Asp-Met	ME159504	0.76	1.19	1.55	NA	0.44	0.61
[FA (20:0/2:0)] Eicosanedioic acid	ME159478	0.94	1.16	0.92	NA	0.77	1.21
N-(2-hydroxypentadecanoyl)-4,8-sphingadienine	ME159717	1.12	1.32	1.03	NA	0.49	0.70
penem CGP31608	ME159484	0.96	1.21	1.25	NA	0.77	0.82
penem CGP31608 2	ME159513	0.96	1.21	1.25	NA	0.77	0.82
LysoPC(20:3(5Z,8Z,11Z))	ME159385	0.55	1.80	NA	0.84	0.70	1.09
Phthalate	ME159284	0.65	1.53	0.86	1.05	0.73	1.17
1,4-Bis(2-ethylhexyl) sulfosuccinate	ME159516	0.76	1.77	0.77	0.63	1.00	1.07
Dehydrojuvabione	ME159503	1.08	1.67	0.69	0.55	0.89	1.13
dATP	ME159297	1.23	0.90	0.69	1.73	0.17	1.28
(R)-S-Lactoylglutathione	ME159346	0.89	0.99	0.97	1.68	0.43	1.04
Muramic acid	ME159475	1.06	0.97	1.02	1.48	0.13	1.34
Muramic acid 2	ME159662	1.06	0.97	1.02	1.48	0.13	1.34
O-Acetyl-L-homoserine	ME159339	1.08	0.95	0.96	1.51	0.32	1.19
O-Acetyl-L-homoserine 2	ME159547	1.08	0.95	0.96	1.51	0.32	1.19
His-Met-Trp-Ser	ME159486	0.88	1.13	0.98	0.91	NA	1.14
indole-3-acetyl-valine	ME159674	1.21	1.16	0.94	0.61	NA	0.92
PS(P-18:0/17:2(9Z,12Z))	ME159645	1.77	1.16	0.83	1.04	0.51	0.68
Methyl 2-(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)-p-toluate	ME159696	1.22	1.31	0.97	1.59	0.39	0.52
Ascorbate	ME159354	1.39	1.61	0.86	0.90	0.39	0.84
3-carboxy-4-methyl-5-propyl-2-furanpropanoic acid	ME159733	1.13	1.45	0.69	1.17	0.48	1.07
[PS (18:0)] 1-octadecanoyl-sn-glycero-3-phosphoserine	ME159501	1.11	1.68	0.71	1.26	0.24	1.00
N-Acetyl-L-phenylalanine	ME159538	1.63	0.77	0.50	0.96	0.88	1.26
N-Acetyl-L-leucine	ME159394	1.46	0.68	0.59	0.95	0.79	1.53
N-Acetyl-L-leucine 2	ME159701	1.46	0.68	0.59	0.95	0.79	1.53
[FA (14:0/2:0)] Tetradecanedioic acid	ME159393	1.59	0.74	1.15	0.59	0.65	1.27
Sucrose	ME159251	1.59	0.46	1.44	0.52	0.68	1.31
Icosadienoic acid	ME159556	0.62	0.57	1.23	1.48	1.12	0.94
perchlorate	ME159407	0.67	0.55	1.20	1.66	0.75	1.18
[PS (10:0)] 1,2-didecanoyl-sn-glycero-3-phosphoserine	ME159761	0.61	1.22	0.77	0.68	0.99	1.74
PS(13:0/12:0)	ME159748	0.68	1.03	0.88	0.67	0.94	1.80
3-Hydroxydodecanedioicacid	ME159760	0.62	1.23	0.58	0.73	0.89	1.95
10-Oxodecanoate	ME159763	0.53	1.07	0.54	0.95	0.87	2.04
[FA (10:1/2:0)] 2E-Decenedioic acid	ME159764	0.57	1.19	0.58	0.95	0.80	1.92
[FA] Methyl jasmonate	ME159617	0.49	0.86	0.49	1.11	1.11	1.94
N3-fumaramoyl-L-2,3-diaminopropanoate	ME159462	0.63	0.72	0.65	0.98	1.11	1.90
[FA oxo(8:0)] 3-oxo-octanoic acid	ME159512	0.49	0.96	0.31	1.29	1.12	1.84
[FA oxo(12:1)] 12-oxo-10E-dodecenoic acid	ME159381	0.54	0.89	0.42	1.22	0.88	2.05
