Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for Metabolomics-based elucidation of active metabolic pathways in erythrocytes and HSC-derived reticulocytes (Study ST000403)

HILIC NEGATIVE ION MODE (Analysis AN000643)

Metabolite	Structure	F1	F2	F3	F4	F5	F6
sodium dodecyl sulfate	ME135693	5.47	0.07	0.06	0.15	0.06	0.19
Urate	ME135551	3.43	1.39	0.22	0.15	0.13	0.16
Cyanuric acid	ME135898	3.80	0.39	0.40	0.59	0.40	0.43
perchlorate	ME135672	3.45	0.34	0.65	0.43	0.74	0.39
2-Hydroxyethanesulfonate_2	ME135841	0.40	0.24	0.35	0.43	4.31	0.28
Glu-Cys-Cys_2	ME135787	NA	0.10	NA	0.31	1.53	NA
uridine-5-diphosphate bromoacetol	ME135661	0.44	0.12	0.04	2.09	2.66	0.02
LPA(18:2(9Z,12Z)/0:0)	ME135802	1.18	1.23	0.78	1.05	NA	0.41
Glu-Asp-Met	ME135769	0.51	1.59	0.90	NA	NA	NA
nocardicin G	ME135975	1.11	1.47	1.05	NA	NA	0.37
[FA hydroxy(7:1/2:0)] 2,4-dihydroxy-2-heptenedioc acid	ME135577	1.17	1.04	1.03	NA	NA	0.29
alpha-D-Mannoheptulopyranose	ME135738	1.07	1.00	0.93	NA	NA	NA
PA(36:1)	ME135985	0.90	1.23	0.87	NA	NA	NA
Thiopental	ME135963	0.79	0.52	1.69	NA	NA	NA
Glu-Thr-Thr	ME135965	1.30	0.71	0.99	NA	NA	NA
Galactinoldihydrate	ME135960	0.85	0.89	1.26	NA	NA	NA
1-naphthalenesulfonamide, n-(6-aminohexyl)-5- chloro-	ME135987	1.11	0.58	1.31	NA	NA	NA
Clitidine 5-phosphate	ME135947	1.00	0.64	1.37	NA	NA	NA
(S)-1-Pyrroline-5-carboxylate	ME135561	1.56	0.82	1.95	0.64	0.31	0.72
2-Deoxymugineic acid	ME135704	2.15	0.38	1.95	0.30	0.32	0.46
L-Arabinonate	ME135805	1.92	0.84	2.21	0.34	0.19	0.50
N-Succinyl-L-glutamate	ME135863	2.09	0.82	2.01	0.31	0.24	0.53
Quinate	ME135615	1.70	2.58	1.45	0.07	0.09	0.11
Norepinephrinesulfate	ME135689	2.04	1.38	2.03	0.17	0.15	0.24
(L-Seryl)adenylate	ME135700	1.88	1.61	2.05	0.15	0.14	0.17
D-Fructose	ME135528	1.85	1.53	1.90	0.23	0.28	0.22
D-Glucarate	ME135608	1.89	1.66	1.89	0.19	0.18	0.20
[FA trihydroxy(4:0)] 2,2,4-trihydroxy-butanoic acid	ME135744	1.91	2.01	2.00	0.03	0.02	0.03
5-Acetamidopentanoate_2	ME135624	1.91	2.15	1.83	0.03	0.04	0.05
D-Gluconic acid	ME135543	1.90	2.07	1.77	0.08	0.09	0.09
melibionate	ME135954	1.82	1.80	1.76	0.19	0.25	0.18
N-Acetyl-L-leucine_2	ME135967	1.83	1.83	1.76	0.17	0.19	0.22
D-Mannose 6-phosphate	ME135607	1.73	1.86	1.88	0.17	0.13	0.23
D-Sorbitol	ME135537	1.73	1.91	1.80	0.17	0.15	0.24
D-Galacturonate	ME135622	1.68	1.77	1.72	0.23	0.26	0.33
Taurine	ME135534	1.65	1.94	1.70	0.25	0.22	0.24
2-Dehydro-3-deoxy-D-gluconate	ME135643	1.54	2.03	1.58	0.25	0.29	0.31
[FA oxo,amino(6:0)] 3-oxo-5S-amino-hexanoic acid_2	ME135625	1.71	2.14	1.56	0.18	0.21	0.20
GMP-N-ε-(N-α-acetyl lysine methyl ester) 5-phosphoramidate	ME135912	0.31	0.26	1.79	NA	0.27	1.90
3,4-Dihydroxymandelaldehyde	ME135654	NA	NA	1.29	0.55	NA	0.87
LysoPC(20:3(5Z,8Z,11Z))	ME135650	NA	0.53	1.91	0.33	NA	0.35
Cys-Thr-Ser-Tyr	ME135767	0.49	0.63	1.86	1.03	1.02	NA
[Fv Methyl,trimethoxy,hydrox] 3,4-Methylenedioxy-2,4,6-trimethoxy-beta-hydroxychalcone	ME136042	0.56	NA	1.17	NA	0.96	NA
Iminoaspartate	ME135652	0.31	NA	1.23	NA	1.00	NA
Dichloroacetate	ME135905	0.39	NA	2.04	NA	0.84	0.21
[FA (20:2)] 15S-hydroperoxy-11Z,13E-eicosadienoic acid	ME135789	NA	NA	1.99	0.45	0.74	0.64
[FA (14:2)] 5,8-tetradecadienoic acid	ME135981	1.80	0.47	0.58	0.64	1.48	0.69
3-dimethylsulfoniopropionaldehyde	ME135926	1.35	0.93	0.02	1.22	1.15	0.02
L-Histidinol phosphate	ME135574	1.68	1.08	0.21	1.67	1.35	0.02
UDP-glucose	ME135518	0.11	0.08	0.40	1.14	0.77	3.50
D-Sedoheptulose 7-phosphate	ME135566	0.31	0.28	1.48	0.88	0.47	2.57
D-Fructose 1,6-bisphosphate	ME135515	0.53	0.21	0.77	0.91	0.81	2.78
3-acetyl pyridine adenine dinucleotide	ME135771	0.31	0.60	0.71	0.96	1.04	2.38
Neuraminic acid	ME136032	0.45	0.40	0.94	0.83	0.99	2.39
4-(2-Aminophenyl)-2,4-dioxobutanoate_2	ME135843	0.27	NA	0.59	1.12	0.98	2.03
2,3-Bisphospho-D-glycerate	ME135513	0.44	0.06	0.46	1.33	1.18	2.52
N-Glycolyl-D-glucosamine	ME135984	0.20	0.11	0.37	1.41	1.18	2.72
4-Oxoglutaramate	ME135817	0.32	0.30	0.37	1.72	1.75	1.54
N-hydroxyisoleucine	ME136000	0.22	0.29	0.32	1.79	1.78	1.61
N-Acetyl-L-glutamate 5-semialdehyde_2	ME135857	0.20	0.23	0.18	1.85	1.82	1.72
Asn-Asp-Gly	ME135991	0.18	0.23	0.17	1.61	1.85	1.96
sn-glycero-3-Phospho-1-inositol	ME135977	0.16	0.20	0.18	1.69	1.87	1.90
Asp-Leu-Lys-Lys	ME135732	0.17	0.18	0.18	1.77	1.80	1.90
(S)-Malate	ME135544	0.17	0.17	0.18	1.84	1.79	1.86
