Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST004200)

(Analysis AN006985)

Metabolite	Structure	F1	F2	F3	F4	F5	F6	F7
Xylenesulfonate	ME1131587	0.16	1.60	0.18	0.15	0.15	4.47	0.78
apronalide 2	ME1130699	0.34	0.22	2.98	3.03	0.29	0.29	0.30
"1-O-(9,16,17-Trihydroxy-18-oxokauran-18-yl)hexopyranose"	ME1130346	0.09	0.08	5.09	0.87	0.07	0.24	1.07
"(2beta,3beta,5beta,11alpha,22R,24R)-2,3,11,14,20,22,25-Heptahydroxyergost-7-en-6-one"	ME1130206	0.14	0.10	5.18	0.31	0.19	0.33	1.23
quinbolone	ME1131449	0.13	0.07	5.05	0.39	0.26	0.34	1.27
"(6S)-9-[(2S)-6-Hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-2-yl]-2,6-dimethylnonanoic acid"	ME1130295	0.61	0.45	4.22	0.38	0.60	0.49	0.75
Kynurenic acid	ME1131068	0.22	0.79	4.30	0.25	0.30	0.76	0.88
Ardisianone	ME1130702	0.26	0.17	4.42	0.50	0.38	0.51	1.25
LLY-507	ME1131153	0.17	0.09	4.28	0.52	0.40	0.54	1.51
phosphatidylserine O-18:0/0:0	ME1131396	0.15	0.09	4.34	0.54	0.40	0.40	1.58
Thiosulfic acid	ME1131533	0.13	0.41	4.40	0.65	0.26	0.88	0.77
"1,1^-[1,12-Dodecanediylbis(oxy)]dibenzene"	ME1130356	0.09	0.10	4.50	0.87	0.39	0.62	0.91
3-Oxochol-4-en-24-oic acid	ME1130514	0.10	0.16	4.31	0.91	0.41	0.65	0.96
"1-(5-{5-[(2S)-1-(1-Acetyl-4-piperidinyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}-2-pyridinyl)-4-piperidinecarboxamide"	ME1130331	0.07	0.12	4.36	1.38	0.11	0.50	0.95
"N-({(1S,4S,6S)-4-[2-(4-Acetyl-1-piperazinyl)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)-4-methoxybenzamide 4"	ME1131231	0.05	0.06	4.22	1.92	0.05	0.25	0.96
Taurocholic acid	ME1131518	0.06	0.04	4.52	1.66	0.03	0.21	0.97
Boc-NH-PEG3	ME1130738	0.12	0.21	3.41	1.27	0.60	0.80	1.09
Taurochenodeoxycholic Acid (sodium salt)	ME1131517	0.19	0.18	3.17	1.69	0.27	1.01	0.99
"N-({(1S,4S,6S)-4-[2-(4-Acetyl-1-piperazinyl)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)-4-methoxybenzamide 3"	ME1131230	0.24	0.19	3.27	1.89	0.15	0.49	1.26
"9,17,19,21-Tetrahydroxy-5,13-bis(3,4,5-trihydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0~2,11~.0~3,8~.0~15,20~]henicosa-2,8,10,15,17,19-hexaen-6-yl 3,4,5-trihydroxybenzoate"	ME1130639	0.18	0.18	3.77	1.94	0.21	0.32	0.86
"N-({(1S,4S,6S)-4-[2-(4-Acetyl-1-piperazinyl)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)-4-methoxybenzamide"	ME1131228	0.22	0.23	3.75	1.45	0.17	0.53	1.16
"N-({(1S,4S,6S)-4-[2-(4-Acetyl-1-piperazinyl)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)-4-methoxybenzamide 2"	ME1131229	0.21	0.23	3.75	1.45	0.16	0.53	1.16
Adenosine	ME1130671	3.62	0.42	0.95	0.02	0.27	1.30	0.93
Uridine monophosphate	ME1131571	3.14	1.32	2.03	0.01	0.02	0.01	0.96
2^-Deoxyguanosine 5^-monophosphate (dGMP)	ME1130452	3.98	0.81	1.50	0.04	0.05	0.05	1.03
Adenosine 5^-monophosphate	ME1130672	3.96	0.76	1.57	0.01	0.03	0.03	0.95
Indole-3-pyrubate	ME1131053	0.82	0.12	0.17	0.33	3.43	1.65	0.97
taurolithocholic acid sulfate	ME1131520	0.42	0.33	0.59	0.69	3.46	1.47	0.55
D-Ribose-1-phosphate	ME1130851	1.13	0.58	1.75	0.01	1.14	1.96	0.93
MFCD00025383	ME1131202	0.38	1.20	1.42	0.02	0.76	2.59	1.12
Xanthine	ME1131584	0.27	1.19	1.91	0.00	0.64	2.60	0.89
Xanthine 2	ME1131585	0.31	1.24	1.74	0.00	0.68	2.57	0.96
2-Nitrobenzoic acid	ME1130430	0.54	0.46	2.07	0.17	0.82	2.68	0.74
Hypoxanthine	ME1131041	0.37	0.70	2.14	0.01	1.07	2.37	0.85
Hypoxanthine 2	ME1131042	0.41	0.65	1.99	0.02	1.23	2.36	0.85
Carbaryl	ME1130769	0.50	0.63	0.68	0.76	0.72	3.57	0.63
Arabinosylhypoxanthine	ME1130701	0.47	0.15	1.03	0.00	1.08	3.64	1.12
Hypoxanthine 3	ME1131043	0.39	0.14	1.07	0.02	0.89	3.96	1.03
"1-(Methylnitrosoamino)-4-(3-pyridinyl)-1,4-butanediol"	ME1130333	0.44	3.62	2.21	0.16	0.14	0.15	0.78
"N-(1-Methyl-4-oxo-4,5-dihydro-1H-imidazol-2-yl)alanine"	ME1131232	1.94	1.64	1.67	0.33	0.47	0.48	0.95
2-Hydroxy-2-methylbutyric acid	ME1130415	2.17	1.62	1.28	0.45	0.47	0.52	0.99
2-Butoxyacetic acid	ME1130405	2.03	1.59	1.45	0.43	0.43	0.56	0.98
Tetrahydrofuran	ME1131526	2.03	1.59	1.45	0.43	0.43	0.56	0.98
"1-octadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine"	ME1130349	1.77	2.19	1.85	0.30	0.40	0.36	0.64
mercaptopurine	ME1131187	1.71	2.08	1.48	0.36	0.45	0.40	1.01
4-Vinylcyclohexene	ME1130575	0.84	1.81	1.93	0.37	0.47	0.48	1.48
7-hydroxy Pestalotin	ME1130619	0.82	1.86	2.43	0.36	0.44	0.54	1.04
3-Hydroxysebacic acid	ME1130500	0.83	1.98	2.55	0.44	0.34	0.40	0.96
N-Methylglutamate	ME1131294	0.81	2.08	2.47	0.36	0.37	0.39	1.01
6-Thio-dG	ME1130614	1.16	1.97	2.38	0.24	0.34	0.52	0.88
3-(4-Hydroxy-3-methoxyphenyl)-1-(3-pentyl-2-oxiranyl)-1-propanone	ME1130467	1.07	2.02	2.26	0.34	0.39	0.38	0.93
"Methyl (E,E,Z)-2,4,6-Decatrienoate"	ME1131195	1.01	1.93	2.23	0.47	0.35	0.38	0.87
"2,4,5-trimethoxyamphetamine 3"	ME1130444	0.72	2.60	2.29	0.24	0.28	0.40	0.97
4-one	ME1130564	1.05	2.29	2.39	0.26	0.29	0.32	0.88
isoetarine	ME1131058	0.90	2.31	2.53	0.25	0.25	0.29	0.96
Salbutamol	ME1131471	0.95	2.33	2.42	0.23	0.25	0.27	1.04
ent-Pellotine	ME1130920	0.60	1.86	2.58	0.51	0.52	0.66	0.74
epsilon-Caprolactone	ME1130923	0.64	1.59	2.64	0.33	0.47	0.91	0.91
"4-[(Dimethylamino)methyl]tetrahydrofuran-2,3-dione"	ME1130539	0.73	1.66	2.45	0.51	0.43	0.82	0.90
(2E)-3-(4-Hydroxy-3-methoxyphenyl)-N-(4-oxobutyl)acrylamide	ME1130213	0.82	1.74	2.32	0.38	0.40	0.88	0.92
2H-Pyran	ME1130460	0.77	1.80	2.28	0.51	0.43	0.80	0.91
2-Isocapryloyl-3R-hydroxymethyl-gamma-butyrolactone 2	ME1130423	0.98	1.73	2.56	0.37	0.35	0.45	0.96
Butyryl-L-homoserine lactone	ME1130749	1.07	1.57	2.48	0.31	0.41	0.65	1.01
4-Hydroxynonenal 2	ME1130555	1.19	1.59	2.49	0.39	0.37	0.50	0.96
Sebacic acid 2	ME1131479	1.19	1.59	2.49	0.39	0.37	0.50	0.96
Crotanecine 2	ME1130807	0.95	1.72	2.83	0.25	0.30	0.52	0.94
4-Oxo-2-propylpentanoic acid 2	ME1130567	1.03	1.45	2.97	0.31	0.38	0.43	0.89
"5-(4,4-Dimethyl-5-hexen-1-yl)-1,3-benzodioxole"	ME1130580	0.96	1.47	2.71	0.38	0.44	0.60	0.95
Gly-l-pro	ME1130978	0.43	1.84	2.91	0.73	0.37	0.45	0.75
Ethyl linolenate	ME1130929	0.48	2.21	2.21	0.62	0.59	0.63	0.55
"(1S,2R,5S)-2-Isopropyl-5-methylcyclohexyl 3-oxobutanoate"	ME1130195	0.58	2.10	2.25	0.44	0.52	0.58	0.96
"DL-2,6-Diaminopimelic acid"	ME1130872	0.51	2.16	2.28	0.81	0.43	0.44	0.88
SBHA 2	ME1131477	0.54	2.10	2.25	0.85	0.38	0.51	0.86
Bucillamine	ME1130743	0.73	2.50	3.13	0.06	0.05	0.05	0.98
Timonacic	ME1131543	0.81	2.56	2.98	0.04	0.04	0.04	1.02
Bucillamine 2	ME1130744	0.78	2.60	3.02	0.05	0.05	0.05	0.95
Dimethyl disulfide	ME1130868	0.76	2.56	3.08	0.06	0.04	0.04	0.97
n-Hexanamide	ME1131292	0.95	2.20	2.95	0.11	0.15	0.12	0.95
"(6R,7S)-6,7-Dihydroxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl (2E)-2-methyl-2-butenoate"	ME1130293	0.91	2.29	2.74	0.17	0.17	0.18	1.02
prohydrojasmon	ME1131418	1.02	2.13	2.77	0.18	0.17	0.17	1.06
"2,7-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one"	ME1130451	0.53	1.82	3.15	0.14	0.22	0.41	1.24
9-Oxononanoic acid 3	ME1130637	0.92	1.69	3.71	0.10	0.08	0.12	0.87
2-(Diethoxymethyl)furan	ME1130393	0.82	1.76	3.39	0.12	0.17	0.29	0.94
(_)-trans-Methyl dihydrojasmonate	ME1130179	0.86	1.53	3.29	0.27	0.25	0.36	0.93
elasnin	ME1130915	1.83	2.58	3.00	0.03	0.01	0.03	0.01
1-Vinyl-2-pyrrolidone	ME1130355	1.42	1.74	2.79	0.09	0.24	0.18	1.03
Vigabatrin	ME1131578	1.42	1.74	2.79	0.09	0.24	0.18	1.03
N-butyryl-L-Homocysteine thiolactone	ME1131287	2.26	2.16	2.11	0.00	0.00	0.00	0.97
snvp	ME1131490	2.12	2.15	2.32	0.04	0.04	0.05	0.77
Pipecolic acid 2	ME1131402	1.76	1.98	2.22	0.09	0.19	0.04	1.11
Guanosine monophosphate (GMP)	ME1131006	1.60	2.42	2.55	0.01	0.01	0.01	0.90
N-[(2S)-2-Hydroxypropanoyl]methionine	ME1131254	1.72	2.29	2.44	0.08	0.05	0.07	0.84
N-Acetyl-S-allyl-L-cysteine	ME1131276	1.73	2.30	2.45	0.07	0.03	0.06	0.85
Sulfathiazole	ME1131501	2.17	0.29	0.07	1.08	1.95	0.07	1.85
glyceraldehyde 3-phosphate	ME1130984	3.75	0.53	0.35	1.12	0.92	0.18	0.61
"(4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-Nonadecapentaenoic acid"	ME1130278	2.92	0.56	0.72	0.88	0.49	0.96	0.92
Solasodine	ME1131491	3.05	0.97	0.45	0.43	0.76	0.36	1.18
DL-decyline	ME1130884	2.78	0.83	0.72	0.82	0.83	0.55	0.89
Purine 2	ME1131435	2.80	1.09	0.62	0.70	0.98	0.47	0.83
"(2Z,6E)-N-(2-Hydroxyethyl)-2-methyl-2,6-icosadienamide"	ME1130253	2.70	1.36	0.62	0.48	0.60	0.37	1.20
"(5Z,8Z,11Z,14Z)-N-(2-Hydroxyethyl)-N-propyl-5,8,11,14-icosatetraenamide"	ME1130287	2.43	1.11	0.64	0.60	0.89	0.45	1.16
Medrogestone	ME1131175	3.36	0.46	0.57	0.60	0.79	0.72	0.74
N-Palmitoyl-L-histidine	ME1131304	3.45	0.67	0.81	0.33	0.87	0.41	0.93
"3,6-Anhydro-1-O-[2-(dodecanoyloxy)ethyl]-2,4,5-tris-O-(2-hydroxyethyl)hexitol"	ME1130529	3.37	0.81	0.27	0.56	1.11	0.39	0.98
"(3beta)-Cholesta-5,7-dien-3-yl hydrogen sulfate"	ME1130261	2.82	0.75	0.41	0.64	1.31	0.42	1.14
"(6R)-6-[(3,6-Dideoxy-4-O-{(6R)-6-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]heptanoyl}-alpha-L-arabino-hexopyranosyl)oxy]heptanoic acid"	ME1130294	3.01	0.57	0.35	0.65	1.35	0.46	1.10
2-Acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranuronosyl)-6-O-sulfo-D-galactopyranose	ME1130397	2.29	1.43	0.30	1.15	1.24	0.30	0.76
p-Cresylsulfate	ME1131374	2.14	1.95	0.18	1.21	0.79	0.34	0.90
"(18R,24S)-21,24,25-Trihydroxy-21-oxido-15-oxo-16,20,22-trioxa-21lambda~5~-phosphapentacosan-18-yl (4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-docosahexaenoate"	ME1130192	1.82	0.50	0.92	1.02	1.51	0.43	1.29
Cytosine	ME1130824	1.58	0.92	0.72	1.30	1.60	0.78	0.61
1-Palmitoyl-2-linoleoyl-sn-glycero-phosphatidylcholine	ME1130352	1.77	1.30	0.73	0.69	1.63	0.44	0.94
"(3E)-2,5-Dioxo-3-hexenal 2"	ME1130266	1.59	1.11	0.51	1.00	1.70	0.59	0.95
Sebacic acid	ME1131478	2.23	0.85	1.01	0.75	0.85	0.96	0.84
"1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine 2"	ME1130326	2.04	1.00	0.83	0.74	0.77	1.06	1.05
Perchloric acid	ME1131387	1.99	1.09	0.69	0.76	0.89	0.83	1.09
nebrosteroid M	ME1131334	1.53	1.01	0.90	1.61	0.71	0.47	1.26
"(2R)-3-(Heptadecanoyloxy)-2-[(9Z,12Z,15Z)-9,12,15-octadecatrienoyloxy]propyl (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoate"	ME1130226	2.13	0.95	0.83	1.35	0.51	0.43	1.30
"(9alpha)-9,10-Secostigmasta-1,3,5(10)-triene-3,8,9-triol"	ME1130303	2.13	0.94	0.84	1.33	0.52	0.41	1.31
thr-arg	ME1131534	0.24	1.43	0.78	3.20	0.29	0.64	0.91