9-Oxononanoic acid	ME159616	0.59	1.00	0.62	1.28	0.84	1.67
Hexanoic acid	ME159286	0.53	0.95	0.51	1.31	0.85	1.85
[FA hydroxy(18:0)] 2S-hydroxy-octadecanoic acid	ME159751	0.71	1.12	0.52	1.40	0.75	1.51
[PR] 9-Hydroxy-helminthosporol	ME159735	0.80	1.04	0.45	1.27	0.94	1.51
[FA hydroxy(11:1)] 2-hydroxy-10-undecenoic acid	ME159649	0.98	0.77	0.67	1.26	0.76	1.56
ethyl-(2R)-methyl-(3S)-hydroxybutanoate	ME159756	0.60	1.04	0.77	1.03	0.78	1.77
10-Hydroxydecanoic acid	ME159728	0.66	0.83	0.76	1.21	0.95	1.59
1,6,6-Trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one	ME159727	0.76	0.95	0.75	1.08	0.88	1.58
(1S,2R,4S)-(-)-Bornyl acetate	ME159714	0.82	0.95	0.40	1.05	1.37	1.41
Farnesoic acid	ME159403	1.16	0.83	0.36	1.20	1.23	1.22
gamma-L-Glutamyl-L-cysteinyl-beta-alanine	ME159456	0.59	0.66	0.88	1.54	1.05	1.28
L-Dehydroascorbate	ME159340	0.51	0.54	0.51	1.70	1.20	1.54
PE(14:0/22:5(4Z,7Z,10Z,13Z,16Z))	ME159559	0.60	0.57	0.67	1.68	1.12	1.36
5D-5-O-Methyl-2,3,5/4,6-pentahydroxycyclohexanone	ME159447	0.68	0.74	0.70	1.52	1.00	1.37
Citrate	ME159257	0.80	0.66	0.62	1.49	1.02	1.41
2-Hydroxybutane-1,2,4-tricarboxylate	ME159321	0.68	0.66	0.56	1.49	1.15	1.46
3-Sulfolactate	ME159367	0.62	0.78	0.43	1.54	1.12	1.52
L-Cysteinylglycinedisulfide	ME159402	0.82	0.56	0.80	1.16	1.40	1.27
[FA (17:0)] heptadecanoic acid	ME159490	0.59	0.79	0.60	1.15	1.42	1.45
Orotidine	ME159285	0.61	0.81	0.77	1.16	1.19	1.46
[PR] Citronellyl acetate	ME159487	0.60	0.78	0.74	1.06	1.29	1.53
(S)-Lactate	ME159348	0.73	0.82	0.82	1.23	1.21	1.19
Icosatrienoic acid	ME159609	0.67	0.90	0.73	1.19	1.23	1.30
Orotate(Fragment)	ME159607	0.71	0.88	0.83	1.07	1.19	1.33
PI(38:4)	ME159669	0.74	0.70	0.77	1.43	1.18	1.20
2,7-Anhydro-alpha-N-acetylneuraminic acid	ME159706	0.68	0.77	0.79	1.23	1.20	1.33
dXMP	ME159471	0.60	0.71	0.78	1.29	1.25	1.37
3-Methylbutanoic acid	ME159588	0.72	0.76	0.69	1.36	1.15	1.33
[FA methyl(14:0)] 12-methyl-tetradecanoic acid	ME159739	0.62	0.83	0.61	1.35	1.21	1.37
ethylpyruvate	ME159468	0.60	0.71	0.58	1.54	1.31	1.26
Cyclic ADP-ribose	ME159546	0.62	0.55	0.69	1.45	1.24	1.45
[PE (18:0/20:4)] 1-octadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoethanolamine	ME159307	0.68	0.60	0.64	1.36	1.46	1.27
Ala-Asp-Ser	ME159659	0.66	0.59	0.52	1.24	1.48	1.52
Fumarate	ME159272	0.62	0.67	0.64	1.30	1.39	1.39
L-Aspartate	ME159267	0.64	0.67	0.66	1.30	1.31	1.43
ethanedisulfonate	ME159408	0.72	0.60	0.69	1.21	1.33	1.46
HEPES	ME159409	0.70	0.58	0.58	1.31	1.36	1.48