dihomocitrate	ME135996	0.11	0.09	0.12	1.71	1.88	1.79
Hydantoin-5-propionate	ME135623	0.12	0.15	0.13	1.79	1.93	1.89
UDP-glucuronate	ME135592	0.21	0.15	0.21	1.86	1.59	1.98
Arg-Leu-Val-Asn	ME135717	0.23	0.25	0.24	1.69	1.73	1.87
myo-Inositol	ME135525	0.30	0.23	0.34	1.65	1.63	1.85
[PC (17:0)] 1-(10Z-heptadecenoyl)-sn-glycero-3-phosphocholine	ME135914	0.22	0.38	0.21	1.33	1.91	1.68
[FA oxo(16:0)] 3-oxo-hexadecanoic acid	ME136009	0.19	0.28	0.46	1.48	1.80	1.80
L-Cysteate	ME135647	0.17	0.33	0.47	1.50	1.64	1.90
Oxalosuccinate	ME135864	0.21	0.14	0.21	1.29	1.93	2.22
[FA hydroxy(18:2)] 9S-hydroxy-10E,12Z-octadecadienoic acid	ME135861	0.17	0.16	0.38	1.44	1.88	1.98
2-Oxooctadecanoic acid	ME135770	0.13	0.20	0.29	1.38	1.92	2.07
nonulose 9-phosphate	ME135702	0.23	0.24	0.26	1.38	1.87	2.02
sn-Glycerol 3-phosphate	ME135540	0.13	0.12	0.15	1.70	1.56	2.33
2-Aminoacrylate	ME135816	0.08	0.07	0.09	2.21	1.59	1.96
N-Acetylneuraminate	ME135567	0.11	0.08	0.11	2.09	1.50	2.10
5-Deoxy-5-aminoshikimic acid	ME135683	0.06	0.05	0.06	2.01	1.85	1.99
2-(Hydroxymethyl)-3-(acetamidomethylene)succinate	ME135825	0.01	0.01	0.02	2.07	1.81	2.08
3,4-Dihydroxypyridine	ME135944	0.04	0.03	0.04	2.06	1.81	2.02
Ala-Asp-Asp	ME135695	0.06	0.08	0.07	1.76	1.96	2.08
Aspartyl-L-proline	ME135711	0.05	0.05	0.05	1.92	2.02	1.91
UMP	ME135585	0.38	0.30	0.18	1.84	1.26	2.03
6-Phospho-D-gluconate	ME135522	0.39	0.30	0.42	1.44	1.33	2.12
N-Formyl-L-aspartate	ME135887	0.30	0.43	0.36	1.44	1.40	2.08
N-hexanoyl-D,L-homoserine lactone	ME136016	0.17	0.19	1.11	1.35	1.49	1.70
Traumatic acid	ME135883	0.21	0.40	0.92	1.37	1.43	1.68
2-(Acetamidomethylene)succinate	ME135890	0.29	0.28	0.57	1.31	1.53	1.54
Sulfoacetaldehyde	ME135578	0.33	0.30	0.73	1.47	1.61	1.58
[PR] 9-Hydroxy-helminthosporol	ME136001	0.31	0.48	0.75	1.32	1.60	1.53
Stealthin C	ME136018	0.26	0.44	0.72	1.33	1.61	1.64
6-Acetyl-D-glucose	ME135943	0.29	0.14	0.69	1.51	1.44	1.95
D-Glyceraldehyde 3-phosphate	ME135840	0.32	0.31	0.55	1.44	1.40	1.76
Sulfoacetaldehyde_2	ME135831	0.31	0.28	0.70	1.52	1.41	1.78
[FA dimethyl(13:0)] 2,5-dimethyl-2E-tridecenoic acid	ME136008	0.62	0.43	0.40	1.17	1.68	1.70
Ala-Asp-Ser	ME135925	0.46	0.66	0.39	1.48	1.35	1.65
Orotidine	ME135548	0.56	0.62	0.50	1.32	1.42	1.58
FAD	ME135546	0.51	0.58	0.52	1.41	1.49	1.50
N-Acetyl-D-glucosamine	ME135590	0.58	0.57	0.47	1.46	1.48	1.44
gamma-L-Glutamyl-L-cysteinyl-beta-alanine	ME135721	0.47	0.48	0.46	1.53	1.29	1.60
dXMP	ME135736	0.49	0.52	0.61	1.38	1.37	1.64
Cyclic ADP-ribose	ME135811	0.58	0.51	0.60	1.48	1.33	1.49
Glycerophosphoglycerol	ME135974	0.58	0.52	0.51	1.43	1.37	1.59
Ala-Asp	ME135956	0.41	0.69	0.46	1.35	1.66	1.43
Asp-Ser	ME135931	0.36	0.56	0.42	1.49	1.70	1.46
Lys-Asp	ME135934	0.37	0.41	0.34	1.54	1.72	1.62
Thr-Ala-Ala	ME135988	0.43	0.38	0.41	1.53	1.60	1.65
Asp-Asp	ME135707	0.44	0.47	0.44	1.45	1.59	1.61
N4-(Acetyl-beta-D-glucosaminyl)asparagine_2	ME135834	0.41	0.51	0.42	1.51	1.54	1.61
Ala-Asn-Asp	ME136003	0.53	0.46	0.37	1.41	1.61	1.61
alpha-D-Glucosamine 1-phosphate_2	ME135617	0.49	0.51	0.46	1.40	1.58	1.56
N2-Acetyl-L-aminoadipate	ME135636	0.50	0.54	0.45	1.35	1.53	1.65
CoA-glutathione	ME135709	0.61	0.38	0.49	1.70	1.18	1.64
1-Aminocyclopropane-1-carboxylate_2	ME135850	0.49	0.39	0.53	1.62	1.43	1.53
N-Acetyl-D-glucosamine 1,6-bisphosphate	ME135678	0.59	0.38	0.61	1.56	1.29	1.58
3-Sulfino-L-alanine	ME135558	0.45	0.26	0.46	1.73	1.30	1.79
N2-Acetyl-L-aminoadipate_2	ME135804	0.36	0.38	0.44	1.74	1.45	1.62
(S)-3-Methyl-2-oxopentanoic acid	ME135600	0.41	0.27	0.41	1.86	1.52	1.54
L-Ala-L-Glu	ME135759	0.38	0.32	0.51	1.55	1.55	1.70
N-Acetyl-D-glucosamine 6-phosphate	ME135826	0.40	0.31	0.42	1.66	1.50	1.70
2,2-Iminodipropanoate	ME135705	0.32	0.28	0.35	1.71	1.59	1.75
[PI (18:0)] 1-octadecanoyl-sn-glycero-3-phospho-(1-myo-inositol)	ME135734	0.31	0.34	0.37	1.62	1.59	1.78
Succinate	ME135635	0.30	0.34	0.42	1.67	1.53	1.74
2-Hydroxybutane-1,2,4-tricarboxylate	ME135586	0.28	0.52	0.40	1.56	1.56	1.67
L-Dehydroascorbate	ME135605	0.41	0.47	0.40	1.54	1.47	1.72
3-Phosphonopyruvate	ME135627	0.39	0.43	0.39	1.59	1.39	1.80
UDP-N-acetyl-D-glucosamine	ME135541	0.41	0.43	0.43	1.61	1.40	1.73
Diethofencarb	ME135786	NA	0.06	0.26	1.36	1.39	1.30
CMP-N-acetylneuraminate	ME135884	0.02	0.01	NA	1.47	1.38	1.47
Phosphodimethylethanolamine	ME135888	NA	0.08	0.09	1.38	1.26	1.59