thr-arg 2	ME1131535	0.22	1.44	1.06	3.04	0.33	0.63	0.77
CHOLESTERYL EICOSAPENTAENOATE	ME1130779	1.18	1.02	0.46	2.35	0.52	0.69	1.09
240I539PWQ 3	ME1130458	1.05	0.65	0.64	2.52	0.89	0.65	1.09
1-Heptanethiol	ME1130339	0.75	0.79	0.62	2.97	0.68	0.67	0.96
L-(+)-Leucine	ME1131082	0.75	0.92	0.76	2.60	0.85	0.72	0.90
6-Thio-5â€_-xanthylic acid	ME1130613	0.34	0.43	0.68	1.13	0.89	0.83	3.19
RC8815000	ME1131452	1.11	0.81	0.38	1.11	0.83	0.30	2.96
MFCD00272697	ME1131211	0.95	0.25	0.31	1.39	1.36	0.51	2.72
Uric acid	ME1131568	0.72	0.51	0.53	1.53	0.87	0.52	2.80
Uric acid 2	ME1131569	0.73	0.60	0.58	1.49	0.85	0.51	2.73
lactide 2	ME1131134	0.93	1.23	0.51	1.21	0.51	1.00	1.90
"4-[(4-phenethyl-1,4-diazepan-1-yl)sulfonyl]-2,1,3-benzoxadiazole"	ME1130538	1.14	0.85	0.80	1.44	0.67	0.37	2.04
afegostat 2	ME1130676	1.21	0.62	0.72	1.46	0.87	0.44	2.09
(9E)-N-(2-Hydroxyethyl)-9-octadecenamide	ME1130305	1.46	0.72	0.85	1.57	2.08	0.63	0.08
Gemfibrozil 1-O-Î_-Glucuronide	ME1130958	0.13	3.53	0.63	1.20	0.35	0.91	0.66
Zalcitabine 2	ME1131592	0.38	3.41	0.16	1.60	0.44	0.67	0.83
Histidylglycine	ME1131025	0.29	3.18	1.15	1.35	0.26	0.38	0.89
Physovenine	ME1131398	0.18	3.08	1.11	1.10	0.53	0.76	0.73
"(2-Hydroxy-2-oxido-1,3,2-dioxaphospholan-4-yl)methyl (9Z,12Z)-9,12-octadecadienoate"	ME1130200	0.46	3.10	1.09	0.81	0.40	0.43	1.21
Jasmone	ME1131064	0.36	2.99	1.23	0.49	0.52	0.86	1.04
"Methyl (2E,4E)-2,4-decadienoate"	ME1131194	0.36	2.99	1.23	0.49	0.52	0.86	1.04
"1,3,7-Trimethyluric acid"	ME1130365	0.18	2.56	0.73	2.29	0.29	0.54	0.91
ser-gln 2	ME1131483	0.43	2.79	1.69	1.38	0.11	0.36	0.73
Ser-Ser	ME1131485	0.48	1.94	1.59	1.73	0.31	0.48	0.97
Ser-Ser 2	ME1131486	0.48	1.91	1.50	1.77	0.30	0.41	1.13
1D-1-guanidino-1-deoxy-3-dehydro-scyllo-inositol	ME1130381	0.36	1.93	1.86	1.74	0.28	0.46	0.84
1D-1-guanidino-1-deoxy-3-dehydro-scyllo-inositol 2	ME1130382	0.44	2.02	1.77	1.62	0.25	0.48	0.90
CAY10767	ME1130774	0.63	1.92	1.34	2.03	0.18	0.64	0.74
ser-arg	ME1131481	0.44	1.76	1.43	2.03	0.37	0.49	0.98
"3,8-Dimethyl-7-decen-1-yl dihydrogen phosphate"	ME1130532	0.17	2.74	1.02	1.80	0.27	0.43	1.06
dribendazole	ME1130911	0.36	2.77	1.19	1.72	0.20	0.40	0.80
ser-gln 3	ME1131484	0.39	2.69	1.25	1.71	0.25	0.36	0.84
Arg-Gly	ME1130704	0.52	2.47	1.11	1.89	0.21	0.37	0.92
Gly-Arg	ME1130975	0.47	2.46	1.24	1.82	0.20	0.38	0.93
"2,6-Diamino-4-methyleneheptanedioic acid"	ME1130448	0.78	2.25	1.27	1.50	0.27	0.31	1.11
PP121	ME1131415	0.49	2.17	1.13	1.79	0.45	0.44	1.01
"1,11,21-Trihydroxy-1,6,11,16,21,26-hexaazacyclohentriacontane-2,5,12,15,22,25-hexone"	ME1130357	0.51	2.18	1.11	1.76	0.47	0.41	1.05
RLH	ME1131460	0.52	2.18	1.12	1.75	0.44	0.44	1.05
4-fluoro ABUTINACA	ME1130546	0.20	2.53	1.82	0.67	0.50	0.59	1.12
"1-(3,4-Dihydroxyphenyl)-5-hydroxy-3-decanone"	ME1130328	0.54	2.85	1.79	0.38	0.39	0.59	0.94
"2-Dimethylamino-5,6-dimethyl-4-hydroxypyrimidine"	ME1130409	0.87	2.57	1.91	0.36	0.35	0.60	0.84
leu-lys	ME1131143	0.96	2.34	1.62	1.05	0.16	0.52	0.83
Ascosalitoxin 2	ME1130713	0.99	1.96	1.63	0.74	0.41	1.04	0.58
Tiglylcarnitine 2	ME1131542	0.87	2.25	1.79	0.37	0.43	0.61	1.17
Zalcitabine	ME1131591	1.15	2.25	1.67	0.47	0.47	0.58	0.91
Anserine	ME1130697	1.15	2.18	1.63	0.49	0.48	0.68	0.89
balenine	ME1130721	1.18	2.10	1.67	0.49	0.48	0.66	0.92
"Methyl (2E,4E,6S)-6-hydroxy-2,4-decadienoate"	ME1131193	0.75	1.81	2.15	1.25	0.09	0.43	0.84
"4,5-Dihydroxy-3-oxo-1-cyclohexene-1-carboxylic acid"	ME1130578	0.41	1.89	2.04	0.89	0.49	0.50	1.27
L-Alanyl-L-glutamine 2	ME1131089	0.45	1.87	2.02	1.13	0.45	0.66	0.88
4-Hydroxybenzaldehyde	ME1130553	0.56	1.58	1.73	1.27	0.58	0.63	1.15
Glycylglutamic acid 2	ME1130998	0.76	1.43	2.10	1.19	0.51	0.54	0.94
3-Methyl-2-butenyl caffeate	ME1130505	0.37	2.09	1.07	0.95	0.71	1.36	0.95
MFCD08063737	ME1131214	0.36	2.31	0.94	0.91	0.65	1.37	0.95
"(1S)-1,5-Anhydro-1-benzyl-D-galactitol"	ME1130197	0.36	2.31	0.94	0.91	0.65	1.37	0.95
Butylphthalide	ME1130748	0.36	2.31	0.94	0.91	0.65	1.37	0.95
3-Hydroxy-2-(3-methyl-2-buten-1-yl)phenyl hexopyranosiduronic acid	ME1130492	0.49	2.08	1.26	0.62	0.73	1.57	0.74
"6-Methyl[1,2,4]triazolo[4,3-b]pyridazin-8-ol"	ME1130606	0.49	1.86	1.38	0.66	0.86	1.27	0.98
4-Methyleneglutamine	ME1130561	0.16	2.38	1.38	1.32	0.34	0.80	1.10
Gly-thr	ME1130983	0.15	2.38	1.38	1.32	0.34	0.80	1.10
"2,4,6-triaminotoluene"	ME1130445	0.34	2.58	1.36	1.10	0.49	0.69	0.92
N-(2-Cyanoethyl)-L-glutamine	ME1131236	0.34	2.34	1.49	1.10	0.54	0.76	0.93
Drospirenone	ME1130912	0.58	2.20	1.08	0.99	0.64	0.82	1.14
tp	ME1131546	0.56	2.43	1.21	0.99	0.48	0.70	1.13
meglumine	ME1131176	0.64	2.02	0.99	1.12	0.87	0.84	1.01
2-Acetylthiazole	ME1130398	0.52	1.94	1.22	1.11	0.62	1.05	1.02
"Icosa-5,8,11,14-tetraenoic acid"	ME1131048	0.61	1.77	1.13	1.19	0.72	0.92	1.16
Gly-His	ME1130977	0.77	1.95	1.54	1.42	0.40	0.52	0.90
MFCD00079614	ME1131205	0.57	2.09	1.47	1.28	0.45	0.61	1.03
"N-(3-Aminopropyl)-3-(3,4-dihydroxyphenyl)propanamide"	ME1131238	0.46	1.96	1.54	1.21	0.52	0.76	1.02
Prostaglandin G2	ME1131431	0.28	2.20	1.53	0.82	0.58	0.85	1.07
(10E)-9-Hydroxy-11-(3-pentyl-2-oxiranyl)-10-undecenoic acid	ME1130182	0.56	1.81	1.54	0.93	0.62	0.96	1.00
N~2~-(1-Carboxyethyl)-N~5~-(diaminomethylene)ornithine	ME1131320	0.49	1.91	1.58	0.97	0.53	1.06	0.96
1-(1-Acetoxyethyl)-7-isopropyl-4-methylene-2-oxooctahydro-1H-inden-5-yl (2Z)-2-methyl-2-butenoate	ME1130323	0.55	2.05	1.36	0.92	0.75	0.85	0.97
tetramethyl Nordihydroguaiaretic Acid	ME1131530	0.55	2.05	1.36	0.92	0.75	0.85	0.97
LU3453000 3	ME1131156	0.70	1.80	1.42	1.10	0.70	0.85	0.93
"_,_-Trehalose"	ME1131595	0.68	1.89	1.39	1.02	0.73	0.78	1.00
20-Hydroxyeicosatetraenoic acid	ME1130453	0.57	1.83	1.82	0.84	0.64	0.68	1.12
(Â±)5(6)-DiHET lactone	ME1130308	0.58	1.75	1.73	0.87	0.72	0.78	1.05
aloxistatin	ME1130687	0.58	1.75	1.73	0.87	0.72	0.78	1.05
"Abieta-8(14),9(11),12-triene-12,18-diol"	ME1130640	0.54	2.02	1.75	0.92	0.59	0.70	0.97
D-(+)-Maltose	ME1130832	0.62	2.18	1.54	0.92	0.60	0.64	1.00
Gly-Arg 2	ME1130976	0.45	1.43	3.43	0.73	0.45	0.71	0.30
6-Hydroxykynurenic acid	ME1130604	0.46	1.28	3.24	0.50	0.37	0.74	0.90
Hypotaurine	ME1131040	0.50	0.86	3.59	0.45	0.42	0.71	0.96
3-Carboxyindole	ME1130491	0.22	0.60	3.07	0.42	0.42	1.64	1.11
Indole-3-carboxilic acid-O-sulphate	ME1131051	0.21	0.68	2.96	0.45	0.47	1.56	1.17
S-Sulfocysteine 2	ME1131466	0.57	0.58	2.99	0.59	0.90	1.02	0.85
11-dehydro Thromboxane B2-d4	ME1130370	0.62	0.54	2.76	0.51	0.90	1.18	0.94
S-Sulfocysteine	ME1131465	0.53	0.45	2.86	0.57	0.91	1.07	1.09
2-morpholinoacetic acid	ME1130429	0.89	0.98	2.73	0.43	0.56	1.05	0.86
Glycine	ME1130989	0.75	1.02	3.12	0.24	0.40	0.96	0.80
"(8S,13R)-8-Amino-1,1,4-trihydroxy-7,11,14-trioxo-13-(sulfanylmethyl)-2,6-dioxa-12,15-diaza-1-phosphaheptadecan-17-oic acid 1-oxide"	ME1130301	0.57	1.30	2.81	0.60	0.56	0.75	0.90
Aminohippuric acid	ME1130692	0.72	1.23	2.83	0.45	0.69	0.79	0.78
propionylcarnitine	ME1131429	0.95	1.14	2.89	0.49	0.44	0.61	0.98
3-oxo-C12-HSL	ME1130513	0.99	1.25	2.54	0.55	0.51	0.58	1.07
"5-Nonyl-1,3-benzenediol"	ME1130592	1.01	1.15	2.44	0.43	0.61	0.69	0.95
"3,4-Diaminopyridine 2"	ME1130523	0.63	1.35	2.17	0.59	0.74	1.10	0.90
meprobamate	ME1131183	0.63	1.35	2.17	0.59	0.74	1.10	0.90
MFCD06798381	ME1131213	0.54	1.23	2.26	0.71	0.90	0.95	0.92
alpha-Cyano-4-hydroxycinnamic acid	ME1130688	0.61	1.17	2.18	0.66	0.86	1.06	0.94
_-L-Glutamyl-L-glutamic acid	ME1131596	0.66	1.24	2.23	0.73	0.79	1.00	0.85
3-[3-Methoxy-4-(sulfooxy)phenyl]propanoic acid 3	ME1130474	0.57	1.13	2.02	0.78	0.66	1.26	1.08
L-Homocysteic acid	ME1131105	0.70	1.23	2.10	0.83	0.61	1.08	0.95
(±)-Malic Acid	ME1130178	0.66	1.18	2.21	0.69	0.50	1.26	0.99
"(5E,7E)-8-Nitro-5,7-tetradecadienoic acid"	ME1130280	0.64	1.46	2.27	0.42	0.60	1.04	1.08
3-(2-Furylmethyl)-1H-pyrrole	ME1130463	0.59	1.24	2.38	0.54	0.51	1.13	1.10
L-Phenylalanine 5	ME1131114	0.59	1.24	2.38	0.54	0.51	1.13	1.10
6-Oxo-pipecolinic acid 2	ME1130609	0.59	1.16	2.54	0.70	0.52	1.15	0.82
Ruspolinone	ME1131462	0.81	1.32	2.42	0.57	0.45	1.03	0.77
2-Oxoglutaric acid	ME1130434	0.98	0.95	2.32	0.44	0.58	1.04	1.19
3-oxolauric acid	ME1130515	0.82	0.84	1.95	0.51	0.85	1.46	1.06
"(2S)-3-{[(1Z)-11-Methyl-1-dodecen-3-yn-1-yl]oxy}-1,2-propanediol"	ME1130241	0.72	0.85	2.11	0.51	0.80	1.41	1.09
9-Hydroxydodecanoic acid	ME1130634	0.74	0.82	2.14	0.44	0.86	1.40	1.07
Uracil	ME1131565	0.76	0.79	2.09	0.68	0.73	1.28	1.16
3-oxopalmitic acid	ME1130516	0.83	0.92	2.10	0.46	0.67	1.22	1.14
MFCD00059633	ME1131204	0.88	0.86	2.14	0.45	0.79	1.20	1.10
MFCD12546417	ME1131215	0.16	1.26	2.77	0.66	0.34	1.47	0.85
2-(Acetylsulfamoyl)benzoic acid 2	ME1130392	0.36	0.74	2.66	0.49	0.71	1.45	1.09
Propionic acid	ME1131428	0.48	1.01	2.29	0.60	0.75	1.47	0.89
Acetanilide	ME1130646	0.35	0.95	2.35	0.63	0.74	1.43	1.04
Hippuric acid	ME1131022	0.36	0.94	2.34	0.64	0.75	1.43	1.03
Nicotinuric acid	ME1131339	0.35	0.97	2.55	0.61	0.79	1.33	0.87
4-(6-Hydroxy-3-pyridinyl)-4-oxobutanal	ME1130534	0.35	0.98	2.50	0.56	0.66	1.42	1.00
Methylmalonic acid	ME1131197	0.42	0.95	2.50	0.51	0.68	1.54	0.90
2-Aminophenyl hydrogen sulfate	ME1130403	0.30	1.13	2.56	0.85	0.36	1.09	1.20
"4-Ethyl-2,6-dihydroxyphenyl hydrogen sulfate"	ME1130545	0.48	1.17	2.64	0.55	0.49	1.02	1.15
2-Hydroxy-6-methoxy-4-vinylphenyl hydrogen sulfate	ME1130419	0.35	1.00	2.56	0.66	0.48	1.41	1.04
8-Hydroxyquinoline 2	ME1130630	0.43	1.18	2.65	0.49	0.50	1.29	0.96
8-Hydroxyquinoline 3	ME1130631	0.43	1.18	2.65	0.49	0.50	1.29	0.96
3-[3-Methoxy-4-(sulfooxy)phenyl]propanoic acid 2	ME1130473	0.23	0.98	2.26	0.38	0.95	1.40	1.30
HIAA	ME1131021	0.36	1.30	2.00	0.59	0.79	1.49	0.96
Dodecanedioic acid 3	ME1130907	0.47	1.16	2.46	0.98	0.68	0.97	0.77
quinol sulfate 2	ME1131451	0.25	1.27	2.40	1.03	0.98	0.72	0.84
4-Ethyl-2-hydroxy-6-methoxyphenyl hydrogen sulfate	ME1130544	0.27	1.02	3.05	0.53	0.38	0.89	1.20
Lanthionine ketimine	ME1131135	0.25	1.07	2.87	0.75	0.36	1.06	1.14
Sulfosalicylic Acid	ME1131504	0.24	0.88	2.86	0.89	0.60	1.18	0.85
Homovanillic acid sulfate	ME1131031	0.25	0.79	2.49	1.24	0.64	1.03	1.06
Phloionolic acid	ME1131395	0.48	0.71	2.75	0.97	0.60	0.88	1.07
Taurodeoxycholic acid	ME1131519	0.57	0.21	2.43	1.56	0.71	1.05	0.96