S-Sulfo-L-cysteine	ME159336	1.12	1.18	0.61	1.53	1.05	0.52
3-Phospho-D-glyceroyl phosphate	ME159289	1.50	0.73	0.69	1.23	1.23	0.62
L-2-Amino-3-oxobutanoic acid	ME159555	1.20	1.10	0.51	1.09	1.21	0.89
[PS (20:4)] 1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoserine	ME159421	1.08	1.01	0.77	1.12	1.30	0.72
Ala-Ser-His	ME159736	0.54	0.71	1.20	0.88	1.09	1.58
D-Alanyl-D-alanine	ME159377	0.75	1.10	1.26	0.64	1.01	1.25
Diethyl adipate	ME159508	0.62	1.07	1.20	0.67	1.28	1.16
Acetyl-CoA	ME159308	1.29	1.15	0.99	0.83	0.47	1.27
D-Ribose 5-phosphate	ME159260	1.18	1.13	1.03	0.61	0.64	1.41
3-Phospho-D-glycerate	ME159253	1.08	0.72	1.22	1.11	0.47	1.40
Phosphoenolpyruvate	ME159254	1.08	0.73	1.13	1.21	0.39	1.46
D-Glycerate	ME159303	0.91	0.78	1.19	0.99	0.87	1.25
Met-Met-Pro-Tyr	ME159644	1.05	0.68	1.08	1.14	0.71	1.24
2(alpha-D-Mannosyl)-D-glycerate	ME159361	0.68	0.81	1.43	0.73	0.76	1.58
XTP	ME159331	0.77	0.77	1.41	0.71	0.77	1.57
D-Xylulose	ME159562	0.85	0.82	1.40	0.72	0.75	1.47
(S)-Methylmalonate semialdehyde	ME159564	0.83	0.80	1.40	0.73	0.77	1.47
2-Acetolactate	ME159567	0.86	0.84	1.46	0.72	0.74	1.37
2-Butenoate	ME159689	0.80	0.82	1.51	0.73	0.73	1.42
2-Hydroxy-2,4-pentadienoate	ME159572	0.82	0.81	1.46	0.71	0.74	1.46
D-Glucose	ME159264	0.83	0.82	1.50	0.68	0.71	1.45
alpha-D-Glucose	ME159337	0.95	1.00	1.46	0.93	0.68	0.98
Mesaconate	ME159372	0.88	1.16	1.25	0.90	0.72	1.09
D-Galactose	ME159373	0.82	1.10	1.18	0.75	0.82	1.39
(S)(+)-Allantoin	ME159613	0.85	1.24	1.20	0.74	0.71	1.26
(2S)-2-{[1-(R)-Carboxyethyl]amino}pentanoate	ME159498	0.91	0.93	1.33	0.91	0.53	1.39
(2S)-2-{[1-(R)-Carboxyethyl]amino}pentanoate 2	ME159687	0.91	0.93	1.33	0.91	0.53	1.39
L-2-Aminoadipate 6-semialdehyde	ME159581	0.96	0.97	1.16	0.87	0.78	1.27
5-Acetamidopentanoate	ME159306	1.09	0.96	1.17	0.78	0.68	1.33
5-Acetamidopentanoate 2	ME159359	1.09	0.96	1.17	0.78	0.68	1.33
2-oxosuberate	ME159406	1.02	0.80	1.36	0.80	0.77	1.25
2-Dehydro-D-xylonate	ME159483	1.07	0.99	1.30	0.76	0.73	1.15
2-Dehydro-D-xylonate 2	ME159667	1.07	0.99	1.30	0.76	0.73	1.15
5beta-Cyprinolsulfate	ME159287	1.25	0.57	0.95	0.88	1.11	1.24
4-Methylpentanal	ME159294	1.04	0.71	0.89	0.67	1.41	1.26
Vinylacetylglycine	ME159425	0.97	0.84	0.69	0.75	1.20	1.55
Vinylacetylglycine 2	ME159657	0.97	0.84	0.69	0.75	1.20	1.55
Glycerol	ME159290	1.57	1.00	0.93	0.67	1.12	0.71
dTDP-3-oxo-4,6-dideoxy-alpha-D-glucose	ME159399	1.25	0.76	1.04	0.92	1.03	0.99
herbicide 14A	ME159643	1.39	0.88	1.04	0.95	0.98	0.76