Glu-Ser	ME136023	0.15	0.09	0.15	1.36	1.75	1.35
LysoPE(0:0/20:2(11Z,14Z))	ME135920	0.08	0.09	NA	1.29	1.68	1.55
Cer(d18:2/16:0)	ME136004	0.14	0.18	0.20	1.61	1.38	1.67
Glutarylglycine	ME136012	0.09	0.15	0.13	1.51	1.61	1.61
[PC (7:0/8:0)] 1-heptanoyl-2-octanoyl-sn-glycero-3-phosphocholine	ME135997	0.03	0.14	0.24	1.44	1.75	1.76
Asn-Gly	ME135656	0.37	NA	0.38	1.57	1.07	1.61
PS(19:1(9Z)/22:2(13Z,16Z))	ME135681	0.50	0.30	NA	1.64	1.17	1.39
Asp-Asp_2	ME135794	NA	NA	NA	0.43	1.42	0.96
Cys-Met-Met-Phe	ME135790	NA	NA	NA	0.49	1.46	0.88
2-Aminomalonate semialdehyde	ME135782	NA	0.35	NA	1.12	0.82	1.72
Melibiitol	ME135653	0.34	NA	NA	0.95	0.89	1.38
2-(alpha-D-Galactosyl)-sn-glycerol 3-phosphate	ME136045	NA	NA	NA	0.78	0.88	1.34
Glu-Glu_2	ME135795	NA	NA	NA	0.74	0.98	1.28
hydroxypyruvaldehyde phosphate	ME135906	NA	NA	0.23	0.93	0.82	1.50
(-)-Medicocarpin	ME135791	NA	NA	NA	0.77	0.64	1.59
nonulose 9-phosphate_2	ME136053	NA	0.21	NA	1.00	1.33	0.93
[FA (24:0)] 15Z-tetracosenoic acid	ME135891	NA	NA	0.29	1.17	1.05	1.01
UTP	ME135801	NA	NA	NA	1.12	0.72	1.16
PG(40:8)	ME136049	NA	NA	NA	1.01	1.04	0.95
4-Nitrophenyl-3-ketovalidamine	ME136044	NA	NA	NA	1.01	1.07	0.92
N-Acetylgalactosaminate	ME136047	NA	NA	NA	0.99	1.06	0.94
Pseudouridine_2	ME135895	NA	NA	NA	0.95	1.10	0.95
Asp-Met-Cys-Cys	ME135799	NA	NA	NA	0.94	1.06	1.00
N-Succinyl-L-glutamate_2	ME135896	NA	NA	NA	0.96	1.05	0.99
Asn-Asp-Asp-Pro	ME136041	NA	NA	NA	0.95	0.95	1.10
Asp-Gly-Tyr	ME136039	NA	NA	NA	1.02	0.98	1.01
Hymexazol O-glucoside	ME136043	NA	NA	NA	0.99	0.97	1.05
Leu-Ala-Asp	ME136040	NA	NA	NA	1.15	1.01	0.84
sinapoyltyramine	ME136050	NA	NA	NA	1.11	0.97	0.92
N-(L-Arginino)succinate	ME135879	NA	NA	NA	1.05	0.93	1.03
[FA hydroxy,trihydroxy(3:0/2:0)] N-(1,3-dihydroxypropan-2-yl)-9S,11R,15S-trihydroxy-5Z,13E-prostadienoyl amine	ME135788	NA	NA	NA	1.08	0.89	1.00
Val-Asp-Ser	ME136051	NA	NA	NA	1.07	0.91	1.02
PG(36:3)	ME135798	NA	NA	NA	1.13	0.89	0.98
4-Hydroxyphenylacetylglycine_2	ME135894	NA	NA	NA	1.15	0.85	1.00
CDP	ME135892	NA	NA	NA	1.18	0.84	0.98
(-)-jasmonoyl-L-valine	ME136048	NA	NA	0.56	1.06	1.06	1.32
N-oleoyl threonine	ME136037	NA	NA	0.37	1.13	1.14	1.37
3-(ADP)-glycerate	ME136038	0.23	0.14	0.25	1.40	1.07	1.32
Pseudouridine	ME135562	0.20	0.21	0.20	1.37	1.26	1.17
Asp-Gly-Ser	ME136046	NA	0.29	NA	1.15	1.06	1.27
Leu-Asp-Gly	ME135797	NA	0.10	0.13	1.14	1.23	1.22
3-hydroxyacyl group of bacterial toxin	ME135876	0.43	1.48	2.22	0.50	0.50	0.87
4-Nitroaniline	ME135728	0.80	1.31	0.91	0.59	1.83	0.56
N-Acetyl-D-fucosamine_2	ME135785	NA	1.37	NA	0.68	1.29	0.65
n-Acetylasparagine	ME136035	0.29	0.73	0.34	1.31	0.85	2.01
5beta-Cyprinolsulfate	ME135550	0.34	0.84	0.81	1.34	0.57	1.66
[FA trihydroxy(4:0)] 2,3,4-trihydroxy-butanoic acid	ME135555	0.53	0.96	0.59	1.47	0.77	1.69
(R)-S-Lactoylglutathione	ME135611	0.68	0.76	0.67	1.26	0.94	1.69
L-Glutamate 5-semialdehyde_2	ME135871	0.63	0.62	0.56	1.72	1.01	1.46
GDP-mannose	ME135524	0.61	0.48	0.63	1.68	0.53	2.07
P-DPD	ME135908	0.67	0.38	0.72	1.67	0.76	1.80
3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestan-26-al	ME135644	0.26	1.25	1.24	0.58	1.08	1.59
[FA oxo(5:1/5:0/4:0)] (1R,2R)-3-oxo-2-(2Z-pentenyl)-cyclopentanebutanoic acid	ME136019	0.26	0.95	1.29	0.71	1.22	1.57
[PS (10:0)] 1,2-didecanoyl-sn-glycero-3-phosphoserine	ME136027	0.22	1.12	1.29	0.79	1.20	1.39
7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one	ME135886	NA	0.99	0.90	0.58	1.10	1.43
[FA (20:0/2:0)] Eicosanedioic acid	ME135743	NA	0.85	1.24	0.62	1.13	1.16
(4E)-2-Oxohexenoic acid	ME135756	0.52	0.90	1.74	0.77	1.23	0.83
[FA (11:1)] 10-undecenoic acid	ME135719	0.64	0.73	1.02	1.10	1.46	1.05
Pentanoate	ME135701	0.72	0.84	0.98	1.13	1.35	0.98
[FA dioxo(8:0)] 4,7-dioxo-octanoic acid	ME135772	0.95	1.00	0.86	0.90	1.11	1.19
Sulfoacetate	ME135828	0.77	0.98	0.94	0.93	1.21	1.17
4-Hydroxyhexan-3-one	ME135716	0.70	0.79	1.20	1.07	1.10	1.14
PS(P-18:0/17:2(9Z,12Z))	ME135911	0.64	0.84	1.16	1.06	1.11	1.19
1,6,6-Trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one	ME135993	0.68	0.88	1.11	0.90	1.30	1.14
[FA methyl(6:0)] 2-methyl-hexanoic acid	ME135762	0.68	1.05	1.16	0.98	1.10	1.03
Gentisyl alcohol	ME135976	0.79	0.93	1.12	0.91	1.13	1.11
L-2-Aminoadipate 6-semialdehyde	ME135846	0.56	1.04	1.29	1.07	0.87	1.16
5-Acetamidopentanoate	ME135571	0.48	0.81	1.34	1.06	0.96	1.35