trans-3-Indoleacrylic acid	ME1131549	0.26	0.72	2.69	1.68	0.40	1.51	0.25
"1-{[(3R,6R)-6-{[4-(4-Biphenylyl)-1H-1,2,3-triazol-1-yl]methyl}-1-azabicyclo[2.2.2]oct-3-yl]carbonyl}-4-piperidinecarboxamide"	ME1130334	0.50	0.56	2.27	0.71	1.34	1.36	0.75
DA6495000	ME1130854	0.26	0.52	2.02	0.75	1.21	1.96	0.76
3-Aminopyridine-2-carboxaldehyde thiosemicarbazone	ME1130481	0.56	0.57	2.21	0.55	0.80	1.80	1.00
Indole-3-carboxilic acid-O-sulphate 2	ME1131052	0.35	0.43	1.97	0.73	1.03	1.77	1.23
Ferulic acid 4-sulfate	ME1130935	0.24	1.00	1.68	1.64	0.75	1.18	1.02
kakuol	ME1131067	0.21	0.96	1.87	1.72	0.70	0.95	1.07
(5Z)-N-[(2R)-5-Oxotetrahydro-2-furanyl]-5-dodecenamide	ME1130289	0.49	0.99	1.62	1.17	0.93	1.25	1.00
"N-[(2S)-1-Amino-3,3-dimethyl-1-oxo-2-butanyl]-1-(2-phenylethyl)-1H-indazole-3-carboxamide"	ME1131253	0.43	0.94	1.80	1.10	1.03	1.11	1.07
3-[4-Hydroxy-3-(sulfooxy)phenyl]propanoic acid	ME1130476	0.43	0.93	2.06	1.03	0.78	1.20	1.06
Vanillic acid 4-sulfate	ME1131574	0.40	1.01	1.86	1.22	0.79	1.18	1.04
(2E)-3-Methyl-4-(sulfooxy)-2-butenoic acid	ME1130214	0.14	1.30	2.23	1.29	0.45	1.28	0.81
"3,4-Dihydroxyphenylglycol O-sulfate"	ME1130525	0.32	0.96	2.16	1.33	0.38	1.09	1.23
3-[3-Methoxy-4-(sulfooxy)phenyl]propanoic acid	ME1130472	0.23	0.93	2.16	0.99	0.59	1.46	1.14
quinol sulfate	ME1131450	0.17	0.68	2.37	1.10	0.44	1.46	1.26
L-Phenylalanine 3	ME1131112	0.52	0.89	1.81	1.60	0.57	1.49	0.61
meprobamate 4	ME1131186	0.63	1.06	1.34	1.47	0.80	1.34	0.86
"(2S)-1-Hydroxy-3-(tridecanoyloxy)-2-propanyl (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoate"	ME1130237	0.92	0.70	1.20	1.40	1.09	1.53	0.62
adrenaline	ME1130674	0.66	0.78	1.21	1.56	0.85	1.67	0.76
Bolandiol dipropionate	ME1130740	0.96	0.30	1.84	1.19	0.72	1.70	0.79
8-Hydroxyhexadecanedioic acid	ME1130628	0.56	0.54	1.73	1.23	1.17	1.30	0.91
Ardisianone 2	ME1130703	0.56	0.42	1.61	1.39	1.03	1.52	0.96
Bis(2-ethylhexyl) phthalate	ME1130737	0.24	0.19	1.56	1.46	1.03	1.95	1.07
pladienolide B	ME1131411	0.18	0.28	1.88	1.39	0.95	1.79	1.03
"(6aR,10aR)-6,6,9-Trimethyl-3-octyl-6a,7,10,10a-tetrahydro-6H-benzo[c]chromen-1-ol"	ME1130290	0.20	0.22	1.73	1.48	1.15	1.68	1.06
ANDROSTENEDIOL 3-TETRAHYDROPYRANYL ETHER	ME1130696	0.20	0.22	1.73	1.48	1.15	1.68	1.06
metixene	ME1131200	0.12	0.37	0.32	1.57	2.76	1.51	0.84
Guanidinosuccinic acid 2	ME1131005	0.76	0.55	0.76	1.43	2.17	0.86	0.96
FRAX597	ME1130942	0.89	0.97	0.48	1.12	1.87	1.18	0.98
Glycerophosphoglycerol	ME1130987	0.71	0.72	0.63	1.07	2.22	1.23	0.93
Glycerophosphoglycerol 2	ME1130988	0.73	0.71	0.59	1.14	2.21	1.18	0.93
3-Thiomorpholinecarboxylic acid	ME1130518	1.04	0.52	0.27	0.86	3.04	0.86	0.91
Orthanilic acid	ME1131368	1.09	0.51	0.30	0.81	2.61	1.33	0.82
7-Heptyl-2-methyl-2-(4-methyl-3-penten-1-yl)-2H-chromen-5-ol	ME1130617	0.68	0.05	0.37	1.59	1.64	2.27	0.90
pregnenolone acetate	ME1131417	0.09	0.11	0.12	1.63	2.06	2.68	0.80
"2,3-Dinor-6-keto-PGF1?"	ME1130440	0.06	0.12	0.11	1.93	1.96	2.43	0.90
2-arachidonoylglycerol	ME1130404	0.14	0.10	0.28	1.86	1.82	2.42	0.88
L-Isoleucyl-D-alanyl-L-arginyl-D-arginyl-L-histidyl-L-prolyl-L-tyrosyl-D-phenylalanyl-D-leucine	ME1131107	0.33	0.54	0.98	1.23	1.12	1.66	1.64
N-[(9Z)-3-Hydroxy-9-hexadecenoyl]glycine	ME1131257	0.34	0.38	0.99	1.09	1.42	2.40	0.86
3-Hydroxytetradecanedioic acid	ME1130501	0.56	0.44	1.01	0.92	1.34	2.26	0.96
N-[(9Z)-3-Hydroxy-9-octadecenoyl]glycine	ME1131258	0.45	0.52	1.09	1.03	1.34	2.05	0.92
Icaridin	ME1131047	0.38	1.03	0.94	1.45	1.09	1.53	1.04
MFCD00153469	ME1131208	0.36	1.16	0.86	1.29	1.10	1.66	1.04
"(2S,3R,4E)-2-[(13Z)-13-Docosenoylamino]-3-hydroxy-4-octadecen-1-yl 5-acetamido-6-[(1S,2R)-2-({5-acetamido-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranonosyl}oxy)-1,3-dihydroxypropyl]-3,5-dideoxy-beta-L-threo-hex-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside"	ME1130231	0.15	0.78	1.04	1.36	1.23	1.91	1.02
4-Pyridoxic acid	ME1130571	0.58	0.85	1.30	0.85	1.32	1.74	0.86
zoapatanol	ME1131594	0.50	0.60	1.18	1.03	1.35	1.78	1.04
Creatinine 2	ME1130803	0.65	0.57	0.90	1.29	1.26	1.97	0.85
"(2E,4E,7E)-9-Oxo-2,4,7-decatrienoic acid"	ME1130209	0.60	0.78	0.90	0.98	1.42	1.83	0.98
Homo-L-arginine	ME1131026	0.51	0.92	0.85	1.16	1.24	1.88	0.93
Homo-L-arginine 2	ME1131027	0.44	0.91	0.90	1.13	1.41	1.79	0.92
"(2E,4E,6S,8E,11E)-6-Hydroxy-2,4,8,11-tetradecatetraenoic acid"	ME1130208	0.64	0.75	0.98	1.13	1.32	1.66	1.00
LT9970000 2	ME1131155	0.50	0.68	0.91	1.34	1.36	1.68	1.03
"(2E,5Z,7E)-decatrienoylcarnitine"	ME1130210	0.56	0.69	0.97	1.28	1.28	1.72	0.99
LT9970000	ME1131154	0.58	0.79	0.95	1.25	1.23	1.70	1.00
"16,16-Dimethyl prostaglandin A1"	ME1130379	0.51	0.69	1.01	1.13	1.51	1.67	0.87
Butenylcarnitine	ME1130745	0.40	0.67	0.89	1.27	1.46	1.89	0.90
N-STEAROYLSPHINGOMYELIN	ME1131308	0.81	0.57	0.65	1.13	1.10	2.04	1.19
Anapheline	ME1130695	0.81	0.79	0.93	1.02	0.83	2.25	0.66
2-isopropylmaleic acid	ME1130424	0.87	0.91	0.92	0.90	1.12	1.88	0.88
vuf10460	ME1131583	0.66	0.85	0.92	1.05	1.16	2.03	0.82
"N-[(2S,3R)-1,3-Dihydroxy-2-octadecanyl]-2-hydroxyheptacosanamide"	ME1131251	0.48	1.02	0.44	1.37	1.41	1.97	0.81
lentiginosine	ME1131140	1.09	0.54	0.71	1.00	1.46	1.84	0.85
D-(+)-Pyroglutamic Acid 2	ME1130834	0.72	0.81	0.62	1.09	1.65	1.64	0.97
L-2-Aminoadipic acid	ME1131086	0.72	0.81	0.62	1.09	1.65	1.64	0.97
Diosgenin	ME1130871	0.26	0.27	0.78	1.90	1.26	1.95	1.05
Hydrocortisone caproate	ME1131035	0.20	0.11	0.78	2.16	1.55	1.58	1.10
2IAP3WIO1P	ME1130461	0.37	0.32	0.35	1.77	1.69	2.06	0.93
Limaprost	ME1131149	0.20	0.24	0.52	1.79	1.63	2.12	0.98
(+)-10-Deoxymethynolide	ME1130172	0.18	0.27	0.36	1.78	1.92	2.01	0.98
(2S)-2-Hydroxy-3-[(10Z)-10-tetradecenoyloxy]propanoic acid	ME1130239	0.23	0.31	0.30	1.98	1.85	1.85	0.97
N-nonanoyl-L-Homoserine lactone	ME1131300	0.26	0.37	0.60	1.38	1.70	2.14	1.04
N-nonanoyl-L-Homoserine lactone 2	ME1131301	0.25	0.41	0.63	1.28	1.64	2.30	0.98
8-(5-Butyl-2-furyl)octanoic acid	ME1130622	0.49	0.51	0.57	1.26	1.51	2.08	0.88
Albuterol Methyl Ether	ME1130682	0.29	0.47	0.75	1.36	1.44	2.03	0.99
Traumatin	ME1131554	0.29	0.47	0.75	1.36	1.44	2.03	0.99
Formiminoglutamic Acid	ME1130939	0.42	0.37	0.64	1.85	1.62	1.52	1.06
Artemotil	ME1130705	0.30	0.53	0.55	1.73	1.65	1.77	0.96
JH-III	ME1131065	0.30	0.53	0.55	1.73	1.65	1.77	0.96
13-Hydroxy-9-methoxy-10-oxo-11-octadecenoic acid	ME1130373	0.34	0.56	0.62	1.69	1.61	1.63	1.01
4-tert-Octylphenol monoethoxylate	ME1130573	0.34	0.58	0.61	1.57	1.65	1.74	1.00
(10S)-Juvenile hormone III diol	ME1130183	0.28	0.35	0.60	1.59	1.79	1.89	0.99
Geranyl isovalerate	ME1130959	0.28	0.35	0.60	1.59	1.79	1.89	0.99
"(6E,8R,10Z)-8-Hydroxy-3-oxo-6,10-hexadecadienoic acid"	ME1130291	0.37	0.43	0.58	1.49	1.73	1.88	1.01
Alosetron	ME1130686	0.39	0.38	0.48	1.53	1.83	1.92	0.96
Heptadecanedioic acid	ME1131011	0.40	0.37	0.65	1.47	1.61	1.72	1.15
Pentadecanedioic acid	ME1131384	0.32	0.38	0.70	1.59	1.66	1.75	1.06
YQ2978400	ME1131588	0.33	0.38	0.60	1.62	1.68	1.77	1.08
2-(3-phenylpropyl)oxolane	ME1130385	0.33	0.61	0.85	1.46	1.61	1.59	0.99
TOFA	ME1131545	0.38	0.62	0.74	1.45	1.56	1.57	1.07
"eicosa-11,14-dienoic acid"	ME1130914	0.47	0.61	0.77	1.45	1.37	1.75	1.04
DA0512150	ME1130853	0.33	0.45	0.74	1.59	1.47	1.87	1.05
5-Hydroxy-1-(4-hydroxyphenyl)-3-decanone	ME1130585	0.51	0.50	0.74	1.46	1.55	1.76	0.93
ES9990000	ME1130924	0.33	0.55	0.68	1.50	1.64	1.81	0.98
RH3422500	ME1131457	0.40	0.50	0.72	1.42	1.64	1.83	0.99
"2-({[(2S,3R)-2-Methyl-3-pentadecyl-2-oxiranyl]carbonyl}amino)propyl acetate"	ME1130384	0.55	0.52	0.62	1.27	1.65	1.74	1.10
minaprine	ME1131217	0.54	0.62	0.57	1.50	1.69	1.64	0.93
Creatinine	ME1130802	0.71	0.77	1.07	1.38	1.55	1.32	0.70
(S)-(+)-2-Amino-1-propanol	ME1130315	0.29	0.67	0.72	1.72	1.54	1.48	1.08
3-Indoxyl sulphate	ME1130502	0.46	0.74	0.87	1.61	1.45	1.26	1.11
5-Indolol	ME1130589	0.42	0.66	0.89	1.63	1.46	1.23	1.20
AM9627000	ME1130690	0.48	0.60	0.74	1.71	1.24	1.65	1.06
Guvacoline 2	ME1131008	0.55	0.70	0.80	1.57	1.00	1.60	1.14
D-PANTOTHENIC ACID 2	ME1130848	0.70	0.78	0.60	1.42	1.26	1.67	1.06
TEMPOL-H	ME1131524	0.57	0.83	0.70	1.48	1.44	1.63	0.82
D-PANTOTHENIC ACID	ME1130847	0.73	0.75	0.57	1.54	1.44	1.47	0.97
Pantothenic acid	ME1131382	0.75	0.77	0.49	1.63	1.45	1.48	0.93
metharbital	ME1131192	1.09	0.63	1.44	0.88	1.31	0.37	1.78
Refametinib	ME1131453	1.59	1.02	0.89	0.74	1.08	1.45	0.70
Taurine 2	ME1131510	1.92	0.74	0.64	0.66	1.37	1.57	0.59
ala-ile	ME1130680	1.23	0.86	0.93	0.61	1.84	1.17	0.86
"(3E)-2,5-Dioxo-3-hexenal"	ME1130265	1.39	0.46	0.54	0.80	1.68	1.54	1.03
4-Sulfanyldihydro-3(2H)-furanone	ME1130572	1.00	0.85	0.66	0.71	1.42	1.74	1.11
L-Aspartic acid	ME1131092	1.39	0.77	0.44	0.74	1.47	1.51	1.15
D-(-)-Aspartic acid	ME1130825	1.38	0.87	0.55	0.65	1.41	1.61	0.99
oxazolidinone	ME1131370	1.38	0.87	0.60	0.53	1.39	1.72	0.98
THIAMINE PHOSPHORIC ACID ESTER	ME1131532	2.09	0.40	0.65	0.04	1.63	1.83	0.85
6-(3-Hydroxy-3-methylbutyl)-7-methoxy-2H-chromen-2-one	ME1130601	1.79	0.34	1.01	0.49	0.99	1.83	0.98
.ALPHA.-TOCOPHERONIC ACID	ME1130162	1.76	0.39	1.00	0.52	0.99	1.82	0.96
3-O-Methyl-N-acetyl-D-glucosamine 2	ME1130512	0.57	1.81	0.86	1.89	0.48	1.16	0.72
Difloxacin	ME1130865	0.74	1.38	0.64	1.91	0.51	1.37	0.95
Acrylic acid 4	ME1130669	0.47	1.89	0.69	1.42	0.79	1.30	0.94
"N-(4-Heptanyl)-1,3-benzodioxole-5-carboxamide"	ME1131241	0.30	1.95	1.00	1.69	0.70	0.86	1.00
"N-(4-Heptanyl)-1,3-benzodioxole-5-carboxamide 2"	ME1131242	0.37	1.74	1.11	1.54	0.74	0.95	1.03
3-Amino-2-naphthoic acid 2	ME1130478	1.14	1.45	1.43	1.33	0.45	0.76	0.91
Lemobiline	ME1131139	1.22	1.55	1.47	1.25	0.33	0.73	0.95
val-arg	ME1131573	0.70	1.29	1.36	1.71	0.60	0.73	1.10
DL-Phenylalanine	ME1130898	0.77	1.09	1.20	1.80	0.79	0.89	0.96
L-Threonic acid	ME1131119	0.94	1.19	1.09	1.61	0.78	0.78	1.11
Melengestrol acetate	ME1131179	1.59	0.53	0.54	1.57	0.95	1.17	1.13
3-[4-(Sulfooxy)phenyl]-2-oxiranecarboxylic acid	ME1130475	0.27	1.26	0.98	2.09	0.92	0.89	1.09
gamma-glutamyltyramine	ME1130955	0.39	1.25	0.62	2.16	1.10	1.04	0.93
saccharopine 2	ME1131469	0.87	1.49	0.24	2.13	1.22	0.70	0.84
saccharopine	ME1131468	0.76	1.55	0.57	1.81	0.99	0.85	0.97
saccharopine 3	ME1131470	0.78	1.46	0.38	2.02	1.00	0.97	0.89