Capryloylglycine	ME159401	1.44	0.94	0.98	0.84	0.86	0.94
Capryloylglycine 2	ME159499	1.44	0.94	0.98	0.84	0.86	0.94
Cantleyine	ME159397	1.52	0.82	0.68	1.12	0.75	1.10
LPA(18:2(9Z,12Z)/0:0)	ME159537	1.41	0.77	0.82	0.87	0.71	1.01
Obliquine	ME159641	1.02	0.71	0.95	1.10	1.18	0.75
[FA (22:4)] 7Z,10Z,13Z,16Z-docosatetraenoic acid	ME159365	0.70	0.86	0.65	1.48	1.14	1.04
PI(38:5)	ME159693	0.81	0.85	0.91	1.34	1.14	0.95
N-Acetyl-D-glucosamine	ME159325	0.79	0.79	0.86	1.27	1.23	1.06
PE(20:2(11Z,14Z)/18:3(6Z,9Z,12Z))	ME159582	0.79	0.80	0.93	1.28	1.19	1.01
[FA (11:1)] 10-undecenoic acid	ME159454	0.79	0.87	1.00	1.33	0.76	1.24
L-Glutamate 5-semialdehyde	ME159590	0.87	0.94	0.97	1.25	0.67	1.30
L-Glutamate 5-semialdehyde 2	ME159606	0.87	0.94	0.97	1.25	0.67	1.30
ADP ribose 1,2-phosphate	ME159684	0.99	1.00	0.88	1.23	0.67	1.24
GMP	ME159332	0.96	0.97	0.90	1.18	0.78	1.21
Gentisate aldehyde	ME159299	1.01	0.84	0.94	1.24	0.83	1.15
phosphinomethylmalate	ME159653	1.01	0.85	0.88	1.25	0.75	1.27
[FA oxo(4:0)] 11-oxo-5Z,9,12E,14E-prostatetraenoic acid	ME159316	0.92	0.86	0.72	1.15	0.91	1.45
2-Oxoadipate	ME159587	0.88	0.93	0.86	1.07	0.92	1.33
4-Hydroxyhexan-3-one	ME159451	0.87	0.95	0.79	1.13	0.89	1.38
[FA (14:2)] 5,8-tetradecadienoic acid	ME159715	0.91	1.06	0.70	1.26	0.97	1.14
Quassin	ME159485	0.86	1.08	0.77	1.27	0.84	1.28
[FA (18:1)] 9Z-octadecenoic acid	ME159323	0.99	0.97	0.80	1.12	0.90	1.22
Tetradecanoic acid	ME159279	0.93	1.08	0.76	1.14	0.86	1.23
Ethyl (R)-3-hydroxyhexanoate	ME159744	0.66	0.97	0.81	1.32	0.92	1.32
Docosanoic acid	ME159605	0.79	0.97	0.63	1.43	0.95	1.23
Otonecine	ME159429	0.95	0.92	0.55	1.39	0.97	1.33
Butanoic acid	ME159318	0.83	0.79	0.89	1.35	0.96	1.17
Glu-Leu	ME159441	0.83	0.84	0.79	1.21	1.10	1.24
Pentanoate	ME159436	0.84	0.84	0.87	1.22	0.98	1.25
Benzoate	ME159256	1.01	0.83	0.77	1.27	0.96	1.17
2-Butyne-1,4-diol	ME159655	0.88	0.76	0.75	1.39	1.00	1.24
[FA hydroxy(20:4)] 15S-hydroxy-5Z,8Z,11Z,13E-eicosatetraenoic acid	ME159541	0.98	0.76	0.64	1.41	0.93	1.27
S-(Formylmethyl)glutathione	ME159635	0.78	1.00	0.99	1.48	0.78	0.98
CAI-1	ME159417	1.02	0.92	0.81	1.53	0.75	0.97
[GP (20:4)] 1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphate	ME159405	1.07	0.81	0.80	1.52	0.81	0.99
[FA (11:0)] undecanoic acid	ME159419	0.93	0.86	0.79	1.44	0.91	1.06
8-keto-7-aminoperlagonate	ME159726	0.85	1.07	0.79	1.39	0.84	1.06
[FA (20:0)] 11Z-eicosenoic acid	ME159591	0.90	0.99	0.78	1.50	0.84	0.98