[PS (18:0)] 1-octadecanoyl-sn-glycero-3-phosphoserine	ME135766	0.45	0.88	1.26	1.05	1.00	1.36
Vinylacetylglycine	ME135690	0.82	0.77	1.43	0.92	0.76	1.30
XTP	ME135596	0.82	0.78	1.46	0.81	0.75	1.40
5-Hydroxyisourate	ME135877	0.60	0.76	1.53	0.89	1.06	1.16
alpha-D-Glucose	ME135602	0.76	0.78	1.41	0.83	0.93	1.28
[FA hydroxy(11:2/11:2)] 2R,9R-dihydroxy-3S,4S,7S,8S-diepoxy-5E,10-undecadien-1-ol	ME136025	0.61	0.85	1.40	0.87	0.96	1.30
[FA oxo(8:0)] 3-oxo-octanoic acid	ME135777	0.82	0.45	1.40	0.85	1.24	1.24
Ethyl (R)-3-hydroxyhexanoate	ME136010	0.62	0.72	1.31	1.00	1.32	1.03
N-Butyryl-L-homoserine lactone	ME135946	0.65	0.58	1.48	1.01	1.24	1.04
8-keto-7-aminoperlagonate	ME135992	0.57	0.51	1.43	1.06	1.20	1.22
N-Butyryl-L-homoserine lactone_2	ME135982	0.58	0.64	1.49	1.05	1.09	1.15
9-Oxononanoic acid	ME135881	0.52	0.81	1.40	0.72	1.29	1.25
[FA (10:1/2:0)] 2E-Decenedioic acid	ME136030	0.48	0.92	1.32	0.74	1.27	1.27
Otonecine	ME135694	0.52	0.45	1.48	0.93	1.17	1.45
[FA (8:1)] 2Z-octenoic acid	ME136011	0.33	0.48	1.28	1.10	1.40	1.41
Hexanoic acid	ME135549	0.31	0.57	1.40	1.02	1.35	1.35
PS(13:0/12:0)	ME136014	0.24	0.69	1.30	0.80	1.15	1.32
(+/-)-6-Hydroxy-3-oxo-alpha-ionone	ME136024	0.28	0.63	1.36	0.86	1.34	1.28
ethyl-(2R)-methyl-(3S)-hydroxybutanoate	ME136022	0.42	0.68	1.40	0.86	1.36	1.28
(9Z)-Hexadecenoic acid	ME135862	1.02	0.41	0.65	1.03	1.51	1.38
Sulmazole	ME135657	0.81	NA	0.51	1.03	1.32	1.32
Farnesoic acid	ME135668	0.96	0.50	0.73	1.44	1.18	1.18
PE(14:0/22:5(4Z,7Z,10Z,13Z,16Z))	ME135824	0.90	0.73	0.73	1.54	1.05	1.05
PS(15:0/22:4(7Z,10Z,13Z,16Z))	ME135927	0.80	0.51	0.59	1.26	1.44	1.41
3-Sulfolactate	ME135632	0.73	0.60	0.51	1.48	1.31	1.37
[PE (18:0/20:4)] 1-octadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoethanolamine	ME135572	0.78	0.70	0.54	1.48	1.28	1.22
Orotate(Fragment)	ME135872	0.64	0.73	0.61	1.20	1.36	1.46
2,7-Anhydro-alpha-N-acetylneuraminic acid	ME135972	0.58	0.64	0.59	1.35	1.43	1.40
3-Methylbutanoic acid	ME135853	0.62	0.60	0.65	1.42	1.39	1.32
D-Xylonolactone	ME135612	0.63	0.76	0.60	1.37	1.34	1.30
ethylpyruvate	ME135733	0.69	0.71	0.68	1.33	1.37	1.22
Glu-Leu	ME135706	0.75	0.73	0.62	1.28	1.39	1.22
L-2-Amino-3-oxobutanoic acid	ME135820	1.00	0.84	0.68	1.15	1.01	1.31
[PS (20:4)] 1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoserine	ME135686	1.00	0.78	0.59	1.29	1.08	1.27
Butanoic acid	ME135583	0.83	0.78	0.75	1.30	1.24	1.10
PI(38:4)	ME135935	0.88	0.77	0.58	1.21	1.32	1.24
S-(Formylmethyl)glutathione	ME135901	0.78	0.82	0.60	1.32	1.19	1.28
CAI-1	ME135682	1.02	0.66	0.81	0.98	1.19	1.34
D-Proline	ME135569	0.84	0.65	1.03	0.98	1.14	1.37
[FA hydroxy(11:1)] 2-hydroxy-10-undecenoic acid	ME135915	0.77	0.67	0.99	1.04	1.27	1.26
[FA methyl(14:0)] 12-methyl-tetradecanoic acid	ME136005	0.83	0.76	0.91	0.98	1.21	1.31
L-Cysteinylglycinedisulfide	ME135667	0.89	0.73	0.97	1.25	1.19	0.98
[FA hydroxy(20:4)] 15S-hydroxy-5Z,8Z,11Z,13E-eicosatetraenoic acid	ME135806	0.76	0.61	1.04	1.30	1.09	1.20
Indole-5,6-quinone	ME135595	0.75	0.63	1.12	1.23	1.13	1.14
2-Dehydro-D-xylonate	ME135748	0.67	0.68	0.78	1.30	1.28	1.29
[GP (20:4)] 1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphate	ME135670	0.71	0.65	0.83	1.19	1.35	1.28
ADP ribose 1,2-phosphate	ME135950	0.86	0.66	0.85	1.32	1.10	1.20
2-Butyne-1,4-diol	ME135921	0.77	0.56	0.93	1.31	1.11	1.32
(S)-Lactate	ME135613	0.73	0.58	0.75	1.32	1.23	1.39
Maleamate_2	ME135848	0.77	0.63	0.77	1.31	1.15	1.36
Fumarate	ME135535	0.78	0.66	0.80	1.26	1.19	1.31
L-Aspartate	ME135530	0.80	0.64	0.79	1.31	1.16	1.30
Cantleyine	ME135662	0.68	0.55	1.02	1.15	1.28	1.31
[FA hydroxy(18:0)] 2S-hydroxy-octadecanoic acid	ME136017	0.59	0.58	0.85	1.18	1.36	1.45
[PR] Citronellyl acetate	ME135752	0.75	0.57	0.85	1.12	1.29	1.42
(1S,2R,4S)-(-)-Bornyl acetate	ME135980	0.64	0.47	0.82	1.48	1.19	1.40
dATP	ME135560	0.84	0.46	0.95	1.24	1.07	1.45
Citrate	ME135520	0.76	0.39	0.93	1.36	1.16	1.39
Icosatrienoic acid	ME135874	0.74	0.39	0.97	1.37	1.19	1.35
ethanedisulfonate	ME135673	0.88	0.36	1.07	1.23	1.19	1.27
HEPES	ME135674	0.85	0.34	1.02	1.33	1.17	1.30
4-Hydroxyphenylacetylglycine	ME135563	0.61	0.85	1.13	1.39	0.92	1.11
Phthalate	ME135547	0.57	1.00	0.93	1.08	1.04	1.37
penem CGP31608_2	ME135778	0.49	0.72	0.88	1.36	1.05	1.33
Docosanoic acid	ME135870	0.71	0.85	0.75	1.29	1.06	1.24
3-Dehydroquinate	ME135639	0.84	0.74	0.87	1.33	0.86	1.36