N-Succinyl-L-diaminopimelic acid 2	ME1131310	1.35	1.34	0.66	1.37	0.79	1.03	0.96
pimethixene	ME1131400	0.99	1.46	0.66	1.56	0.77	1.18	0.88
N-Acetylglucosaminitol 5	ME1131283	0.84	1.70	0.68	1.40	1.00	0.88	0.99
"(2S,4S)-4-Amino-2-hydroxy-2-methylpentanedioic acid"	ME1130233	0.69	1.35	0.93	1.71	0.90	1.01	0.91
(E)-5-(methylsulfanyl)pentanal oxime	ME1130310	0.83	1.48	0.72	1.60	1.13	0.98	0.75
3-O-Methyl-N-acetyl-D-glucosamine	ME1130511	1.08	0.45	0.54	1.80	1.40	0.99	1.23
glucosylmannitol	ME1130970	0.91	0.72	0.60	1.76	1.31	0.75	1.43
2-Amino-4-{6-[(3-methyl-2-buten-1-yl)amino]-3H-purin-3-yl}butanoic acid	ME1130400	0.60	0.74	0.51	2.16	1.40	1.17	0.91
DL-Tryptophan 4	ME1130903	0.80	0.57	0.63	2.40	1.20	0.98	0.91
Creatine 3	ME1130799	0.93	0.90	0.73	2.03	0.86	0.98	1.06
L-(+)-Alanine	ME1131073	0.93	0.92	0.75	1.97	0.85	1.00	1.08
3-Amino-3-(4-hydroxyphenyl)propanoic acid 2	ME1130480	0.79	1.04	0.71	2.25	1.07	0.90	0.73
L-(+)-Alanine 2	ME1131074	0.78	1.21	0.50	2.14	1.07	0.95	0.84
"(2S)-4-Methyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)pentanoic acid (non-preferred name) 2"	ME1130248	0.79	1.03	0.49	1.97	1.21	1.05	0.96
Acetylcarnitine 2	ME1130660	0.79	1.03	0.39	2.09	1.19	1.03	0.97
"(2S)-4-Methyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)pentanoic acid (non-preferred name) 4"	ME1130250	0.73	0.88	0.48	2.25	1.14	0.90	1.13
L-(+)-Valine	ME1131085	0.94	0.91	0.44	2.05	1.24	0.84	1.07
"(2S)-2-{[11-(3,4-Dimethyl-5-pentyl-2-furyl)undecanoyl]oxy}-3-hydroxypropyl 13-(3-methyl-5-pentyl-2-furyl)tridecanoate"	ME1130238	0.51	0.80	0.83	1.78	0.97	1.25	1.35
Fructoselysine 3	ME1130947	0.54	1.17	0.42	1.88	0.99	1.45	1.06
Biphenyl	ME1130736	0.47	1.23	0.62	1.84	1.10	1.20	1.04
"(7S)-6-[(1R)-1-Hydroxyethyl]-2-imino-7-methyl-1,2,7,8-tetrahydro-4-pteridinol"	ME1130299	0.68	1.11	0.74	1.88	0.98	1.09	1.00
N6-(1-CARBOXYETHYL)-L-LYSINE	ME1131327	0.70	1.02	0.64	1.82	1.11	1.06	1.15
DL-Arginine 5	ME1130880	0.91	0.85	0.73	1.62	1.63	0.84	0.92
"1-{[(3S,4S,5R)-2,3,4-Trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}-2-pyrrolidinecarboxylic acid (non-preferred name)"	ME1130335	0.98	1.15	0.35	1.65	1.56	0.78	1.03
Vinbarbital	ME1131579	0.93	0.83	0.36	1.92	1.51	1.00	0.95
1-octadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-(1^-sn-glycerol)	ME1130350	0.69	1.04	0.78	1.50	1.23	1.44	0.82
IM-93	ME1131049	0.63	1.16	0.55	1.61	1.22	1.37	0.94
Succinyl proline 2	ME1131500	0.68	1.24	0.60	1.64	1.21	1.22	0.90
.alpha.-Aminoadipic acid	ME1130160	0.79	1.09	0.70	1.75	1.08	1.17	0.92
C-7280948	ME1130750	0.78	1.06	0.79	1.59	1.15	1.18	0.95
N-Glycosyl-L-asparagine	ME1131290	0.82	1.05	0.79	1.60	1.09	1.21	0.94
"5-(5-{5-[(2S)-1-Isopropyl-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}-2-pyridinyl)pyrimidine 2"	ME1130582	0.79	0.96	0.71	1.66	1.10	1.29	0.99
N~2~-(1-Carboxyethyl)-N~5~-(diaminomethylene)ornithine 2	ME1131321	0.82	0.97	0.70	1.64	1.16	1.24	0.97
N6-(1-CARBOXYETHYL)-L-LYSINE 2	ME1131328	0.86	0.88	0.51	1.81	1.39	1.14	0.91
"8-Azabicyclo[3.2.1]oct-3-yl 3,4-dimethoxybenzoate"	ME1130627	0.83	0.95	0.60	1.72	1.26	1.22	0.91
Fructoselysine 5	ME1130949	0.88	0.93	0.59	1.77	1.30	1.14	0.89
DL-Lysine 4	ME1130894	0.89	0.89	0.53	1.68	1.36	1.24	0.91
4-Hydroxyprolylisoleucine	ME1130556	0.78	0.93	0.60	1.69	1.38	1.18	0.94
Allysine	ME1130684	0.85	0.92	0.59	1.70	1.36	1.17	0.93
cis-acetylacrylic acid	ME1130787	0.83	0.98	0.58	1.59	1.42	1.17	0.93
pentobarbital	ME1131386	0.89	0.91	0.62	1.63	1.40	1.16	0.90
Guvacoline 3	ME1131009	0.97	0.84	0.70	1.73	1.23	1.10	0.89
Threonylglutamine 2	ME1131538	0.90	1.01	0.54	1.84	1.21	1.12	0.88
muramic acid 2	ME1131224	0.90	0.94	0.64	1.83	1.12	1.14	0.92
N-(3-Carboxypropanoyl)-5-hydroxynorvaline	ME1131239	0.80	1.01	0.65	1.87	1.16	1.09	0.93
"(3beta)-Ergosta-5,24(28)-dien-3-yl hydrogen sulfate"	ME1130262	0.90	0.84	0.52	1.60	1.40	1.10	1.13
Glutarylcarnitine	ME1130972	0.91	1.06	0.50	1.48	1.30	1.15	1.11
Cholesterol sulfate	ME1130778	0.86	0.93	0.68	1.56	1.28	1.08	1.10
Guvacoline	ME1131007	0.86	0.93	0.67	1.52	1.24	1.15	1.00
N-Acetyl-L-leucine 4	ME1131272	0.85	1.03	0.59	1.60	1.39	1.01	1.02
Boc-NH-PEG3 2	ME1130739	0.98	1.13	0.58	1.45	1.51	0.93	0.93
"(2S)-4-Methyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)pentanoic acid (non-preferred name) 3"	ME1130249	0.97	1.04	0.57	1.55	1.35	0.98	1.05
"(2S)-4-Methyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)pentanoic acid (non-preferred name)"	ME1130247	0.97	1.09	0.57	1.51	1.43	0.92	1.00
N-Acetyl-L-leucine	ME1131269	1.01	1.08	0.61	1.49	1.39	0.91	1.01
3-Butynoic acid 3	ME1130487	1.05	0.97	0.53	1.60	1.42	1.01	0.91
ascopyrone M 4	ME1130710	1.18	0.95	0.43	1.48	1.45	1.03	0.97
D-(_)-Erythrose 3	ME1130839	0.81	1.28	0.81	1.50	0.93	1.01	1.15
L-dihydroanticapsin	ME1131094	0.76	1.29	0.72	1.35	0.97	1.21	1.19
4-Hydroxyprolylleucine	ME1130557	0.67	1.11	0.68	1.69	1.34	0.84	1.17
Fructoselysine 2	ME1130946	0.71	0.98	0.76	1.62	1.23	1.02	1.17
"2,3-Dihydro-1-benzofuran-2-carboxylic acid"	ME1130438	0.81	1.23	0.88	1.51	1.21	0.86	1.00
"(5Z,7E)-9,10-Secocholesta-5,7,10-triene 2"	ME1130284	0.92	1.00	0.97	1.50	1.06	0.90	1.14
"DORZOLAMIDE, (+)-(TRANS)-"	ME1130910	0.89	1.58	1.92	0.67	0.93	1.00	0.48
"(2R)-3-[(Hydroxy{[(1R,2S,3S,4R,5R,6S)-3,4,5-trihydroxy-2-{[alpha-D-mannopyranosyl-(1->6)-alpha-D-mannopyranosyl-(1->6)-alpha-D-mannopyranosyl]oxy}-6-(alpha-D-mannopyranosyloxy)cyclohexyl]oxy}phosphoryl)oxy]-2-[(9Z)-9-octadecenoyloxy]propyl nonadecanoate"	ME1130227	0.66	2.03	1.84	0.46	0.93	1.29	0.29
"(2S,3R)-3-Hydroxy-2-(tetracosanoylamino)octadecyl (1S,2R,3S,4S,5R,6R)-2,3,4,5-tetrahydroxy-6-{[6-O-(hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl)-alpha-D-mannopyranosyl]oxy}cyclohexyl hydrogen phosphate"	ME1130232	0.67	1.99	1.84	0.47	0.81	1.34	0.37
6-O-Phosphono-D-allopyranose	ME1130607	0.97	1.88	1.76	0.17	0.72	1.19	0.78
7-O-Phosphonohept-2-ulose	ME1130621	1.08	1.51	2.10	0.04	0.80	1.07	0.88
D-Glucose 6-phosphate 2	ME1130845	1.01	1.53	1.86	0.21	0.81	1.15	0.92
Fructose 1-phosphate	ME1130944	1.07	1.43	1.74	0.20	0.90	1.24	0.91
2-{[(3R)-3-(Decanoyloxy)dodecanoyl]amino}-2-deoxy-6-O-(2-deoxy-2-{[(3R)-3-(dodecanoyloxy)dodecanoyl]amino}-3-O-[(3R)-3-hydroxydodecanoyl]-4-O-phosphono-beta-D-glucopyranosyl)-1-O-phosphono-alpha-D-glucopyranose	ME1130396	1.03	1.28	1.69	0.31	1.09	1.24	0.84
C19 Ceramide (d18:1/19:0)	ME1130757	1.20	1.28	1.43	0.41	1.13	1.24	0.82
Mycinamicin II	ME1131227	1.16	1.33	1.53	0.37	1.13	1.26	0.72
"O-(Hydroxy{(2R)-2-[(6Z,9Z,12Z,15Z)-6,9,12,15-octadecatetraenoyloxy]-3-[(9Z)-9-tetradecenoyloxy]propoxy}phosphoryl)-L-serine"	ME1131351	1.18	1.33	1.53	0.37	1.13	1.27	0.68
Selsun	ME1131480	0.99	1.43	1.40	0.48	1.09	1.24	0.81
lysoPC a C28:1	ME1131163	1.02	1.42	1.45	0.42	1.15	1.29	0.75
"(1Z)-2-Hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxy-2-octadecanyl]pentadecanimidic acid"	ME1130199	1.01	1.45	1.52	0.44	1.12	1.22	0.75
POSACONAZOLE-D5	ME1131414	1.00	1.45	1.50	0.44	1.10	1.24	0.76
"(13Z)-N-[(2S,3R,4E)-1,3-Dihydroxy-4-hexadecen-2-yl]-13-docosenamide"	ME1130186	1.08	1.37	1.39	0.52	1.14	1.22	0.77
N-[(4Z)-1-(beta-D-Galactopyranosyloxy)-3-hydroxy-4-octadecen-2-yl]tetradecanamide	ME1131256	1.03	1.36	1.36	0.52	1.20	1.15	0.89
Correolide	ME1130793	1.08	1.44	1.87	0.29	1.02	1.35	0.45
4-Methyl-7-coumarinyl-tri-N-acetyl-beta-chitotrioside	ME1130560	1.03	1.48	1.63	0.33	1.06	1.35	0.62
N-2-hydroxystearoylsphingosine	ME1131261	0.96	1.47	1.57	0.38	1.13	1.35	0.65
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(9Z)-9-tetradecenoyloxy]propyl pentadecanoate	ME1130229	1.10	1.43	1.62	0.34	1.08	1.42	0.50
FB1	ME1130932	1.16	1.43	1.70	0.30	1.08	1.28	0.54
"(3beta,5alpha,7alpha,12alpha,24R)-3-({3-[(4-Aminobutyl)amino]propyl}amino)-7,12-dihydroxycholestan-24-yl hydrogen sulfate"	ME1130257	1.10	1.38	1.69	0.33	1.08	1.35	0.58
"N-[(2S,3R,4E,6R)-1,3,6-Trihydroxy-4-octadecen-2-yl]heptadecanamide"	ME1131247	1.14	1.36	1.61	0.35	1.08	1.34	0.63
(3beta)-Cholest-5-en-3-yl (23Z)-32-[(9Z)-9-octadecenoyloxy]-23-dotriacontenoate	ME1130259	1.12	1.39	1.64	0.34	1.09	1.28	0.63
N-(2-hydroxyhexadecanoyl)-4-hydroxysphinganine	ME1131237	1.12	1.39	1.66	0.32	1.07	1.31	0.64
1-O-palmitoyl-2-O-(9-oxononanoyl)-sn-glycero-3-phosphocholine	ME1130348	0.95	1.60	1.45	0.46	1.09	1.43	0.51
Larazotide	ME1131136	0.87	1.69	1.63	0.34	1.11	1.29	0.57
"(3beta,5alpha,7alpha)-3-({3-[(4-Aminobutyl)amino]propyl}amino)-7-hydroxy-24-oxocholestan-27-yl hydrogen sulfate"	ME1130258	0.94	1.63	1.58	0.32	1.11	1.37	0.54
Lepimectin A4	ME1131141	0.96	1.62	1.58	0.33	1.10	1.40	0.51
"(20Z)-6-Hydroxy-6-oxido-12-oxo-5,7,11-trioxa-2-aza-6lambda~5~-phosphapentacos-20-en-9-yl (9Z)-9-tetradecenoate"	ME1130203	0.98	1.59	1.59	0.32	1.11	1.34	0.56
"2-Hydroxy(~2~H_5_)-1,3-propanediyl (9Z,9^Z)bis(-9-hexadecenoate)"	ME1130421	0.96	1.59	1.56	0.33	1.14	1.32	0.59
"2-[(2-Acetamido-2-deoxyhexopyranosyl)oxy]-3,4,5-trihydroxycyclohexyl 3,3a,4-trihydroxy-4^-[(4-hydroxybenzoyl)oxy]-5^-methyldecahydro-3H-spiro[1-benzofuran-2,2^-pyran]-6-carboxylate"	ME1130395	0.97	1.61	1.46	0.36	1.06	1.39	0.64
"N-[(2S,3R,4E,6E)-1,3-Dihydroxy-4,6-pentadecadien-2-yl]docosanamide"	ME1131246	1.00	1.56	1.48	0.38	1.16	1.28	0.65
ribulose 5-phosphate	ME1131458	1.02	1.51	1.37	0.23	1.01	1.52	0.84
Glycerol 3-phosphate	ME1130985	1.15	1.54	1.21	0.28	0.95	1.45	0.92
Glycerol 3-phosphate 2	ME1130986	1.22	1.51	1.15	0.34	0.97	1.38	0.93
Serotonin	ME1131487	0.85	1.72	1.53	0.43	0.86	1.24	0.87
D-Glucose 6-phosphate	ME1130844	1.17	1.54	1.52	0.23	0.97	1.17	0.90
Mannose 6-phosphate	ME1131173	1.13	1.65	1.45	0.27	0.96	1.08	0.95
3-Hydroxy-3-methylglutaric acid	ME1130494	0.91	0.98	1.84	1.13	0.60	0.78	1.14
4-Hydroxyprolylleucine 2	ME1130558	0.81	1.05	2.05	0.60	1.11	0.74	1.13
4-Undecylbenzenesulfonic acid	ME1130574	0.59	1.52	1.70	0.51	0.39	1.43	1.19
Pyrone 2	ME1131441	0.61	1.89	1.85	0.69	0.27	1.32	0.85
Diethylpyrocarbonate	ME1130862	0.52	1.83	1.97	0.59	0.27	1.43	0.89
Glucosamine	ME1130967	0.52	1.83	1.97	0.59	0.27	1.43	0.89
Lysylvaline	ME1131165	0.60	1.64	2.02	0.45	0.62	1.37	0.78
Cysteine-glutathione disulfide	ME1130822	0.51	1.86	2.15	0.57	0.57	1.11	0.72