10-oxogeranial	ME159615	0.72	1.19	0.80	1.21	0.96	1.11
phlorisobutyrophenone	ME159509	0.68	1.19	0.80	1.30	0.91	1.12
[FA (20:0)] eicosanoic acid	ME159366	0.95	1.18	0.71	1.14	0.93	1.09
trans-4-Hydroxycyclohexanecarboxylate	ME159489	0.93	1.23	0.75	1.18	0.94	0.98
(9Z)-Tetradecenoic acid	ME159740	0.93	1.28	0.79	1.22	0.63	1.14
Ethyl 3-oxohexanoate	ME159720	1.00	1.21	0.87	1.08	0.72	1.11
N-Butyryl-L-homoserine lactone	ME159680	1.04	1.04	0.81	1.24	0.91	0.96
N-Butyryl-L-homoserine lactone 2	ME159716	1.04	1.04	0.81	1.24	0.91	0.96
2-Octenedioicacid	ME159704	0.94	1.06	0.95	1.14	0.91	1.01
LPA(0:0/18:2(9Z,12Z))	ME159580	1.06	1.07	0.88	1.11	0.85	1.02
Linoleate	ME159586	1.05	1.10	0.87	1.34	0.72	0.92
Cholesterolsulfate	ME159686	1.08	1.10	0.97	1.16	0.77	0.92
N-Undecanoylglycine	ME159500	0.96	1.19	0.96	1.20	0.74	0.95
N-Undecanoylglycine 2	ME159723	0.96	1.19	0.96	1.20	0.74	0.95
(4E)-2-Oxohexenoic acid	ME159491	0.75	1.00	0.97	1.05	0.82	1.41
[FA methyl(6:0)] 2-methyl-hexanoic acid	ME159497	0.76	1.05	0.85	1.06	0.94	1.34
3-Dehydroquinate	ME159374	0.73	1.00	0.97	1.03	0.97	1.30
Nonanoic acid	ME159496	0.78	1.08	0.92	0.97	0.99	1.25
[FA hydroxy(11:2/11:2)] 2R,9R-dihydroxy-3S,4S,7S,8S-diepoxy-5E,10-undecadien-1-ol	ME159759	0.63	1.19	0.95	1.12	0.70	1.42
Diethyl 2-methyl-3-oxosuccinate	ME159493	0.82	1.10	1.04	1.09	0.74	1.21
Hydroxypyruvate	ME159383	0.63	1.14	1.09	1.09	0.79	1.26
[FA dioxo(8:0)] 4,7-dioxo-octanoic acid	ME159507	0.67	1.06	0.98	0.84	1.11	1.34
Phenylacetaldehyde	ME159610	0.66	0.90	0.96	0.82	1.13	1.52
Cys-Met-Pro-His	ME159464	0.84	0.97	0.90	0.88	0.93	1.48
beta-D-Glucose	ME159353	0.90	1.03	0.91	0.69	0.95	1.52
D-Mannose	ME159355	0.89	1.03	0.98	0.73	0.90	1.42
Abscisic acid glucose ester	ME159368	0.87	1.12	0.73	0.90	0.84	1.55
Hexadecanoic acid	ME159276	0.95	1.08	0.71	0.87	0.98	1.41
Octadecanoic acid	ME159603	0.93	1.11	0.67	0.94	0.94	1.40
5-Hydroxycotinine	ME159601	0.93	1.10	0.81	0.77	1.39	0.99
Glu-Glu	ME159488	0.73	0.96	0.90	0.87	1.28	0.99
Glu-Glu 2	ME159530	0.73	0.96	0.90	0.87	1.28	0.99
Sinapoyl aldehyde	ME159549	1.24	1.10	1.00	0.82	1.09	0.69
PS(40:8)	ME159647	1.08	0.83	1.05	0.83	1.29	0.86
3,4-dihydroxybenzylamine	ME159426	1.10	1.05	1.17	0.68	1.09	0.91
[ST hydrox] 3alpha,7alpha-Dihydroxy-5beta-cholan-24-oic Acid	ME159568	1.04	1.02	1.12	0.86	1.14	0.82
12-Hydroxydodecanoic acid	ME159404	1.16	0.85	0.93	1.04	0.90	1.12
Urea-1-carboxylate	ME159554	1.07	0.98	0.92	1.01	0.86	1.17
Salicylaldehyde	ME159633	1.00	0.90	1.00	1.06	0.90	1.13