GMP	ME135597	0.81	0.81	0.82	1.22	0.99	1.35
A-Ketoglutaricacidoxime	ME135783	0.20	0.31	1.09	1.16	1.53	1.22
3,7-Dimethyl-2E,6E-decadien-1,10-dioic acid	ME136031	0.13	0.33	1.18	1.42	1.60	1.35
N-Hydroxy-1-aminonaphthalene	ME135902	0.16	0.31	1.23	1.38	1.71	1.44
Dodecanedioic acid	ME136034	0.35	0.74	0.96	0.81	1.47	1.66
10-Hydroxydecanoic acid	ME135994	0.61	0.77	0.84	0.95	1.46	1.38
Abscisic acid glucose ester	ME135633	0.56	0.74	1.01	0.86	1.36	1.46
[FA (17:0)] heptadecanoic acid	ME135755	0.55	0.72	1.00	0.97	1.38	1.38
Hydroxypyruvate	ME135648	0.32	0.81	1.05	1.10	1.35	1.37
3-Hydroxydodecanedioicacid	ME136026	0.31	0.85	1.17	0.82	1.44	1.41
cis-1,2-Dihydro-3-ethylcatechol	ME135900	0.35	0.64	1.17	0.92	1.43	1.49
[FA oxo(12:1)] 12-oxo-10E-dodecenoic acid	ME135646	0.20	0.57	0.95	1.10	1.52	1.65
10-Oxodecanoate	ME136029	0.53	0.50	0.87	0.95	1.49	1.66
omega-Cyclohexylundecanoic acid	ME135998	0.42	0.46	0.78	1.09	1.57	1.69
16-hydroxypalmitate	ME136013	0.45	0.56	0.98	1.18	1.40	1.44
[FA] Methyl jasmonate	ME135882	0.37	0.44	0.95	1.28	1.54	1.41
O-Acetyl-L-homoserine	ME135604	0.46	0.51	0.83	1.29	1.51	1.41
Glu-Cys-Cys	ME135663	0.45	0.26	1.06	1.19	1.17	1.38
[FA (18:2)] 9S-hydroperoxy-10E,12Z-octadecadienoic acid	ME135610	0.53	0.36	1.15	0.98	1.38	1.60
Asp-Gln	ME135971	0.49	0.47	1.13	1.08	1.46	1.36
N-Acetyl-L-leucine	ME135659	0.58	0.36	1.14	1.12	1.34	1.46
N-Acetyl-L-phenylalanine	ME135803	0.57	0.42	1.00	1.16	1.35	1.50
5,6-Dihydroxyindole-2-carboxylate	ME135655	NA	NA	1.05	0.98	0.87	1.09
[FA (22:4)] 7Z,10Z,13Z,16Z-docosatetraenoic acid	ME135630	NA	0.53	0.59	1.33	1.03	1.38
Tetracosanoic acid	ME135629	NA	0.61	0.48	1.41	1.25	1.25
[FA (22:0)] 13Z-docosenoic acid	ME135651	NA	0.48	0.83	1.13	1.10	1.46
Icosadienoic acid	ME135821	NA	0.53	0.82	1.05	1.13	1.15
[PC acetyl(18:2)] 1-(9Z,12Z-octadecadienoyl)-2-acetyl-sn-glycero-3-phosphocholine	ME136033	NA	0.43	1.00	1.03	1.31	1.23
Zoxazolamine	ME135784	NA	0.51	0.64	0.86	1.54	1.32
PG(P-16:0/15:1(9Z))	ME135948	NA	0.27	0.41	1.23	1.53	1.56
Tauropine	ME135779	NA	0.17	0.72	1.02	1.40	1.70
[PR] 2-methylbacteriohopane-32,33,34,35-tetrol	ME136028	0.94	NA	1.11	0.97	0.90	1.03
Urea-1-carboxylate	ME135819	0.84	0.66	1.63	1.34	0.73	0.80
glutathione-sulfite	ME135760	0.59	0.44	1.19	1.60	0.86	1.32
S-Sulfo-L-cysteine	ME135601	0.53	0.79	1.43	1.41	0.55	1.30
N-Acetylmuramate	ME135645	0.72	0.90	1.58	0.42	0.83	1.52
2-oxosuberate	ME135671	0.83	0.64	1.88	0.85	0.66	1.14
2-Acetolactate	ME135832	0.81	0.56	1.84	0.73	0.66	1.38
2-Hydroxy-2,4-pentadienoate	ME135837	0.79	0.54	1.77	0.79	0.66	1.47
(S)-Methylmalonate semialdehyde	ME135829	0.79	0.53	1.76	0.80	0.68	1.44
2-Butenoate	ME135955	0.76	0.56	1.84	0.74	0.63	1.47
D-Glucose	ME135527	0.81	0.51	1.84	0.75	0.62	1.47
D-Xylulose	ME135827	0.83	0.52	1.80	0.77	0.65	1.43
Met-Met-Pro-Tyr	ME135910	0.86	0.60	1.23	1.00	0.70	1.49
3-Phospho-D-glycerate	ME135516	0.97	0.44	1.32	1.01	0.76	1.49
Phosphoenolpyruvate	ME135517	1.00	0.40	1.46	1.00	0.73	1.42
D-Galactose	ME135638	0.71	0.70	1.43	0.90	0.70	1.69
D-Mannose	ME135620	0.80	0.65	1.55	0.90	0.59	1.56
(2S)-2-{[1-(R)-Carboxyethyl]amino}pentanoate_2	ME135953	0.88	0.47	1.52	0.87	0.67	1.59
beta-D-Glucose	ME135618	0.87	0.59	1.44	0.87	0.76	1.47
O-Acetyl-L-homoserine_2	ME135812	0.83	0.26	1.42	1.18	0.57	1.75
L-Glutamate 5-semialdehyde	ME135855	0.78	0.38	1.23	1.14	0.65	1.82
Muramic acid_2	ME135928	0.72	0.24	1.31	1.25	0.61	1.87
N-Glycosyl-L-asparagine	ME135685	0.69	0.20	1.31	1.19	0.66	1.95
Cyclohexane-1,3-dione	ME136007	0.40	0.60	0.92	1.24	1.18	1.65
2(alpha-D-Mannosyl)-D-glycerate	ME135626	0.54	0.56	0.84	1.05	1.05	1.97
Ala-Ser-His	ME136002	0.42	0.48	0.95	1.19	0.98	1.99
D-Ribose 5-phosphate	ME135523	0.84	0.67	1.13	0.78	0.80	1.77
octulose 8-phosphate	ME135922	0.78	0.60	0.92	1.25	0.68	1.76
6-Acetyl-D-glucose_2	ME135961	0.75	0.79	1.06	1.08	0.76	1.56
Muramic acid	ME135740	0.65	0.61	1.02	1.10	0.89	1.72
Dehydrojuvabione	ME135768	0.66	1.82	1.33	0.57	0.78	0.83
Sulcatone	ME135679	0.75	1.68	1.18	0.73	0.53	1.14
penem CGP31608	ME135749	1.17	1.51	0.59	1.09	0.74	0.77
Glu-Glu	ME135753	1.45	1.39	0.49	1.13	1.27	0.83
Docosahexaenoicacid	ME135869	1.68	1.17	0.63	1.01	0.72	0.80
Glu-Met-Met-His	ME135720	1.59	1.51	0.43	0.72	0.96	0.79
Glutathione	ME135526	1.63	1.45	0.46	0.72	0.88	0.86
PI(36:4)	ME135968	1.61	1.33	1.21	0.48	0.39	0.37