"4-(2-Aminophenyl)-2,4-dioxobutanoic acid"	ME1130533	0.49	1.62	2.12	0.54	0.74	1.12	0.86
guaiacol sulfate	ME1131002	0.47	1.59	2.14	0.61	0.55	1.13	1.01
4-Oxoproline	ME1130568	0.79	1.55	1.84	0.72	0.43	1.13	1.06
D-(+)-Pyroglutamic Acid	ME1130833	0.69	1.55	2.05	0.63	0.37	1.19	1.01
"(10E,12E,23E,47E)-14,18,19,22,31,33,40,41-Octahydroxy-2,11,23,47,50-pentamethyl-35-methylene-27-oxo-26,53,54,55-tetraoxa-6-azaheptacyclo[23.21.5.1~3,45~.1~17,21~.1~29,32~.1~39,43~.0~2,7~]pentapentaconta-6,10,12,23,45,47-hexaen-30-yl hydrogen sulfate"	ME1130180	0.51	1.82	2.03	0.80	0.33	0.97	1.03
spinacine	ME1131494	0.56	1.48	2.20	0.93	0.33	1.04	0.96
2-Hexenoylcarnitine 2	ME1130414	1.55	1.56	1.62	0.49	0.61	0.88	0.75
Capryloylglycine 2	ME1130768	1.50	1.60	1.45	0.66	0.57	0.70	1.01
Capryloylglycine	ME1130767	1.35	1.66	1.60	0.59	0.54	0.80	0.97
N-Methylisopelletierine	ME1131295	1.31	1.68	1.42	0.71	0.55	0.82	0.98
2-Furoic acid	ME1130411	1.48	1.08	1.80	0.72	0.65	1.01	0.75
Palmitelaidic acid	ME1131378	1.27	1.26	1.80	0.50	0.65	0.90	1.12
RG3715000	ME1131456	1.09	1.36	1.71	0.65	0.53	0.95	1.20
1-Myristoyl-2-linoleoyl-sn-glycero-3-phosphocholine	ME1130345	1.35	1.34	1.62	0.65	0.76	0.75	1.03
N-Acetyl-L-glutamine	ME1131266	1.40	1.40	1.53	0.65	0.82	0.88	0.82
"1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid"	ME1130363	1.13	1.19	1.60	0.78	0.86	1.01	0.93
Caprolactam 2	ME1130766	1.14	1.31	1.58	0.84	0.81	1.00	0.78
Glycine 2	ME1130990	1.07	1.34	1.73	0.68	0.86	0.85	0.97
PYRIDOXAMINE	ME1131438	1.17	1.28	1.73	0.85	0.86	0.76	0.84
alpha-Cyano-4-hydroxycinnamic acid 2	ME1130689	1.08	1.82	1.83	0.66	0.36	0.50	1.24
ser-gln	ME1131482	0.85	1.82	2.18	0.67	0.52	0.54	0.89
2-Hydroxy-4-(methylthio)butanoic acid	ME1130417	0.92	1.88	1.98	0.57	0.49	0.64	1.02
N-Acetylvaline	ME1131284	1.08	1.69	1.92	0.58	0.52	0.75	0.96
5-Tetradecenoic acid	ME1130595	1.01	1.14	2.08	0.70	0.72	0.96	0.83
episteryl oleate	ME1130922	0.98	1.18	2.25	0.71	0.73	0.68	0.96
Aceglutamide 3	ME1130645	1.07	1.50	1.87	0.58	0.76	0.93	0.79
N-(Carboxymethyl)norleucine	ME1131243	0.97	1.55	1.93	0.47	0.76	0.70	1.12
Brassicanal A	ME1130741	0.88	1.33	2.07	0.58	0.65	0.89	1.09
RN9730000	ME1131461	0.93	1.23	1.99	0.59	0.65	0.97	1.00
fMet 2	ME1130938	0.80	1.54	2.20	0.55	0.64	0.87	0.90
Butopyronoxyl	ME1130746	0.98	1.55	1.89	0.59	0.59	0.94	0.96
Traumatic Acid	ME1131553	0.84	1.46	1.96	0.66	0.66	0.90	0.99
YQ3683000	ME1131589	0.84	1.46	1.96	0.66	0.66	0.90	0.99
10-Undecenoic acid	ME1130368	0.92	1.60	2.04	0.57	0.58	0.81	0.95
Pivagabine	ME1131410	0.91	1.54	2.06	0.63	0.62	0.79	0.93
(+/-)-Camphoric acid	ME1130176	1.04	1.39	2.04	0.58	0.60	0.88	0.97
Glycine 3	ME1130991	1.05	1.47	2.10	0.54	0.61	0.75	0.97
MUGlcU	ME1131222	0.48	1.43	1.86	0.92	0.88	0.76	1.14
"(3,4-Dihydroxyphenyl)(hydroxy)acetonitrile"	ME1130254	0.40	1.41	1.97	0.90	0.73	1.16	0.92
dl-3-Indolelactic acid	ME1130875	0.62	1.26	2.00	0.79	0.80	1.01	1.02
"(9alpha,11alpha,13E,15S)-9,15-Dihydroxy-1,11-epoxyprosta-5,13-dien-1-one"	ME1130302	0.64	1.09	1.95	0.82	0.81	1.08	1.07
NP-014287	ME1131342	0.68	1.15	1.92	0.87	0.85	1.04	0.93
"N-acetyl-D,L-penicillamine"	ME1131262	0.59	1.42	1.72	0.94	0.79	1.10	0.91
Ethylparaben	ME1130931	0.66	1.37	1.81	0.96	0.75	0.95	0.99
Glycol salicylate	ME1130994	0.67	1.26	1.76	0.99	0.79	1.02	1.01
MMDPPO	ME1131219	0.70	1.21	1.81	0.92	0.78	1.11	0.96
13S-hydroxyoctadecadienoic acid	ME1130377	0.65	1.63	1.72	0.83	0.59	0.94	1.08
Salicylaldoxime	ME1131472	0.54	1.54	1.87	0.88	0.71	1.01	0.94
L-Glutamic acid 2	ME1131100	0.73	1.58	1.68	0.97	0.71	0.89	0.95
L-Threonic acid 2	ME1131120	0.78	1.46	1.77	0.92	0.68	0.97	0.92
L-Glutamic acid	ME1131099	0.73	1.56	1.82	0.88	0.68	0.89	0.95
Threonylglutamine	ME1131537	0.66	1.55	1.86	0.90	0.71	0.86	0.94
"(4S)-6-Methyl-2-oxa-6-azatricyclo[3.3.1.0~3,7~]nonan-4-ol"	ME1130276	0.67	1.58	1.55	0.96	0.77	1.03	0.93
CYCLOCREATINE	ME1130815	0.50	1.63	1.63	0.92	0.83	1.07	0.91
apronalide	ME1130698	0.75	1.66	1.63	0.89	0.86	0.90	0.79
Glutaurine 2	ME1130974	0.87	1.45	1.53	0.99	0.86	0.86	0.94
Glutaurine	ME1130973	0.79	1.47	1.63	0.87	0.87	0.92	0.94
MFCD00093300	ME1131206	0.78	1.54	1.58	0.84	0.83	0.94	0.90
guaietolin	ME1131003	1.04	1.49	1.72	0.87	0.60	0.97	0.76
8-Amino-7-oxononanoic acid	ME1130625	1.01	1.50	1.77	0.75	0.68	0.77	0.99
LU3562000	ME1131159	0.98	1.44	1.75	0.80	0.68	0.86	0.96
3-Methylsuberic acid	ME1130507	0.98	1.44	1.75	0.80	0.68	0.86	0.96
butyl acrylate	ME1130747	0.98	1.44	1.75	0.80	0.68	0.86	0.96
cis-2-Carboxycyclohexyl-acetic acid	ME1130784	0.93	1.46	1.82	0.67	0.69	0.97	0.91
N-Acetyl-L-leucine 2	ME1131270	0.95	1.48	1.86	0.73	0.65	0.88	0.95
2-(Acetylamino)hexanoic acid	ME1130390	0.92	1.40	1.64	0.90	0.76	0.89	0.98
N-Acetyl-DL-glutamic acid	ME1131263	0.94	1.31	1.67	0.97	0.70	0.86	1.04
4-Hydroxynonenal	ME1130554	0.98	1.43	1.59	0.76	0.74	1.01	0.92
N-[1-Carboxy-3-(methylsulfinyl)propyl]glutamine	ME1131259	0.93	1.50	1.63	0.89	0.68	0.96	0.90
Docosapentaenoic acid 2	ME1130906	0.90	1.40	1.59	0.76	0.76	0.91	1.17
Palmitic Acid	ME1131379	0.85	1.52	1.46	0.81	0.68	0.93	1.15
Oleic acid	ME1131363	0.98	1.20	1.57	0.74	0.75	1.10	1.14
"(9E,12Z)-linoleic acid"	ME1130304	0.86	1.41	1.65	0.76	0.63	1.07	1.12
ricinelaidic acid	ME1131459	0.86	1.23	1.73	0.80	0.68	0.98	1.13
Acetylcadaverine	ME1130658	0.90	1.37	1.56	0.81	0.70	1.22	0.93
D-_-Hydroxyglutaric acid	ME1130852	0.78	1.24	1.64	0.80	0.69	1.30	1.05
Glucosamine 2	ME1130968	0.78	1.59	1.62	0.80	0.57	1.21	0.92
3-Butynoic acid 6	ME1130490	0.71	1.48	1.65	0.85	0.62	1.27	0.91
6-Oxo-pipecolinic acid	ME1130608	0.68	1.55	1.61	0.80	0.59	1.30	0.96
(2S)-5-Carbamimidamido-2-(2-oxo-1-azetidinyl)pentanoic acid	ME1130252	0.72	1.46	1.68	0.72	0.69	1.39	0.84
3-O-Ethylascorbic acid	ME1130510	0.59	1.39	1.69	0.86	0.72	1.44	0.80
"2-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepin-4-one 2"	ME1130426	0.78	1.45	1.63	0.46	0.92	1.30	0.95
Uracil 3	ME1131567	0.75	1.39	1.78	0.55	0.77	1.22	1.03
(3E)-4-(pyridin-3-yl)but-3-enoic acid 2	ME1130268	0.65	1.51	1.69	0.76	0.78	1.13	0.98
Dopastin	ME1130909	0.67	1.49	1.85	0.67	0.79	1.06	0.95
"3-[(2S)-6-Hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-2-yl]propanoyl hydrogen sulfate"	ME1130471	0.94	1.43	1.78	0.59	0.81	1.00	0.94
"(5E,7E,9E,11E)-5,7,9,11,13-Tetradecapentaenoic acid"	ME1130279	0.84	1.36	1.82	0.69	0.84	0.99	0.95
carglumic acid	ME1130770	0.80	1.32	1.85	0.78	0.79	1.04	0.92
IpA	ME1131055	0.65	1.58	1.63	0.68	1.00	0.99	0.98
IpA 2	ME1131056	0.62	1.86	1.72	0.61	0.90	0.83	0.96
Docosapentaenoic acid	ME1130905	0.97	1.94	1.67	0.50	0.63	0.88	0.87
"6-Hydroxy-5-methyl-4,11-dioxoundecanoic acid"	ME1130603	0.81	1.93	1.77	0.64	0.55	0.88	0.91
9-oxodecenoic acid	ME1130635	0.81	1.93	1.77	0.64	0.55	0.88	0.91
CAY10736	ME1130773	1.02	1.67	1.60	0.58	0.73	0.74	1.17
ACETONE CYANOHYDRIN	ME1130649	0.99	1.60	1.61	0.64	0.74	0.87	0.95
cis-4-Hydroxy-D-proline	ME1130786	1.05	1.71	1.53	0.66	0.71	0.82	1.02
trans-4-Hydroxy-L-proline	ME1131551	1.00	1.73	1.60	0.63	0.73	0.84	0.97
"2,2-Bis(hydroxymethyl)propionic acid"	ME1130437	0.93	1.67	1.58	0.97	0.69	0.70	0.96
(3S)-3-{[(3S)-3-Aminobutanoyl]amino}-5-methylhexanoic acid 2	ME1130272	0.97	1.88	1.55	0.92	0.62	0.69	0.86
9-oxodecenoic acid 2	ME1130636	0.96	1.95	1.51	0.75	0.62	0.71	0.98
Rehmaionoside C	ME1131454	1.10	0.68	1.30	0.48	0.99	2.02	0.94
"2,5-Dihydroxycinnamic acid"	ME1130446	0.67	1.27	1.07	0.64	0.92	2.03	0.90
"8-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-6,7-dihydroxy-2H-chromen-2-one"	ME1130623	0.86	1.11	1.14	0.64	0.93	1.88	0.93
cladosporacid E	ME1130790	0.79	1.13	1.28	0.55	0.96	1.93	0.85
3-hydroxybutyrylcarnitine	ME1130496	1.00	0.90	1.22	0.65	0.90	1.86	0.95
Tetraneurin A	ME1131531	0.84	0.97	1.32	0.72	1.04	1.77	0.79
GDP-D-glycero-alpha-D-manno-heptose	ME1130957	0.90	1.24	1.66	0.66	0.84	1.64	0.55
(3E)-4-(pyridin-3-yl)but-3-enoic acid	ME1130267	0.54	1.21	1.72	0.54	1.00	1.76	0.71
Baohuoside I	ME1130722	0.60	1.08	1.66	0.70	0.91	1.69	0.84
meprobamate 3	ME1131185	0.51	1.04	1.40	0.93	0.72	1.78	1.12
L-(+)-ERGOTHIONEINE 2	ME1131080	0.44	1.54	1.69	0.74	0.56	1.61	0.89
Gonyautoxin 5	ME1131001	0.50	1.49	1.41	0.97	0.82	1.57	0.74
ALA-PRO	ME1130681	0.48	1.29	1.52	0.79	0.78	1.73	0.90
meprobamate 2	ME1131184	0.48	1.29	1.52	0.79	0.78	1.73	0.90
1-Methylhistidine	ME1130341	1.77	1.42	1.07	0.70	0.79	0.84	0.91
Purine	ME1131434	1.65	1.27	0.99	0.78	1.00	0.83	0.97
1-Myristoyl-2-docosahexaenoyl-sn-glycero-3-phosphocholine	ME1130344	1.66	0.97	1.50	0.47	0.87	0.84	1.17
Aceturic acid	ME1130650	1.84	1.19	1.48	0.49	0.62	0.96	0.91
Aceturic acid 3	ME1130652	1.76	1.27	1.32	0.59	0.68	0.94	0.93
Glycine 4	ME1130992	1.82	1.21	1.37	0.55	0.67	0.90	0.97
"2-Aminoethyl (2R)-2-hydroxy-3-[(1Z,12Z)-1,12-nonadecadien-1-yloxy]propyl hydrogen phosphate"	ME1130401	1.19	0.90	1.45	0.98	0.74	0.86	1.36
(2R)-2-(Acryloyloxy)-3-(hexadecyloxy)propyl 2-(trimethylammonio)ethyl phosphate	ME1130220	1.29	1.06	1.46	0.63	0.70	1.04	1.31
1-O-[Hydroxy({3-hydroxy-15-methyl-2-[(13-methyltetradecanoyl)amino]hexadecyl}oxy)phosphoryl]-beta-D-mannopyranose	ME1130347	1.32	1.19	0.95	0.62	1.20	1.08	1.13
"N-[(2S,3R)-3-Hydroxy-2-octadecanyl]docosanamide"	ME1131252	1.21	1.31	1.00	0.70	1.13	1.07	1.07
NPPB	ME1131344	1.26	1.15	1.10	0.79	1.09	1.06	1.04
(2S)-1-(beta-D-Galactopyranosyloxy)-3-(palmitoyloxy)-2-propanyl (9Z)-9-hexadecenoate	ME1130234	1.12	1.19	1.15	0.71	1.19	1.08	1.06
"(2beta,3beta,5beta,22R)-2,3,14,25-Tetrahydroxy-6-oxocholest-7-en-22-yl (9Z,12Z)-9,12-octadecadienoate"	ME1130207	1.15	1.14	1.16	0.68	1.14	1.03	1.19
Cholesterol Stearate	ME1130777	1.15	1.23	1.09	0.74	1.12	1.01	1.17
N-icosanoylsphingosine 1-phosphate	ME1131293	1.28	1.20	1.11	0.55	1.18	1.10	1.07
Spinosyn D	ME1131495	1.28	1.22	1.17	0.50	1.18	1.15	1.00
TBBZ	ME1131521	1.21	1.23	1.27	0.55	1.14	1.16	0.94
"(3Î_,5Î±,22Î_,25S)-Spirosolan-3-yl 4-O-Î_-D-glucopyranosyl-Î_-D-galactopyranoside"	ME1130270	1.27	1.28	1.33	0.42	1.18	1.19	0.83
"2-Hydroxy(~2~H_5_)-1,3-propanediyl (5Z,8Z,11Z,14Z,17Z,5^Z,8^Z,11^Z,14^Z,17^Z)bis(-5,8,11,14,17-icosapentaenoate)"	ME1130420	1.23	1.28	1.35	0.48	1.10	1.16	0.90
lysoPC a C28:0	ME1131162	1.27	1.30	1.30	0.47	1.14	1.14	0.89