2-Hydroxyethanesulfonate	ME159328	0.95	0.95	0.97	1.06	0.86	1.21
2-Hydroxyethanesulfonate 2	ME159576	0.95	0.95	0.97	1.06	0.86	1.21
[FA hydroxy(6:0)] 4-hydroxy-hexanoic acid	ME159480	0.82	1.01	1.04	1.20	0.95	0.97
D-Xylonolactone	ME159347	0.87	0.97	1.00	1.06	1.03	1.06
alpha-(Methylenecyclopropyl)glycine	ME159670	0.95	0.90	1.03	1.08	0.99	1.05
LPA(0:0/18:1(9Z))	ME159577	0.98	0.98	1.02	1.10	0.93	1.00
D-Proline	ME159304	0.99	0.86	0.92	1.13	0.98	1.13
Decanoic acid	ME159268	0.88	0.92	0.90	1.23	0.98	1.09
[FA (20:4)] 5Z,8Z,11Z,14Z-eicosatetraenoic acid	ME159584	0.87	0.90	0.99	1.21	0.98	1.05
(R)-3-Hydroxybutanoate	ME159324	0.97	0.96	0.89	1.09	1.14	0.96
3-sulfopropanoate	ME159432	0.93	0.91	0.79	1.02	1.21	1.13
Sulfoacetate	ME159563	0.94	0.91	0.82	1.09	1.12	1.12
[FA methyl(19:0/2:0)] 13-methylnonadecane-1,2-diol	ME159423	0.93	0.88	0.97	0.79	1.16	1.26
Oxoamide	ME159558	0.91	0.85	0.90	0.85	1.26	1.23
[6]-Gingerol	ME159482	0.88	1.09	0.98	0.82	1.03	1.20
7E,9E,11-Dodecatrienyl acetate	ME159713	0.95	1.09	0.98	0.80	1.08	1.10
L-Aspartate 4-semialdehyde	ME159317	0.93	0.88	0.89	0.94	1.05	1.31
Arecoline	ME159422	0.94	0.89	1.01	0.95	1.02	1.19
[FA (8:0)] octanoic acid	ME159282	0.81	0.98	0.92	0.98	1.09	1.21
Monomethyl sulfate	ME159465	0.85	0.99	0.96	0.95	1.09	1.16
4-Methylene-L-glutamate	ME159445	0.91	0.98	0.87	1.04	1.01	1.19
L-Rhamnose	ME159333	0.95	0.98	0.93	0.97	1.02	1.15
[ST (4:0/4:0/4:0)] (5Z,7E)-(1S,3R,20R,22S)-24a-homo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol	ME159470	0.88	1.03	0.95	0.99	1.03	1.12
4-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde	ME159375	0.76	1.05	1.05	0.93	1.06	1.15
5-Hydroxyisourate	ME159612	0.69	1.00	0.94	1.01	1.14	1.21
Gentisyl alcohol	ME159710	0.79	0.91	0.95	1.03	1.19	1.12
L-Glycericacid	ME159651	1.17	0.95	0.87	0.88	0.90	1.24
[FA trihydroxy(18:1)] 9S,12S,13S-trihydroxy-10E-octadecenoic acid	ME159341	1.05	1.13	0.97	0.86	1.02	0.97
Glycochenodeoxycholate	ME159594	0.94	1.06	1.08	0.89	1.03	0.99
PIPES	ME159700	0.99	1.08	1.02	0.91	1.01	0.99
Botrydial	ME159729	0.93	1.18	1.02	0.87	0.99	1.00
[FA (13:2)] 3E,5E-tridecadienoic acid	ME159476	0.93	1.12	1.02	0.89	0.95	1.09
Vanilpyruvicacid	ME159448	1.00	1.09	0.86	1.01	1.03	1.01
5-Hydroxypentanoate	ME159675	1.12	1.08	0.93	0.98	0.91	0.98
Apiole	ME159427	1.07	1.03	1.02	1.05	0.95	0.89
1,2-dioctanoyl-1,2,6-hexanetriol	ME159685	1.03	1.05	0.94	1.04	1.01	0.93
1-Aminocyclopropane-1-carboxylate	ME159570	1.05	1.04	0.95	0.95	1.00	1.00