[PS (18:0/22:6)] 1-octadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoserine	ME135576	1.93	1.53	1.05	0.54	0.47	0.49
Sedoheptulose	ME135932	1.44	1.34	1.48	0.22	0.21	0.26
Glucosyl sphingosine	ME135929	1.55	1.68	1.54	0.39	0.27	0.32
hydrogen iodide	ME135725	1.60	1.80	1.57	0.33	0.37	0.34
[GP (16:0/18:1)] 1-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glycero-3-phosphate	ME135865	1.47	1.85	1.24	0.37	0.50	0.56
[GP (18:0/18:2)] 1-octadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate	ME135858	1.57	1.85	1.40	0.33	0.38	0.47
Glycerol	ME135553	1.74	1.01	1.18	0.90	0.59	0.57
N-Acetyl-D-glucosaminate	ME135737	1.28	1.30	1.35	0.69	0.33	1.04
Fagomine	ME135724	1.40	1.50	1.36	0.54	0.59	0.61
[PE (18:0/18:2)] 1-octadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine	ME135836	1.58	1.55	1.33	0.52	0.55	0.47
[PC (15:1)] 1-(1Z-pentadecenyl)-sn-glycero-3-phosphocholine	ME135973	1.25	1.51	1.44	0.77	0.41	0.62
5D-5-O-Methyl-2,3,5/4,6-pentahydroxycyclohexanone	ME135712	1.42	1.34	1.48	0.61	0.49	0.66
[PE (16:1)] 1-(1Z-hexadecenyl)-sn-glycero-3-phosphoethanolamine	ME135990	1.37	1.41	1.52	0.61	0.37	0.50
Ecgonine	ME135708	1.30	1.52	1.21	0.69	0.64	0.63
[FA (18:2)] 9Z,11E-octadecadienoic acid	ME135614	1.21	1.46	1.13	0.77	0.70	0.73
L-Erythrulose	ME135675	1.36	1.22	1.33	0.64	0.60	0.86
2-Oxoglutarate	ME135538	1.30	1.34	1.23	0.62	0.78	0.74
alpha-D-Glucosamine 1-phosphate	ME135594	1.32	1.29	1.18	0.68	0.78	0.76
5-Hydroxycotinine	ME135866	1.39	1.09	1.31	0.68	0.79	0.74
ancymidol	ME135723	1.43	1.24	1.38	0.64	0.65	0.66
Demethyltorosaflavone D	ME135964	1.40	1.24	1.27	0.72	0.74	0.64
PA(36:3)	ME135942	1.58	1.72	1.00	0.55	0.50	0.65
PA(36:4)	ME135938	1.67	1.37	0.96	0.74	0.57	0.69
PE(22:4(7Z,10Z,13Z,16Z)/P-18:0)	ME135854	1.52	1.50	1.05	0.74	0.52	0.67
PI(36:2)	ME135726	1.48	1.14	0.92	0.59	0.50	0.70
PS(40:8)	ME135913	1.39	1.30	0.85	0.81	0.74	0.74
2-hydroxymethanesulfonate	ME135757	1.39	1.37	0.99	0.84	0.53	0.88
4-Methylpentanal	ME135557	1.26	1.42	0.97	0.74	0.59	1.03
4-Propylphenol	ME135775	0.81	1.14	1.78	1.08	0.62	0.57
L-Hypoglycin	ME135677	0.98	1.03	1.76	0.74	0.66	0.83
L-Ala-L-Glu_2	ME135918	0.98	0.68	1.59	0.85	0.98	0.92
2-Ethylhexyl phthalate	ME135676	1.30	0.56	1.60	1.00	0.63	0.91
D-Alanyl-D-alanine	ME135642	1.24	0.59	1.49	0.97	0.72	0.85
3beta-Hydroxyandrost-5-en-17-one 3-sulfate	ME135818	1.30	0.75	1.48	0.96	0.68	0.83
Oxoamide	ME135823	1.25	0.75	1.40	0.90	0.81	0.89
3-carboxy-4-methyl-5-propyl-2-furanpropanoic acid	ME135999	1.35	0.58	1.61	0.77	0.89	0.80
(S)(+)-Allantoin	ME135878	1.16	0.81	1.63	0.82	0.79	0.79
indole-3-acetyl-valine	ME135940	1.28	0.84	1.61	0.83	0.41	0.64
Indole-3-acetaldehyde	ME135591	1.45	0.83	1.32	0.93	0.67	0.80
phosphinomethylmalate	ME135919	1.33	0.90	1.36	0.99	0.53	0.89
Camoensine	ME135949	1.36	0.87	1.52	0.85	0.57	0.84
Pyruvate	ME135521	1.45	0.85	1.54	0.71	0.60	0.85
(R,R)-Tartaric acid	ME135533	1.46	0.89	1.55	0.73	0.58	0.79
ADP	ME135587	1.30	1.04	1.45	0.82	0.59	0.81
2-Hydroxy-1,3-dimethoxy-8,9-methylenedioxycoumestan	ME135945	1.30	1.05	1.40	0.78	0.68	0.79
Phenolsulfonphthalein	ME135718	1.27	1.08	1.39	0.79	0.68	0.79
3,4-dihydroxybenzylamine	ME135691	1.29	1.02	1.48	0.80	0.71	0.71
[ST hydrox] 3alpha,7alpha-Dihydroxy-5beta-cholan-24-oic Acid	ME135833	1.28	0.95	1.40	0.75	0.66	0.73
Acetyl-CoA	ME135573	1.29	0.86	1.41	0.87	0.82	0.75
Benzofuran	ME135939	1.25	1.00	1.38	0.84	0.78	0.75
[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	ME135735	1.01	1.29	1.08	0.89	1.00	0.73
[6]-Gingerol	ME135747	0.97	1.41	1.09	0.81	0.95	0.76
7E,9E,11-Dodecatrienyl acetate	ME135979	0.95	1.36	1.07	0.87	0.96	0.79
[FA hydroxy(13:0)] 2-hydroxy-tridecanoic acid	ME135780	0.71	1.30	1.16	0.82	1.07	0.94
Phenylacetylglycine	ME135536	0.83	1.30	1.08	0.86	0.94	0.98
N-Undecanoylglycine	ME135765	0.85	1.34	1.39	0.78	0.78	0.87
5-Dehydro-4-deoxy-D-glucarate	ME135603	0.73	1.08	1.34	0.79	1.07	0.99
[FA (8:0)] octanoic acid	ME135545	0.65	1.11	1.37	0.94	1.04	0.88
Capryloylglycine_2	ME135764	0.81	1.10	1.59	0.78	0.91	0.82
Diethyl 2-methyl-3-oxosuccinate	ME135758	0.81	1.16	1.45	0.60	1.05	0.94
Diethyl adipate	ME135773	0.89	1.22	1.46	0.65	1.05	0.74
(9Z)-Tetradecenoic acid	ME136006	1.33	0.61	0.99	0.73	1.16	1.18
Laudanosine	ME135699	1.34	0.59	1.13	0.78	0.87	1.29
Linoleate	ME135851	1.37	0.56	1.02	0.95	0.98	1.11
Methyl 2-(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)-p-toluate	ME135962	1.11	0.58	1.01	1.09	0.92	1.30