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(9Z)-9-pentadecenoyloxy]propyl (11Z)-11-docosenoate	ME1130228	1.35	1.18	1.29	0.81	0.83	0.83	1.20
235BBF3K97	ME1130454	1.30	1.35	1.11	0.91	0.82	0.74	1.26
CY9070000	ME1130811	1.30	1.35	1.11	0.91	0.82	0.74	1.26
"(2R)-2-[(8Z,11Z,14Z)-8,11,14-Icosatrienoyloxy]-3-(pentadecanoyloxy)propyl 2-(trimethylammonio)ethyl phosphate"	ME1130221	1.15	1.13	1.42	0.84	1.00	0.87	1.08
Oryzaemate	ME1131369	1.16	1.20	1.27	0.81	0.96	0.94	1.15
"(3E)-6-[16-(Hexopyranosyloxy)-19-methoxy-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.0~1,13~.0~4,12~.0~5,9~]nonadec-2-en-8-yl]-2-methyl-3-hepten-2-yl hexopyranoside"	ME1130269	1.06	1.29	1.42	0.78	0.81	0.98	1.15
Vitamin C	ME1131580	1.22	1.25	1.45	0.66	0.88	0.96	1.06
O-(Hydroxy{(2R)-2-hydroxy-3-[(2-methoxyoctadecyl)oxy]propoxy}phosphoryl)-L-serine	ME1131354	1.32	1.26	1.15	0.87	0.98	0.95	0.97
afegostat	ME1130675	1.28	1.32	1.28	0.78	0.91	0.90	0.98
Pipecolic acid	ME1131401	1.28	1.32	1.28	0.78	0.91	0.90	0.98
1-Palmitoyl-2-hydroxy-sn-glycero-3-PE	ME1130351	1.51	1.17	1.07	0.75	0.92	0.98	1.11
"lysophosphatidylethanolamine (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)"	ME1131164	1.42	1.34	1.10	0.70	0.94	1.00	1.00
[3-(Sulfooxy)phenyl]acetic acid	ME1130321	0.40	0.98	1.41	1.29	1.07	1.23	1.12
"(10E,15Z)-9,12,13-Trihydroxy-10,15-octadecadienoic acid"	ME1130181	0.51	0.89	1.27	1.27	1.22	1.29	0.98
salicylamide	ME1131473	0.57	0.99	1.14	1.32	1.07	1.28	1.13
8-Hydroxyquinoline	ME1130629	0.38	0.91	1.15	1.66	1.14	1.14	1.12
FG7175000	ME1130936	0.43	0.95	1.11	1.66	1.13	1.07	1.15
4-phenolsulfonic acid	ME1130570	0.47	1.00	1.26	1.43	1.27	1.03	1.02
Phenol	ME1131394	0.46	1.02	1.33	1.43	1.25	0.94	1.07
L-gamma-Glutamyl-L-leucine 2	ME1131097	0.35	1.68	0.77	1.18	1.24	1.36	0.91
3-Amino-2-naphthoic acid	ME1130477	0.42	1.27	1.16	1.08	1.32	1.31	0.95
1-(4-Hydroxy-3-methoxyphenyl)-3-undecanone	ME1130330	0.38	1.33	1.03	1.28	1.30	1.23	0.82
Diaminopimelic acid	ME1130861	0.54	1.29	1.06	1.24	1.33	1.11	0.92
"2-Methyl-3-undecyl-1,4-naphthoquinone"	ME1130427	0.69	1.54	1.49	1.03	0.36	1.41	0.98
"N-(1-Methyl-4-oxo-4,5-dihydro-1H-imidazol-2-yl)alanine 3"	ME1131234	0.78	1.60	1.34	0.86	0.38	1.54	1.00
carnosine 2	ME1130772	0.83	1.67	1.30	0.89	0.66	1.25	0.89
MRS1191	ME1131221	0.84	1.61	1.48	0.85	0.69	1.17	0.87
"N-(1-Methyl-4-oxo-4,5-dihydro-1H-imidazol-2-yl)alanine 2"	ME1131233	0.79	1.62	1.23	1.08	0.46	1.27	1.04
Urocanic acid	ME1131572	0.62	1.72	1.32	1.03	0.55	1.21	1.00
Cyprodenate	ME1130818	0.89	1.29	1.78	1.29	0.73	0.80	0.69
S-[(1Z)-N-Hydroxy-8-(methylsulfanyl)octanimidoyl]cysteine	ME1131463	0.79	1.44	1.67	1.19	0.67	1.05	0.67
Cyclo(leucylprolyl)	ME1130814	0.49	1.55	1.50	1.17	0.61	1.14	1.02
2-Hydroxy-5-vinylphenyl hydrogen sulfate	ME1130418	0.44	1.37	1.60	1.13	0.72	1.23	1.00
"3,7-Dihydroxy-2-[3-methoxy-4-(sulfooxy)phenyl]-5-chromanesulfinic acid"	ME1130531	0.45	1.38	1.56	1.14	0.72	1.23	1.02
N-Acetyl-L-leucine 6	ME1131274	0.59	1.28	1.40	1.17	0.89	0.97	1.20
(+)-castanospermine	ME1130174	0.54	1.44	1.54	1.09	0.85	1.05	0.98
N-Acetyl-L-leucine 5	ME1131273	0.63	1.36	1.45	1.07	0.92	1.09	0.98
Acetylcarnitine	ME1130659	0.40	1.56	1.37	1.54	0.69	0.96	0.97
FB9500000	ME1130933	0.42	1.27	1.42	1.47	0.86	1.11	0.95
N-Aceyl-L-tyrosine	ME1131285	0.39	1.35	1.70	1.36	0.75	1.00	0.94
"3,4-Bis(3,4,5-trimethoxybenzyl)dihydro-2(3H)-furanone"	ME1130521	0.56	0.99	1.65	0.69	0.91	1.54	1.16
"(3beta,5alpha,6alpha,7beta,15alpha,22E)-5,6-Epoxyergosta-8(14),22-diene-3,7,15-triol"	ME1130256	0.33	1.00	1.69	0.91	0.93	1.42	1.19
3-Ureidopropionic acid	ME1130519	0.70	0.98	1.74	0.90	0.66	1.47	1.06
"7-{(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(1E,3S,5S)-3-hydroxy-5-methyl-1-nonen-1-yl]cyclopentyl}heptanoic acid"	ME1130616	0.56	0.79	1.87	0.77	0.84	1.59	0.99
C8-HSL 2	ME1130764	0.94	0.57	1.69	0.60	1.23	1.51	0.96
3-Oxotetradecanoic acid	ME1130517	0.84	0.76	1.49	0.61	1.02	1.70	1.06
"4-{(1R,2R)-3-Oxo-2-[(2Z)-2-penten-1-yl]cyclopentyl}butanoic acid"	ME1130540	0.80	0.89	1.71	0.70	0.98	1.37	1.05
CyPPA	ME1130817	0.75	0.72	1.82	0.72	1.05	1.47	0.97
C8-Carnitine	ME1130762	0.88	0.76	1.63	0.65	1.08	1.50	0.99
"(1S,2R,5S)-2-Isopropyl-5-methylcyclohexyl 3-oxobutanoate 2"	ME1130196	0.76	0.81	1.66	0.59	0.99	1.61	1.08
C12-HSL	ME1130754	0.81	0.71	1.76	0.60	0.96	1.60	1.04
decanoylcarnitine	ME1130858	0.81	0.71	1.76	0.60	0.96	1.60	1.04
2-(Acetylsulfamoyl)benzoic acid	ME1130391	0.49	0.67	1.59	0.78	1.07	1.90	0.99
Homovanillic acid sulfate 2	ME1131032	0.48	0.67	1.56	1.00	1.05	1.57	1.16
"(5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S)-3-Hydroxy-1-octen-1-yl]-2,3-dioxabicyclo[2.2.1]hept-5-yl}-N-propyl-5-heptenamide"	ME1130288	0.82	0.63	1.51	0.84	0.97	1.67	1.06
"24,24-Difluoro-25-hydroxycholecalciferol"	ME1130455	0.67	0.66	1.56	0.83	1.08	1.62	1.00
4-Hydroxy-3-(sulfooxy)benzoic acid	ME1130549	0.67	0.82	1.54	0.90	1.02	1.55	1.00
"(2E)-7-({(2R)-1-[(Hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl)oxy]-3-[(9Z)-9-octadecenoyloxy]-2-propanyl}oxy)-4,7-dioxo-2-heptenoic acid"	ME1130216	0.53	1.23	1.69	0.86	1.19	1.39	0.60
8-Amino-7-oxononanoic acid 2	ME1130626	0.81	1.23	1.63	0.86	1.11	1.23	0.63
Piperidione	ME1131408	0.80	1.23	1.63	0.86	1.11	1.23	0.63
Uracil 2	ME1131566	0.86	0.82	1.72	0.79	0.82	1.25	1.16
C12-HSL 2	ME1130755	0.85	0.81	1.67	0.85	1.03	1.09	1.18
L-Glutamic acid 3	ME1131101	0.84	0.93	1.70	0.89	0.88	1.10	1.14
SBHA	ME1131476	0.60	1.16	1.80	0.80	0.95	1.25	0.93
Phenobarbital	ME1131392	0.76	1.09	1.73	0.85	0.91	1.25	0.92
N~2~-Acetyl-L-ornithine	ME1131322	0.78	1.13	1.70	0.86	0.86	1.23	0.92
Pentahomoserine	ME1131385	0.78	1.12	1.69	0.85	0.86	1.25	0.92
13S-hydroxyoctadecadienoic acid 2	ME1130378	0.89	1.09	1.75	0.77	0.85	1.03	0.99
HHL	ME1131020	0.84	1.02	1.73	0.84	0.91	1.14	1.01
"1,5-Anhydro-D-erythro-hexo-2,3-diulose"	ME1130367	0.85	1.04	1.80	0.90	0.82	1.15	0.94
Citraconic acid	ME1130788	0.89	1.11	1.72	0.86	0.80	1.12	0.99
SI-2	ME1131489	0.81	1.04	1.89	0.73	0.95	1.11	0.96
cystathionine 2	ME1130821	0.82	0.92	1.70	0.95	1.00	1.16	0.94
Pidotimod	ME1131399	0.79	0.94	1.88	0.84	0.98	1.14	0.92
cystathionine	ME1130820	0.78	0.94	1.79	0.88	1.00	1.20	0.91
heronapyrrole B	ME1131013	0.71	0.99	1.80	0.86	1.02	1.14	0.94
ACETYL PROLINE	ME1130655	0.92	1.11	2.02	0.70	0.69	1.18	0.88
Crotonic acid	ME1130808	0.82	1.14	1.84	0.83	0.78	1.22	0.85
(E)-Aconitic Acid 2	ME1130312	0.79	1.17	1.94	0.80	0.77	1.19	0.84
Itaconic acid	ME1131063	0.79	1.18	1.92	0.79	0.78	1.20	0.84
.alpha.-Aminoadipic acid 2	ME1130161	0.83	0.98	2.08	0.64	0.81	1.31	0.85
trimethadione	ME1131560	0.83	0.98	2.08	0.64	0.81	1.31	0.85
(4E)-2-Amino-3-oxo-4-decenoic acid	ME1130274	0.72	1.05	1.91	0.74	0.85	1.27	0.95
cis-4-Decenoyl carnitine	ME1130785	0.69	0.96	2.00	0.62	0.92	1.30	1.00
N-Acetyl-L-aspartic acid	ME1131265	0.98	1.00	1.94	0.65	0.66	1.15	1.12
(13Z)-13-Hexadecen-11-ynal	ME1130185	0.85	0.97	2.05	0.77	0.68	1.06	1.06
N5-(1-Iminoethyl)-L-ornithine	ME1131326	0.93	0.93	2.14	0.79	0.74	1.05	0.93
"10,16-Dihydroxyhexadecanoic acid"	ME1130369	0.82	0.83	1.92	0.77	0.88	1.13	1.00
(S)-2-methylbutanal	ME1130318	0.79	0.82	2.13	0.80	0.83	1.15	0.96
Geranylacetone	ME1130960	0.93	1.00	1.82	1.17	0.92	0.92	0.73
S-Methyl-L-Cysteine-S-oxide	ME1131464	0.99	0.87	1.93	0.96	0.93	0.89	0.93
"2,3-Dimethoxy-5-methyl-6-(3-methyl-2-buten-1-yl)-1,4-benzenediol"	ME1130439	1.10	0.77	1.71	1.03	0.95	0.97	0.94
4-ACETAMIDOBUTYRIC ACID	ME1130541	1.18	0.85	1.73	0.78	0.92	1.01	1.04
malonamic acid	ME1131170	1.02	0.82	1.79	0.85	0.95	1.04	1.01
Levulinic acid 3	ME1131148	1.25	0.82	1.82	0.68	0.93	1.21	0.78
AC-ASN-OH	ME1130642	1.19	0.86	1.60	0.89	0.98	1.14	0.84
3-[(2E)-2-Hepten-1-yloxy]-2-hydroxypropyl undecanoate	ME1130470	1.12	0.80	1.63	0.69	0.89	1.30	1.05
6-Oxohexanoic acid 2	ME1130611	1.15	0.79	1.67	0.80	0.78	1.26	0.91
3-hydroxybutyrylcarnitine 2	ME1130497	1.05	0.97	1.58	0.63	0.86	1.50	0.91
6-Oxohexanoic acid 3	ME1130612	0.95	0.84	1.83	0.76	0.84	1.41	0.81
"(2R)-2-[(9Z,12Z)-9,12-Hexadecadienoyloxy]-3-[(hydroxy{[(1R,2S,3S,4R,5R,6S)-3,4,5-trihydroxy-2-{[alpha-D-mannopyranosyl-(1->6)-alpha-D-mannopyranosyl-(1->6)-alpha-D-mannopyranosyl-(1->6)-alpha-D-mannopyranosyl-(1->6)-alpha-D-mannopyranosyl]oxy}-6-(alpha-D-mannopyranosyloxy)cyclohexyl]oxy}phosphoryl)oxy]propyl nonadecanoate"	ME1130222	1.01	0.83	1.48	0.79	1.31	1.22	0.85
5-(2-AMINOPYRIDYL)AMIDE OXIME	ME1130579	0.85	0.91	1.41	0.80	1.37	1.29	0.86
Nopaline	ME1131341	0.85	0.91	1.41	0.80	1.37	1.29	0.86
trans-2-Tetradecenoylcarnitine	ME1131548	0.89	0.72	1.44	0.82	1.08	1.45	1.00
C12-Carnitine	ME1130753	0.92	0.82	1.51	0.76	1.00	1.44	1.06
C14-Carnitine	ME1130756	1.02	0.80	1.53	0.78	0.94	1.39	1.05
2-methylbutyrylcarnitine	ME1130428	0.81	0.96	1.55	1.03	0.96	1.25	0.94
C7-HSL	ME1130759	0.81	0.96	1.55	1.03	0.96	1.25	0.94
Acetylcholine 2	ME1130662	0.87	1.03	1.60	0.81	0.93	1.25	1.00
Caprolactam	ME1130765	0.87	1.03	1.60	0.81	0.93	1.25	1.00
"(6E)-3,7-Dimethyl-8-oxo-6-octen-1-yl acetate"	ME1130292	0.80	1.00	1.48	0.88	0.93	1.38	1.02
His-Ser	ME1131023	0.87	1.03	1.46	0.91	0.99	1.23	1.01
(2S)-2-Piperazinecarboxamide	ME1130240	0.95	0.93	1.34	0.88	1.11	1.35	0.94
DESGLYMIDODRINE	ME1130860	0.92	0.94	1.38	0.91	1.02	1.33	0.97
(E)-Aconitic Acid	ME1130311	1.01	0.84	1.45	0.86	1.10	1.27	0.97
L-Pyroglutamic acid	ME1131115	0.98	0.88	1.42	0.87	1.01	1.28	0.93
N-Acetylaspartic acid	ME1131278	0.96	0.99	1.32	0.93	0.98	1.25	1.08
"(2E,6Z,10Z)-13-[(2R)-6-Hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-2-yl]-2,6,10-trimethyl-2,6,10-tridecatrienoic acid"	ME1130211	0.94	1.08	1.29	0.96	1.04	1.22	0.94
Suberic acid	ME1131497	0.95	1.01	1.36	1.00	1.00	1.24	0.89
Betaine 2	ME1130734	0.86	1.15	1.43	0.79	1.16	1.26	0.80
fosfestrol	ME1130941	0.90	1.00	1.48	0.94	1.05	1.33	0.79
Acetylcholine	ME1130661	0.96	0.98	1.63	0.77	1.00	1.33	0.83
cipamfylline	ME1130783	0.93	0.93	1.52	0.82	1.13	1.26	0.90
Î±-L-Glutamyl-L-glutamine	ME1131044	0.99	1.00	1.43	0.78	1.12	1.28	0.89
Afugan	ME1130677	0.98	1.01	1.48	0.75	1.12	1.35	0.81
gamma-Glu-gln	ME1130954	0.94	1.03	1.50	0.72	1.10	1.32	0.88
glu-ser	ME1130963	0.94	1.03	1.50	0.72	1.10	1.32	0.88