1-Aminocyclopropane-1-carboxylate 2	ME159585	1.05	1.04	0.95	0.95	1.00	1.00
2-Dehydro-3-deoxy-L-arabinonate	ME159574	1.05	1.05	0.98	0.97	1.02	0.93
(3R)-beta-Leucine	ME159319	1.06	1.02	0.97	0.99	1.01	0.95
MG(0:0/24:1(15Z)/0:0)	ME159664	1.10	1.00	1.08	1.01	0.80	1.01
Tetranor-PGE1	ME159692	0.98	1.02	1.14	0.95	0.88	1.03
[GP (16:0)] 1-hexadecanoyl-2-sn-glycero-3-phosphate	ME159550	1.03	0.92	1.07	1.01	0.93	1.05
[GP (18:0)] 1-octadecanoyl-2-sn-glycero-3-phosphate	ME159557	1.04	0.97	1.11	0.98	0.90	0.99
2-Ethylhexyl phthalate	ME159411	1.16	0.99	0.96	0.94	0.89	1.06
LPA(0:0/18:0)	ME159545	1.17	0.98	1.01	0.89	0.92	1.04
[FA (13:0/2:0)] Tridecanedioic acid	ME159431	1.02	1.00	1.07	0.84	0.98	1.09
3-Dehydrocarnitine	ME159543	1.11	0.90	0.95	0.90	0.99	1.13
(S)-2-Aceto-2-hydroxybutanoate	ME159310	1.05	0.95	1.00	0.95	0.95	1.11
[FA oxo,amino(6:0)] 3-oxo-5S-amino-hexanoic acid	ME159315	1.05	0.97	0.97	0.89	1.00	1.12
[FA oxo,amino(6:0)] 3-oxo-5S-amino-hexanoic acid 2	ME159360	1.05	0.97	0.97	0.89	1.00	1.12
metabolite 1	ME159466	1.08	1.25	0.90	0.92	0.99	0.86
5-Dehydro-4-deoxy-D-glucarate	ME159338	1.05	1.10	1.07	0.86	0.85	1.07
Phenol sulfate	ME159691	1.12	1.16	1.03	0.78	0.89	1.02
N-Formyl-L-methionine	ME159602	1.05	1.24	1.02	0.74	1.04	0.90
(6Z)-Octadecenoic acid	ME159457	1.05	1.17	1.07	0.94	0.88	0.89
Quinate	ME159350	1.08	1.21	1.05	0.85	0.92	0.90
[ST hydrox] 3alpha-hydroxy-5alpha-androstan-17-one 3-sulfate	ME159712	1.03	1.19	1.03	0.86	0.96	0.93
LPA(0:0/16:0)	ME159573	1.13	1.12	1.10	0.87	0.93	0.85
Phenylpyruvate	ME159266	1.11	1.13	1.17	0.76	0.98	0.85
Xylobiose	ME159755	0.33	0.57	0.93	NA	NA	1.44
metabolite 2	ME159646	0.35	0.24	2.12	0.26	0.30	1.55
N4-(Acetyl-beta-D-glucosaminyl)asparagine	ME159565	1.05	1.01	2.02	0.33	0.55	1.04
N4-(Acetyl-beta-D-glucosaminyl)asparagine 2	ME159569	1.05	1.01	2.02	0.33	0.55	1.04
2,3,5-Trihydroxytoluene	ME159658	0.71	0.63	2.00	0.54	0.69	1.44
L-Hypoglycin	ME159412	0.89	0.75	1.84	0.59	0.78	1.16

Factors:

F1	Cell type:Mature erythrocyte \| Glucose labelling:C13 glucose \| timepoint:1 hour
F2	Cell type:Mature erythrocyte \| Glucose labelling:C13 glucose \| timepoint:20 hours
F3	Cell type:Mature erythrocyte \| Glucose labelling:unlabelled \| timepoint:20 hours
F4	Cell type:Reticulocyte \| Glucose labelling:C13 glucose \| timepoint:1 hour
F5	Cell type:Reticulocyte \| Glucose labelling:C13 glucose \| timepoint:20 hours
F6	Cell type:Reticulocyte \| Glucose labelling:unlabelled \| timepoint:20 hours

Data matrix