Tetradecanoic acid	ME135542	1.20	0.77	0.88	1.00	1.08	1.07
[FA (11:0)] undecanoic acid	ME135684	1.08	0.78	0.84	1.11	1.01	1.17
[FA (20:4)] 5Z,8Z,11Z,14Z-eicosatetraenoic acid	ME135849	1.24	0.77	0.85	1.13	0.92	1.09
(2S)-2-{[1-(R)-Carboxyethyl]amino}pentanoate	ME135763	1.02	1.04	1.15	0.92	0.89	0.98
L-Noradrenaline	ME135641	1.04	1.07	1.20	0.85	0.84	1.00
Mesaconate	ME135637	0.99	1.00	1.12	0.85	1.03	1.00
Nonanoic acid	ME135761	0.91	1.06	1.18	0.88	1.01	0.97
LPA(0:0/18:0)	ME135810	1.00	1.11	0.99	1.10	0.84	0.96
Phenol	ME135628	0.99	1.06	1.11	1.14	0.82	0.88
2-isocapryloyl-3R-hydroxymethyl-γ-butyrolactone	ME135731	1.08	1.19	0.91	0.88	0.97	0.98
Botrydial	ME135995	1.12	1.13	0.91	0.96	0.87	1.01
1,2-dioctanoyl-1,2,6-hexanetriol	ME135951	0.98	1.12	1.02	0.99	0.88	1.00
MG(0:0/24:1(15Z)/0:0)	ME135930	0.94	1.19	1.04	0.93	0.93	0.97
L-Aspartate 4-semialdehyde	ME135582	0.90	1.07	1.06	0.97	0.96	1.04
N-Undecanoylglycine_2	ME135989	0.89	1.13	0.98	1.03	0.91	1.06
Monomethyl sulfate	ME135730	1.00	1.08	1.03	0.94	0.99	0.96
Tetranor-PGE1	ME135958	1.01	1.04	1.00	1.02	0.95	0.97
4-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde	ME135640	1.09	1.11	1.03	0.90	0.88	0.99
homovanillate	ME135634	1.06	1.06	1.06	1.00	0.87	0.94
Arecoline	ME135687	1.03	0.86	1.13	1.04	0.98	0.95
PIPES	ME135966	1.06	0.90	1.03	0.96	0.99	1.07
2-Dehydro-3-deoxy-L-arabinonate	ME135839	1.03	0.91	1.08	0.98	0.96	1.03
momilactone A	ME135715	1.00	0.96	1.08	0.96	1.00	1.00
[FA trihydroxy(18:1)] 9S,12S,13S-trihydroxy-10E-octadecenoic acid	ME135606	1.08	0.94	0.99	0.91	1.09	0.99
(6Z)-Octadecenoic acid	ME135722	1.04	1.03	0.95	0.92	0.99	1.08
Apiole	ME135692	1.04	0.95	0.89	0.99	1.02	1.11
[FA (13:2)] 3E,5E-tridecadienoic acid	ME135741	1.28	0.93	0.85	0.97	0.93	1.05
[GP (18:0)] 1-octadecanoyl-2-sn-glycero-3-phosphate	ME135822	1.09	0.98	0.98	1.04	0.91	1.00
[GP (16:0)] 1-hexadecanoyl-2-sn-glycero-3-phosphate	ME135815	1.11	0.98	0.96	1.10	0.88	0.97
LPA(0:0/18:1(9Z))	ME135842	1.08	0.95	0.93	1.13	0.92	0.99
Cholesterolsulfate	ME135952	1.09	1.07	0.86	1.02	0.97	0.98
PI(38:5)	ME135959	1.19	1.02	0.78	1.03	0.98	1.00
[FA (14:0/2:0)] Tetradecanedioic acid	ME135658	1.07	1.08	1.45	0.61	0.81	0.98
Sinapoyl aldehyde	ME135814	1.19	0.93	1.43	0.69	0.84	0.87
2-trans,6-trans-Farnesal	ME135746	1.08	1.07	1.24	0.92	0.88	0.80
4-Amino-4-deoxychorismate	ME135873	1.10	1.10	1.26	0.87	0.80	0.87
GDP-L-fucose	ME135599	1.24	1.11	1.26	0.80	0.71	0.88
(R)-2,3-Dihydroxy-3-methylbutanoate	ME135579	1.25	1.11	1.24	0.78	0.77	0.85
Fagomine_2	ME135969	1.21	1.25	1.14	0.82	0.76	0.82
Sorbitol 6-phosphate	ME135844	1.22	1.20	1.24	0.87	0.71	0.75
3-(4-Hydroxyphenyl)pyruvate	ME135616	1.31	0.95	1.17	0.76	0.82	0.99
4-Methylene-L-glutamate	ME135710	1.19	1.02	1.13	0.85	0.86	0.95
Met-Gly-Arg	ME135680	1.28	0.92	1.26	0.89	0.73	0.93
[ST hydrox] 3alpha-hydroxy-5alpha-androstan-17-one 3-sulfate	ME135978	1.25	0.78	1.32	0.88	0.73	1.04
Oxalate	ME135532	1.10	0.88	1.28	0.88	0.80	1.06
Phenol sulfate	ME135957	1.06	0.93	1.31	0.97	0.78	0.96
Glycochenodeoxycholate	ME135859	1.14	0.89	1.15	0.96	0.82	1.03
LPA(0:0/18:2(9Z,12Z))	ME135845	1.19	0.94	1.16	1.01	0.82	0.88
3-Phospho-D-glyceroyl phosphate	ME135552	0.97	0.96	1.37	0.88	0.92	0.90
Phenylpyruvate	ME135529	0.91	1.06	1.37	0.90	0.82	0.94
dTDP-3-oxo-4,6-dideoxy-alpha-D-glucose	ME135664	1.16	0.92	1.36	0.93	0.93	0.70
2-Octenedioicacid	ME135970	1.14	0.95	1.24	0.75	1.03	0.89
Salicylaldehyde	ME135899	1.11	0.96	1.12	0.91	1.05	0.85
Ethyl 3-oxohexanoate	ME135986	0.91	0.81	1.19	0.86	0.95	1.29
Cys-Met-Pro-His	ME135729	0.94	0.89	1.08	0.97	0.89	1.23
[FA oxo(4:0)] 11-oxo-5Z,9,12E,14E-prostatetraenoic acid	ME135581	0.92	0.92	1.13	1.00	0.94	1.10
[FA (20:0)] 11Z-eicosenoic acid	ME135856	0.81	0.86	1.10	1.08	1.03	0.99
trans-4-Hydroxycyclohexanecarboxylate	ME135754	0.89	0.81	1.30	1.01	1.01	0.97
[FA hydroxy(6:0)] 4-hydroxy-hexanoic acid	ME135745	0.91	0.78	1.11	0.98	1.11	1.11
Hydroxymethylphosphonate	ME135937	0.99	0.63	1.17	0.94	1.14	1.13
[FA (18:1)] 9Z-octadecenoic acid	ME135588	1.15	0.64	1.11	1.03	0.98	1.09
[FA oxo,amino(6:0)] 3-oxo-5S-amino-hexanoic acid	ME135580	1.06	0.79	1.11	1.10	0.88	1.05
(S)-2-Aceto-2-hydroxybutanoate	ME135575	0.99	0.85	1.09	1.10	0.90	1.07
(3R)-beta-Leucine	ME135584	0.99	0.77	1.20	1.07	0.93	1.05