Betaine	ME1130733	0.68	1.06	1.43	0.95	0.99	1.45	0.93
cys-ser	ME1130819	0.63	1.05	1.54	0.99	1.02	1.37	0.87
Tegaserod	ME1131523	0.74	0.98	1.55	0.78	0.95	1.56	0.93
2-Hexenoylcarnitine	ME1130413	0.78	0.96	1.65	0.80	1.09	1.34	0.87
Creatinine 3	ME1130804	0.80	1.09	1.61	0.72	0.96	1.41	0.89
glyoctamide	ME1130999	0.77	1.08	1.61	0.74	1.08	1.36	0.85
Glu-Lys	ME1130962	0.67	1.20	1.59	0.79	0.93	1.46	0.85
N6-Acetyl-L-lysine 2	ME1131330	0.72	1.16	1.58	0.86	0.97	1.40	0.80
Maleic acid 2	ME1131169	0.73	1.06	1.65	0.84	0.84	1.40	0.98
CYCLO(-SER-TYR)	ME1130812	0.64	1.11	1.70	0.89	0.88	1.42	0.86
Tiglylcarnitine	ME1131541	0.64	1.04	1.65	0.87	0.99	1.38	0.93
1-(4-Amino-4-carboxybutanoyl)-2-piperidinecarboxylic acid	ME1130329	0.85	0.75	1.71	0.86	1.16	1.26	0.91
frescolat ML	ME1130943	0.77	0.80	1.51	0.93	1.02	1.30	1.03
5-Methoxy-3-indoleaceate	ME1130590	0.69	0.91	1.62	0.88	1.04	1.39	0.96
Ozagrel	ME1131373	0.71	0.87	1.57	0.89	1.08	1.39	0.98
C10-HSL	ME1130751	0.67	0.75	1.62	1.05	1.09	1.25	1.06
C10-HSL 2	ME1130752	0.58	0.78	1.71	1.00	1.05	1.39	0.99
Vitamin C 2	ME1131581	0.69	1.48	1.06	0.70	1.48	1.38	0.71
"2-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepin-4-one"	ME1130425	0.58	1.20	1.22	0.61	1.19	1.50	1.19
"N-[(2S,3R,4E)-1-(beta-D-Glucopyranosyloxy)-3-hydroxy-4-tetradecen-2-yl]docosanamide"	ME1131248	0.96	1.20	1.23	0.55	1.30	1.42	0.85
"(4E)-2-Amino-4-octadecene-1,3-diol"	ME1130275	0.82	1.29	1.32	0.51	1.00	1.42	1.06
"N-[(2S,3R,4E)-1-{[alpha-D-Galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxy-4-octadecen-2-yl]icosanamide"	ME1131249	0.97	1.21	1.43	0.54	1.09	1.26	0.99
"5-[(Z)-(4-Ethyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-5-methoxy-3-methyl-4-vinyl-1,5-dihydro-2H-pyrrol-2-one"	ME1130583	1.09	1.00	0.83	0.87	1.07	1.65	1.00
11Z-Octadecenylcarnitine	ME1130372	1.08	0.81	1.12	0.89	1.04	1.47	1.08
Thymine	ME1131540	1.16	0.77	1.03	1.01	0.99	1.37	1.17
"Coumarin, 3-(1,1-dimethylallyl)-7-hydroxy-6-methoxy-"	ME1130795	1.09	0.94	1.09	1.09	0.92	1.44	0.81
Maleamic acid	ME1131166	1.08	0.83	1.28	0.99	1.06	1.46	0.80
LU3453000 4	ME1131158	0.91	1.10	1.14	1.04	1.05	1.64	0.62
octenedioic acid	ME1131360	0.87	1.13	1.33	1.00	1.02	1.45	0.69
N-[2-Hydroxy-4-(sulfooxy)phenyl]acetamide	ME1131260	0.93	0.68	1.16	1.02	1.11	1.67	0.93
"(5R)-5-[(1R)-1,2-Dihydroxyethyl]-4-hydroxy-2-oxo-2,5-dihydro-3-furanyl hydrogen sulfate"	ME1130281	0.83	0.66	1.17	1.00	1.27	1.47	1.09
N-Ethylglycine	ME1131289	0.82	0.80	1.06	1.01	1.25	1.56	1.00
"N,N-Dimethylglycine"	ME1131317	0.90	0.78	1.18	0.99	1.18	1.49	0.98
Ethyl acetate	ME1130927	0.95	0.90	1.23	0.82	1.11	1.53	0.95
trans-3-Indoleacrylic acid 2	ME1131550	0.81	0.86	1.25	0.95	1.21	1.59	0.83
Acetyl-L-carnitine	ME1130656	0.81	1.00	1.20	1.00	1.16	1.46	0.87
Crotanecine	ME1130806	0.81	1.00	1.20	1.00	1.16	1.46	0.87
"5,6-Dihydroxy-3-methyl-2(1H)-quinolinone"	ME1130598	0.74	1.02	1.26	0.98	1.05	1.48	0.96
"N,N-dimethylarginine"	ME1131316	0.76	1.06	1.30	0.93	1.07	1.55	0.83
Hexythiazox	ME1131019	0.81	1.07	1.34	0.79	1.16	1.28	1.02
Dodecanedioic acid 4	ME1130908	0.72	0.90	1.45	0.83	1.19	1.39	0.99
Methylphenobarbital	ME1131199	0.75	0.83	1.35	1.00	1.20	1.39	0.99
"(2R,3R,4S,5S,6R)-3-(acetyloxy)-2-[(acetyloxy)methyl]-5-(hexanoyloxy)-6-[(2S,3R)-2,3,4-trihydroxybutoxy]oxan-4-yl tetradecanoate"	ME1130217	0.61	0.84	1.11	1.22	1.31	1.46	0.95
(9Z)-N-[(3S)-2-Oxotetrahydro-3-furanyl]-9-tetradecenamide	ME1130307	0.58	0.76	1.19	1.15	1.32	1.54	0.96
"2-(Hydroxy{2-[(9Z)-9-octadecenoyloxy]-3-(palmitoyloxy)propoxy}phosphoryl)-N,N,N-trimethylethanaminium"	ME1130394	0.63	0.94	1.00	1.26	1.23	1.38	1.05
MFCD00270409	ME1131210	0.61	0.81	0.91	1.19	1.34	1.39	1.13
Homo-L-arginine 3	ME1131028	0.60	1.13	1.13	1.00	1.16	1.60	0.87
"1,4-Dimethylpiperazine"	ME1130366	0.56	1.05	1.10	1.05	1.25	1.62	0.85
"(2E)-4-Hydroxy-7-({(2R)-1-[(hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl)oxy]-3-[(9Z)-9-octadecenoyloxy]-2-propanyl}oxy)-7-oxo-2-heptenoic acid"	ME1130215	0.53	1.03	1.13	1.10	1.21	1.66	0.83
bacillosporin C	ME1130720	0.69	1.15	0.99	1.04	1.08	1.58	0.97
N6-METHYLLYSINE	ME1131332	0.64	1.06	1.03	1.12	1.23	1.55	0.87
N-methylproline	ME1131296	0.64	1.16	1.03	1.06	1.16	1.50	0.89
4-[(2-Isopropyl-5-methylcyclohexyl)oxy]-4-oxobutanoic acid	ME1130537	0.54	1.06	1.12	1.11	1.24	1.41	1.02
Dihydroshikonofuran	ME1130866	0.57	1.03	1.31	0.93	1.26	1.37	0.93
Gingerdione	ME1130961	0.87	0.83	1.20	0.81	0.85	1.75	1.18
DL-Arginine 3	ME1130878	0.86	0.91	1.40	0.91	0.86	1.33	1.21
D-(-)-Mannitol	ME1130828	0.69	0.85	1.24	0.92	1.03	1.42	1.34
Tyrosine	ME1131563	0.62	0.91	1.34	0.86	0.95	1.42	1.39
.beta.-Alanine 3	ME1130165	0.90	0.96	1.08	1.18	0.84	1.38	1.17
L-(-)-Asparagine 2	ME1131070	1.03	0.82	0.93	1.25	0.89	1.35	1.23
5-POHSA	ME1130594	0.72	1.11	1.11	1.10	0.93	1.38	1.10
Stearic acid	ME1131496	0.82	1.11	1.17	1.03	0.78	1.21	1.27
Muscimol	ME1131226	0.75	1.12	1.01	1.15	0.84	1.28	1.36
"O-{Hydroxy[(2R)-2-hydroxy-3-{[(7Z,21Z)-2-methoxy-7,21-octacosadien-1-yl]oxy}propoxy]phosphoryl}-L-serine"	ME1131358	0.74	1.08	1.04	1.13	0.95	1.29	1.28
"1D-myo-Inositol 1,2-cyclic phosphate"	ME1130383	0.86	0.82	1.16	1.40	0.93	0.92	1.28
Lactamide	ME1131131	0.70	1.13	1.18	1.37	0.76	1.09	1.27
mesifurane	ME1131189	0.77	1.42	0.99	0.78	0.99	1.59	0.96
cyclohexenone	ME1130816	0.72	1.49	1.02	0.83	0.90	1.62	0.92
Ethyl maltol	ME1130930	0.73	1.43	1.06	0.80	0.89	1.64	0.95
Salicylic acid	ME1131474	0.70	1.42	1.03	0.79	0.94	1.68	0.94
"6-(1-Hydroxyethyl)-3-(hydroxymethyl)-2,7-dioxabicyclo[4.1.0]hept-3-en-5-one"	ME1130600	0.71	1.51	1.05	0.69	0.86	1.84	0.84
LW8000000	ME1131160	0.71	1.47	0.94	0.70	1.06	1.78	0.85
Phthalic acid	ME1131397	0.67	1.44	0.99	0.72	0.96	1.80	0.90
Vanillyl alcohol	ME1131576	0.75	1.41	1.27	0.75	0.86	1.55	0.90
4-one 2	ME1130565	0.77	1.48	1.32	0.71	0.78	1.47	0.96
PESTALOTIN	ME1131389	0.77	1.48	1.32	0.71	0.78	1.47	0.96
(-)-Spiculisporic acid	ME1130169	0.55	1.31	1.20	0.75	1.02	1.68	0.96
ACHP	ME1130665	0.60	1.27	1.37	0.87	0.91	1.50	0.99
"N,N-Dihydroxy-L-valine"	ME1131315	0.51	1.46	1.30	0.90	0.93	1.45	0.94
3-Keto-scyllo-inosamine	ME1130503	0.65	1.35	0.93	0.97	1.14	1.56	0.89
"3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid"	ME1130527	0.82	1.23	0.89	1.12	1.21	1.43	0.80
"3,5-Dioxooctanedioic acid"	ME1130528	0.84	1.26	0.81	0.95	1.10	1.65	0.88
Succinic anhydride	ME1131498	0.94	1.14	0.80	1.00	1.23	1.56	0.83
7-Hydroxy-2-(2-hydroxypropyl)-5-methyl-4H-chromen-4-one	ME1130620	0.91	1.39	0.88	0.91	1.01	1.36	1.03
(.+/-.)-Mellein	ME1130170	0.86	1.30	0.85	0.93	1.06	1.49	1.00
2-Hydroxy-3-(4-methoxyphenyl)propanal	ME1130416	0.89	1.30	0.86	0.95	1.05	1.44	1.00
(-)-Camphanic acid	ME1130167	0.89	1.30	0.86	0.95	1.05	1.44	1.00
1-heptadecanoyl-sn-glycero-3-phosphocholine	ME1130338	1.05	1.18	0.76	1.07	0.99	1.32	1.14
Pseudoconhydrine	ME1131432	0.96	1.19	0.89	1.10	0.98	1.29	1.09
Brassylic acid	ME1130742	0.71	1.57	0.94	0.96	0.95	1.35	1.00
Queen Bee Acid	ME1131448	0.85	1.61	0.90	0.96	0.86	1.24	1.07
1-arachidonoyl-sn-glycero-3-phosphocholine	ME1130336	0.79	1.37	0.88	1.15	1.09	1.17	1.05
(+)-calycanthidine	ME1130173	0.81	1.45	0.92	1.07	1.06	1.28	0.90
Hydroxypyruvic acid	ME1131039	1.23	1.12	1.48	0.73	0.63	1.36	0.93
beta-D-Ethyl glucuronide	ME1130730	0.95	1.22	1.23	0.98	0.73	1.51	0.89
lys-thr	ME1131161	1.04	1.01	1.48	1.06	0.58	1.42	0.90
D-(+)-Xylose	ME1130836	0.62	1.65	1.38	0.79	0.87	1.27	0.92
3-Methylsulfolene	ME1130508	0.63	1.51	1.47	0.88	0.83	1.25	0.91
L-(-)-Methionine	ME1131071	0.63	1.51	1.47	0.88	0.83	1.25	0.91
1-Methylpseudouridine	ME1130342	0.79	1.48	1.37	0.69	0.98	1.30	0.88
carnosine	ME1130771	0.78	1.51	1.36	0.83	0.85	1.24	0.94
N-Acetyl-L-histidine 2	ME1131268	0.88	1.47	1.33	0.80	0.90	1.21	0.92
1-(Aminomethyl)urea	ME1130332	0.66	1.36	1.51	0.96	0.82	1.32	0.87
Leucine	ME1131144	0.72	1.36	1.37	1.05	0.86	1.22	0.92
Piperidine 2	ME1131405	0.72	1.28	1.48	1.03	0.83	1.24	0.92
Arabic acid	ME1130700	0.72	1.49	1.37	1.01	0.94	1.16	0.81
Acetohydroxamic acid	ME1130647	0.83	1.39	1.37	0.90	0.97	1.13	0.91
Tetrahydrouridine 3	ME1131529	0.87	1.37	1.42	0.95	0.94	1.12	0.82
2-Chloro-5-methyl-cis-dienelactone	ME1130406	0.77	1.19	1.53	0.83	1.18	0.96	1.02
Indoleacrylic acid	ME1131054	0.79	1.03	1.48	0.90	1.10	1.11	1.10
"2,6-di-tert-butylhydroquinone"	ME1130447	0.65	0.99	1.61	0.99	1.09	1.19	0.97
C4-Carnitine	ME1130758	0.72	0.99	1.54	1.04	1.17	1.08	0.95
Cimbuterol	ME1130782	0.73	1.04	1.53	0.99	1.17	1.08	0.95
Dinitolmide	ME1130870	0.72	1.20	1.46	1.07	0.98	1.06	1.02
"3,4-Dihydroxyphenylpropionic acid"	ME1130526	0.69	1.18	1.41	1.13	0.99	1.02	1.08
L-Tyrosine	ME1131124	0.69	1.18	1.41	1.13	0.99	1.02	1.08
Benzylformamide	ME1130729	0.71	1.19	1.47	1.13	0.96	1.00	1.05
Coumarone	ME1130796	0.71	1.19	1.47	1.13	0.96	1.00	1.05
.beta.-Alanine	ME1130163	0.84	1.16	1.48	1.09	0.77	1.08	1.06
(2E)-3-(3-Hydroxyphenyl)acrylaldehyde	ME1130212	0.83	1.07	1.47	1.03	0.91	1.16	1.02
Dalcotidine	ME1130855	0.79	1.12	1.35	1.08	0.89	1.14	1.02
L-Phenylalanine	ME1131110	0.81	1.17	1.45	1.06	0.88	1.13	1.00
L-Phenylalanine 4	ME1131113	0.86	1.19	1.38	1.03	0.92	1.15	0.96
9-Oxononanoic acid 4	ME1130638	0.97	1.18	1.53	1.01	0.84	1.03	0.88
VS1150000	ME1131582	0.77	1.03	1.61	0.97	0.89	1.09	1.05
Undecanedioic acid	ME1131564	0.83	1.24	1.50	0.91	0.84	1.06	1.04
Acrylic acid	ME1130666	0.84	1.16	1.57	0.95	0.84	1.12	1.00
"2,4,5-trimethoxyamphetamine 2"	ME1130443	0.86	1.13	1.53	0.94	0.92	1.09	1.02
fMet	ME1130937	0.86	1.13	1.56	0.90	0.95	1.12	0.98
N-Acetyl-L-phenylalanine	ME1131275	0.72	1.15	1.61	1.06	0.87	1.11	0.98
Maleic acid	ME1131168	0.77	1.19	1.63	0.94	0.83	1.13	1.01
D-(+)-Malic acid	ME1130831	0.76	1.20	1.65	0.93	0.81	1.12	1.02
Glyoxylic acid	ME1131000	0.76	1.20	1.65	0.93	0.81	1.12	1.02
"(4E)-1-(3,4-Dimethoxyphenyl)-4-dodecen-3-one"	ME1130273	0.81	1.36	1.43	1.07	0.73	0.96	1.09
Glycylglutamic acid	ME1130997	0.75	1.35	1.48	0.96	0.88	0.97	1.11
Juniperic acid	ME1131066	0.79	1.24	1.47	1.00	0.81	0.96	1.10
C8-HSL	ME1130763	0.81	1.31	1.57	0.84	0.93	1.01	1.03
"1,2,7,7^,8,8^,11,12-Octahydro-psi,psi-carotene-1,2-diol"	ME1130362	0.72	1.37	1.40	0.88	0.88	1.13	1.05
DL-Tryptophan	ME1130900	0.76	1.27	1.42	0.86	1.05	1.07	1.06