alpha-(Methylenecyclopropyl)glycine	ME135936	0.99	0.70	1.23	1.00	0.99	1.10
L-Rhamnose	ME135598	0.99	0.68	1.16	1.08	0.98	1.12
2-Oxoadipate	ME135852	0.91	0.58	1.33	1.07	0.82	1.29
N3-fumaramoyl-L-2,3-diaminopropanoate	ME135727	0.99	0.59	1.34	1.07	0.81	1.21
10-oxogeranial	ME135880	0.79	0.66	1.26	1.13	0.87	1.30
D-Glycerate	ME135568	0.84	0.71	1.20	1.05	0.93	1.27
2-Dehydro-D-xylonate_2	ME135933	1.04	0.78	1.26	0.92	0.71	1.28
L-Glycericacid	ME135917	1.07	0.77	1.32	1.08	0.67	1.09
2-Hydroxyethanesulfonate	ME135593	1.06	0.72	1.30	0.98	0.86	1.08
(R)-3-Hydroxybutanoate	ME135589	1.07	0.69	1.34	1.01	0.87	1.02
1-Aminocyclopropane-1-carboxylate	ME135835	1.15	0.79	1.18	0.93	1.07	0.88
Gentisate aldehyde	ME135564	1.13	0.71	1.21	1.04	1.05	0.87
Benzoate	ME135519	1.23	0.83	1.01	1.10	0.99	0.85
Decanoic acid	ME135531	1.10	0.85	0.98	1.09	1.04	0.94
Cardiospermin	ME135714	0.89	0.93	1.29	1.07	0.91	0.69
phlorisobutyrophenone	ME135774	0.85	0.88	1.28	1.23	1.01	0.73
[FA methyl(19:0/2:0)] 13-methylnonadecane-1,2-diol	ME135688	0.98	0.72	1.24	1.26	0.85	0.94
3-sulfopropanoate	ME135697	1.04	0.88	1.17	1.14	0.93	0.83
3-Dehydrocarnitine	ME135808	1.03	0.80	1.32	1.11	0.90	0.83
herbicide 14A	ME135909	1.12	0.88	1.30	1.07	0.83	0.80
Homogentisate	ME135621	1.24	1.27	1.08	1.06	0.71	0.64
[PR] Tretinoin/All-Trans Retinoic Acid	ME135554	1.28	0.87	0.83	1.42	0.81	0.79
Vanilpyruvicacid	ME135713	1.36	0.74	1.14	1.25	0.56	0.96
Vinylacetylglycine_2	ME135923	1.36	0.71	1.20	1.19	0.78	0.77
[FA (20:0)] eicosanoic acid	ME135631	1.30	1.00	0.81	1.18	0.76	0.96
Octadecanoic acid	ME135868	1.29	0.91	0.96	1.16	0.68	1.00
Hexadecanoic acid	ME135539	1.15	0.87	1.08	1.14	0.75	1.01
5-Hydroxypentanoate	ME135941	1.24	0.86	1.07	1.14	0.83	0.86
LPA(0:0/16:0)	ME135838	1.24	1.00	1.00	1.08	0.78	0.90
N-Formyl-L-methionine	ME135867	1.29	1.01	1.04	1.02	0.54	1.10
[FA (13:0/2:0)] Tridecanedioic acid	ME135696	1.34	1.14	0.94	0.94	0.68	0.96
Indoxylsulfate	ME135916	1.42	0.99	1.08	0.96	0.70	0.86
Maleamate	ME135813	1.51	0.96	1.18	0.62	0.64	1.09
Quassin	ME135750	1.82	0.68	1.10	0.55	0.92	0.93
Obliquine	ME135907	1.31	0.62	1.30	0.71	1.35	0.83
12-Hydroxydodecanoic acid	ME135669	1.25	1.07	0.90	0.62	1.01	1.14
Phenylacetaldehyde	ME135875	1.31	0.89	0.92	0.73	1.24	0.91
Progesterone	ME135609	1.60	0.83	0.78	0.78	1.15	0.86
1,4-Bis(2-ethylhexyl) sulfosuccinate	ME135781	0.76	1.35	0.72	0.87	0.78	1.52
N-(2-hydroxypentadecanoyl)-4,8-sphingadienine	ME135983	0.51	1.25	1.15	0.96	0.79	1.33
N-Acetyl-D-fucosamine	ME135742	0.65	1.21	0.27	1.18	1.20	1.24
Arg-Cys-Gln-Tyr	ME135739	0.84	1.22	0.69	1.11	1.05	1.09
Capryloylglycine	ME135666	0.94	1.11	0.70	1.30	1.08	0.87
PE(20:2(11Z,14Z)/18:3(6Z,9Z,12Z))	ME135847	1.10	1.01	0.71	1.30	0.95	0.93
(R)-AMAA	ME135793	0.36	0.18	0.88	0.54	1.96	1.31
Aspidinol	ME136036	NA	0.32	1.82	0.89	0.87	1.11
[FA (18:3)] 13S-hydroperoxy-9Z,11E,14Z-octadecatrienoic acid	ME135860	0.15	0.13	1.79	1.14	1.28	1.51
[FA oxo(7:0)] 2-oxo-heptanoic acid	ME136020	0.22	0.47	1.74	0.88	1.29	1.40
Abscisic aldehyde	ME135889	NA	0.44	1.52	0.55	1.38	1.11
Nitrilotriacetic acid	ME135792	0.37	NA	1.75	0.64	1.35	0.89
2,3,5-Trihydroxytoluene	ME135924	0.42	0.37	2.56	0.44	0.46	1.76
Sucrose	ME135514	0.43	0.37	2.59	0.43	0.66	1.52
2-(sulfomethyl)thiazolidine-4-carboxylate	ME135660	0.85	0.16	2.53	0.89	0.75	0.82
Brassicanal A	ME136015	0.20	0.33	2.65	0.77	0.95	1.09
Furfural diethyl acetal	ME135776	0.24	0.29	3.21	0.55	0.89	0.81
N4-(Acetyl-beta-D-glucosaminyl)asparagine	ME135830	0.91	0.74	2.11	0.55	0.47	0.88
Ascorbate	ME135619	1.51	0.35	1.82	0.72	0.44	1.16
His-Met-Trp-Ser	ME135751	1.09	0.17	2.00	0.58	0.30	1.30
3,6,8-Trimethylallantoin	ME135559	1.30	0.52	2.64	0.26	0.82	0.47
2-Oxoglutaramate	ME135570	0.86	0.28	1.52	0.68	1.62	1.04
2-Oxosuccinamate	ME135649	0.73	0.39	1.40	0.55	1.56	0.96
Flaccidin B	ME135665	1.35	0.23	2.17	0.22	1.50	0.53
5-Hydroxyectoine	ME135885	0.78	0.57	1.97	0.41	1.51	0.76
4-(2-Aminophenyl)-2,4-dioxobutanoate	ME135556	1.21	0.38	2.04	0.41	0.96	0.80
5-Phenyl-1,3-oxazinane-2,4-dione	ME135897	1.26	0.40	2.16	0.41	1.11	0.67
N-Acetyl-L-glutamate 5-semialdehyde	ME135807	1.09	0.34	1.99	0.54	1.26	0.79
Glu-Asp-Cys	ME135703	1.10	0.51	1.79	0.58	1.19	0.84
2-Formaminobenzoylacetate	ME135565	1.14	0.51	1.94	0.55	1.11	0.73
Glycylproline	ME135698	1.12	0.62	1.95	0.56	1.00	0.76

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