aspergillic acid	ME1130716	0.85	1.23	1.76	0.83	0.93	1.10	0.77
"N6,N6,N6-Trimethyl-L-lysine"	ME1131333	0.86	1.36	1.51	0.81	0.94	1.26	0.76
galactosylhydroxylysine	ME1130953	0.77	1.25	1.65	0.71	0.97	1.24	0.90
L-gamma-Glutamyl-L-valine	ME1131098	0.87	1.24	1.58	0.94	0.97	1.11	0.77
asp-gln	ME1130714	0.78	1.28	1.51	0.92	0.96	1.15	0.89
DAz-1	ME1130856	0.87	1.24	1.55	0.85	0.97	1.10	0.91
Tetrahydrouridine 2	ME1131528	0.89	1.23	1.54	0.86	0.92	1.17	0.89
L-2-Aminoadipic acid 2	ME1131087	0.86	1.21	1.53	0.81	0.90	1.25	0.94
"2,4,5-trimethoxyamphetamine"	ME1130442	0.78	1.22	1.65	0.84	0.91	1.17	0.94
"(5Z,8Z,10E)-12-Oxo-5,8,10-dodecatrienoic acid"	ME1130285	0.83	1.21	1.63	0.83	0.91	1.16	0.93
Levulinic acid	ME1131146	1.07	1.12	1.46	0.73	0.94	1.17	1.00
6-Oxohexanoic acid	ME1130610	0.98	1.16	1.48	0.84	0.83	1.19	1.01
fenamole	ME1130934	1.03	1.09	1.46	0.86	0.91	1.13	1.02
ethyl 2-nitro-3-(4-nitrophenyl)acrylate	ME1130926	0.94	1.11	1.34	0.87	1.00	1.24	1.01
Proline 6	ME1131424	0.87	1.17	1.28	0.84	1.03	1.28	1.00
Betaine 3	ME1130735	1.02	1.18	1.25	0.86	0.93	1.30	0.91
Nitrosoguvacoline	ME1131340	1.02	1.12	1.39	0.76	0.95	1.32	0.95
D-(-)-Glutamine	ME1130826	1.02	1.14	1.35	0.79	0.97	1.29	0.95
NPYR	ME1131345	1.05	1.14	1.34	0.78	0.96	1.27	0.96
"3-(3,4-dihydroxyphenyl)propanoic acid"	ME1130466	0.85	1.26	1.33	0.80	0.93	1.20	1.12
"DL-2,6-Diaminopimelic acid 2"	ME1130873	1.03	1.20	1.46	0.82	0.89	1.21	0.88
"1-Pentofuranosyl-2,4(1H,3H)-pyrimidinedione"	ME1130353	0.89	1.33	1.43	0.81	0.90	1.19	0.95
L-Histidine	ME1131103	0.95	1.23	1.41	0.86	0.93	1.18	0.94
"3,4-Diaminopyridine"	ME1130522	0.93	1.26	1.44	0.87	0.92	1.14	0.95
L-Histidine 2	ME1131104	0.89	1.28	1.44	0.86	0.90	1.16	0.96
2-(acetamidomethylidene)succinic acid	ME1130389	0.90	1.32	1.45	0.91	0.97	1.00	0.95
Piracetam	ME1131409	0.97	1.20	1.38	0.92	0.95	1.01	0.93
"(7R,18E)-1-Amino-4-hydroxy-7-{[(9Z)-9-octadecenoyloxy]methyl}-9,17-dioxo-3,5,8-trioxa-4-phosphaicos-18-en-20-oic acid 4-oxide"	ME1130297	0.92	1.31	1.32	0.95	0.88	1.12	1.00
L-Threonine 2	ME1131122	0.98	1.21	1.29	0.89	0.96	1.08	1.08
Melilotoside A2	ME1131181	0.94	1.24	1.34	0.89	0.97	1.08	1.02
Decanamide	ME1130857	1.19	1.20	1.24	0.96	1.03	1.07	0.77
Paeonoside	ME1131376	1.06	1.23	1.24	0.90	1.04	1.26	0.76
delta-Octalactone	ME1130859	1.06	1.33	1.22	0.88	0.79	1.21	0.99
Prolylleucine	ME1131425	1.04	1.40	1.20	0.90	0.77	1.21	0.98
Prolylleucine 2	ME1131426	1.04	1.40	1.20	0.90	0.77	1.21	0.98
.beta.-Alanine 2	ME1130164	0.89	1.40	1.16	0.99	0.89	1.37	0.81
Creatine 4	ME1130800	1.05	1.46	1.03	0.94	0.94	1.30	0.78
"(2R)-2,3-Dihydroxypropanoic acid"	ME1130225	1.10	1.20	1.00	1.00	0.89	1.36	0.95
Pyruvic acid 4	ME1131447	1.07	1.17	1.01	1.10	0.87	1.24	1.02
"(20E)-7-Butyl-11,16,23,24,25-pentahydroxy-10,19,20-trimethyl-15-methylene-8,13,28,29-tetraoxatetracyclo[22.3.1.1~3,6~.0~12,14~]nonacos-20-ene-9,18-dione"	ME1130202	0.97	1.30	1.01	1.04	0.98	1.27	0.91
Creatine	ME1130797	0.94	1.39	1.05	1.03	0.98	1.18	0.94
1-(1Z-hexadecenyl)-sn-glycero-3-phosphocholine	ME1130324	1.09	1.33	1.01	1.07	0.94	1.13	0.94
glutaral	ME1130971	0.97	1.29	1.14	1.07	0.93	1.12	0.96
2-Isocapryloyl-3R-hydroxymethyl-gamma-butyrolactone	ME1130422	0.65	1.28	1.05	1.07	1.08	1.41	0.95
Isobutyl-propyl-amine	ME1131057	0.82	1.13	1.06	1.06	1.08	1.40	0.93
"Tetrahydro-2,5-furan-diacetic acid"	ME1131525	0.79	1.22	1.13	1.07	1.07	1.34	0.86
Indole-3-acetic acid	ME1131050	0.61	1.24	1.25	1.13	0.91	1.42	0.94
Octyl-2KG	ME1131361	0.63	1.43	1.12	1.05	0.92	1.39	0.94
CYCLO(-SER-TYR) 2	ME1130813	0.67	0.99	1.26	1.12	1.09	1.35	1.01
DL-Dipalmitoylphosphatidylcholine	ME1130885	0.78	1.06	1.27	1.10	1.10	1.21	0.98
Seryl-4-hydroxyproline	ME1131488	0.83	1.04	1.25	1.05	1.15	1.19	1.00
C75 trans	ME1130761	0.74	0.96	1.26	1.06	1.19	1.30	0.98
ethyl argininate	ME1130928	0.78	1.06	1.20	1.01	1.15	1.32	0.99
methyl 8-[2-(2-formyl-vinyl)-3-hydroxy-5-oxo-cyclopentyl]-octanoate	ME1131196	0.79	0.97	1.08	1.12	1.18	1.42	0.92
2-Aminoheptanoic acid	ME1130402	0.76	1.08	1.04	1.24	1.11	1.32	0.96
Ecdysone	ME1130913	0.85	1.00	1.06	1.16	1.16	1.26	1.01
D-(+)-Glucose	ME1130829	0.74	1.20	1.34	0.79	1.11	1.41	0.90
"2,6-Dimethyl-7-octene-2,3,6-triol"	ME1130450	0.82	1.20	1.29	0.79	0.93	1.45	1.02
DL-Lysine 2	ME1130892	0.71	1.19	1.33	0.89	0.98	1.47	0.92
DL-Lysine 5	ME1130895	0.72	1.16	1.27	0.96	0.99	1.43	0.97
YV8195000	ME1131590	0.75	1.16	1.29	0.90	1.00	1.42	0.94
"(2S)-3-Hydroxy-1,2-propanediyl dibutanoate"	ME1130242	0.80	1.29	1.24	0.96	0.91	1.36	0.93
DL-Arginine	ME1130876	0.86	1.22	1.27	0.92	1.00	1.31	0.93
Histamine	ME1131024	0.84	1.15	1.32	0.93	1.00	1.34	0.92
L-Valine 2	ME1131127	0.81	1.20	1.19	0.94	1.03	1.40	0.93
6-Azidocaproic acid	ME1130602	0.85	1.16	1.21	0.96	1.04	1.34	0.95
DL-Arginine 2	ME1130877	0.88	1.14	1.20	0.98	1.04	1.29	0.97
Ornithine 4	ME1131367	0.88	1.14	1.17	0.99	1.08	1.29	0.95
Tedatioxetine	ME1131522	0.92	1.17	1.13	0.86	0.99	1.39	1.03
L-Cystine	ME1131093	0.93	1.11	1.27	0.88	1.02	1.38	0.92
cystine	ME1130823	0.99	1.09	1.16	0.94	1.02	1.38	0.91
L-(+)-Cysteine	ME1131078	0.99	1.07	1.21	0.88	1.02	1.47	0.86
Pyruvic acid 2	ME1131445	0.98	1.20	1.07	0.96	1.04	1.29	0.93
5-Hydroxyvalproic acid	ME1130587	0.95	1.06	1.08	1.08	1.05	1.28	0.99
Glycolic acid	ME1130995	0.98	1.14	1.13	0.94	1.07	1.19	1.02
Linolenelaidic acid	ME1131152	0.90	1.13	1.15	0.97	1.12	1.20	1.02
sulfobacin B 2	ME1131503	0.89	1.11	1.16	0.97	1.11	1.21	1.03
Gly-l-pro 2	ME1130979	0.90	1.14	1.08	1.05	1.16	1.23	0.93
Homocitrulline 2	ME1131030	0.90	1.14	1.08	1.05	1.16	1.23	0.93
L-Phenylalanine 2	ME1131111	0.92	1.16	1.14	1.11	1.09	1.17	0.91
sulfobacin B	ME1131502	0.86	1.17	1.19	1.08	1.06	1.18	0.93
L-(+)-Lactic acid	ME1131081	0.90	1.24	1.14	1.05	1.00	1.18	0.98
N-Acetylglucosaminitol 4	ME1131282	0.91	1.18	1.15	1.01	1.06	1.21	0.98
Threonine	ME1131536	0.87	1.32	1.09	1.00	1.05	1.17	0.99
DL-Citrulline	ME1130883	0.86	1.29	1.18	1.02	1.12	1.15	0.89
Ornithine 3	ME1131366	0.87	1.27	1.17	1.02	1.13	1.14	0.90
"(17Z)-N-[(2S,3R,4E)-1-{[2-Acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxy-4-octadecen-2-yl]-17-hexacosenamide"	ME1130189	0.85	1.27	1.26	0.99	0.95	1.14	1.03
3-Buten-1-amine 2	ME1130483	0.79	1.26	1.31	0.92	1.00	1.20	1.01
L-Valine	ME1131126	0.81	1.26	1.29	0.94	1.01	1.18	1.01
L-(-)-Asparagine	ME1131069	0.77	1.23	1.23	1.05	1.09	1.21	0.93
Proline 5	ME1131423	0.84	1.27	1.21	0.98	0.99	1.23	0.95
dimethylformamide	ME1130869	0.83	1.29	1.23	0.96	1.03	1.21	0.95
L-Threonine	ME1131121	0.82	1.30	1.22	0.96	1.03	1.22	0.95
3-Buten-1-amine 3	ME1130484	0.80	1.22	1.26	0.96	1.08	1.23	0.95
DL-Ornithine	ME1130897	0.83	1.23	1.28	1.00	1.05	1.20	0.90
4-Methyleneglutamine 2	ME1130562	0.83	1.25	1.26	0.98	1.06	1.19	0.91
L-(+)-Citrulline	ME1131075	0.82	1.26	1.28	0.97	1.06	1.21	0.91
Allantoin	ME1130683	0.91	1.19	1.27	0.92	1.03	1.24	0.95
Gly-Lys	ME1130981	0.95	1.23	1.26	0.92	1.04	1.16	0.92
DL-Cerulenin	ME1130881	0.90	1.16	1.23	1.02	1.11	1.11	0.96
AT0700000	ME1130717	0.91	1.15	1.30	1.04	1.04	1.14	0.93
2-Pyrrolidone	ME1130436	0.92	1.21	1.25	1.03	0.98	1.16	0.95
N-Acetylalanine	ME1131277	0.92	1.21	1.25	1.03	0.98	1.16	0.95
DL-Stachydrine	ME1130899	0.85	1.24	1.28	0.89	1.20	1.14	0.87
glu-ser 2	ME1130964	0.74	1.28	1.35	0.89	1.14	1.23	0.87
trans-4-Hydroxy-L-proline 2	ME1131552	0.78	1.33	1.35	0.86	1.07	1.22	0.88
"N~6~,N~6~-Dimethyllysine"	ME1131323	0.76	1.13	1.34	0.97	1.10	1.35	0.85
ALA-GLU	ME1130678	0.76	1.11	1.48	0.90	1.09	1.24	0.93
AMPA	ME1130693	0.76	1.11	1.48	0.90	1.09	1.24	0.93
5-Hydroxylysine	ME1130586	0.66	1.32	1.47	0.93	1.01	1.19	0.93
C7-HSL 2	ME1130760	0.77	1.16	1.39	1.00	1.02	1.18	0.97
glu-ser 3	ME1130965	0.77	1.20	1.39	1.02	1.11	1.13	0.88
Maleamic acid 2	ME1131167	0.71	1.17	1.29	1.00	1.08	1.24	1.02
Isoleucine 2	ME1131060	0.70	1.30	1.32	1.02	0.95	1.28	0.92
3-hydroxyisovalerylcarnitine	ME1130498	0.77	1.24	1.33	0.91	0.97	1.27	0.93
N-NITROSOMETHYLVINYLAMINE	ME1131298	0.72	1.23	1.38	0.97	1.01	1.28	0.92
Asparagine	ME1130715	0.73	1.23	1.33	0.99	1.03	1.27	0.92
D-Pyroaspartic Acid	ME1130849	0.73	1.23	1.33	0.99	1.03	1.27	0.92
(Z)-dehydrobutyrine	ME1130319	0.67	1.47	1.14	0.89	0.95	1.13	1.20
3-Methylsulfolene 2	ME1130509	0.66	1.31	1.23	1.05	0.89	1.16	1.18
"(2R)-2-[(9Z,12Z)-9,12-Hexadecadienoyloxy]-3-[(hydroxy{[(1R,2S,3S,4R,5R,6S)-3,4,5-trihydroxy-2-{[alpha-D-mannopyranosyl-(1->6)-alpha-D-mannopyranosyl-(1->6)-alpha-D-mannopyranosyl]oxy}-6-(alpha-D-mannopyranosyloxy)cyclohexyl]oxy}phosphoryl)oxy]propyl nonadecanoate"	ME1130223	0.75	1.39	1.03	1.10	0.89	1.17	1.15
L-(+)-Leucine 2	ME1131083	0.78	1.42	1.16	0.96	0.84	1.20	1.03
"3,10-Dihydroxydecanoic acid"	ME1130520	0.70	1.20	1.31	1.13	0.90	1.25	1.01
(+/-)9-HpODE	ME1130177	0.56	1.24	1.27	1.23	0.96	1.22	1.01
N-(3-carboxypropanoyl)-N-hydroxyputrescine	ME1131240	0.66	1.26	1.33	1.24	0.90	1.14	0.97
N-Nonanoylglycine	ME1131302	0.63	1.41	1.22	1.14	0.94	1.19	0.95
L-Glutamic acid 4	ME1131102	0.76	1.30	1.14	1.16	0.99	1.14	0.94
L-Serine	ME1131116	0.77	1.33	1.21	1.05	0.98	1.19	0.96
2-O-glutaroyl-1-O-palmitoyl-sn-glycero-3-phosphocholine	ME1130431	0.79	1.33	1.29	1.11	0.86	1.15	0.98
L-gamma-Glutamyl-L-leucine	ME1131096	0.88	1.38	1.21	1.05	0.88	1.14	0.97
3-Methyl-2-buten-1-yl hydrogen sulfate	ME1130504	0.91	1.20	1.05	1.45	0.82	1.13	0.93
Isoleucine	ME1131059	0.77	1.18	1.09	1.41	0.96	1.11	0.98
Piperidine	ME1131404	0.77	1.16	1.08	1.42	0.97	1.11	0.99
Vanillin	ME1131575	0.77	1.26	1.20	1.28	1.00	0.99	1.00
oxazolidinone 3	ME1131372	0.77	1.20	1.13	1.23	1.09	1.16	0.93
N-[(4-Methoxy-1-benzofuran-5-yl)carbonyl]glycine	ME1131255	0.82	1.15	1.13	1.24	1.15	0.93	1.07
3-Amino-3-(4-hydroxyphenyl)propanoic acid	ME1130479	0.80	1.10	1.10	1.36	1.13	0.98	1.02
N-Benzylformamide	ME1131286	0.77	1.08	1.17	1.29	1.14	1.04	1.01
(E)-Furazolidone	ME1130313	0.78	1.14	1.15	1.26	1.10	1.05	1.02
L-Tyrosine 2	ME1131125	0.77	1.12	1.18	1.24	1.11	1.07	1.01
Glycine 5	ME1130993	0.73	1.33	1.00	1.20	1.00	1.07	1.18
L-Serine 2	ME1131117	0.77	1.22	0.99	1.25	1.03	1.10	1.14
Guanidinosuccinic acid	ME1131004	0.74	1.27	1.08	1.09	1.07	1.17	1.07
"3-(5-tert-Butyl-3-hydroxy-1,2-oxazol-4-yl)-L-alanine"	ME1130468	0.79	1.23	1.15	1.16	0.95	1.10	1.11
"(7R,18Z)-4-Hydroxy-N,N,N-trimethyl-7-[(9Z)-9-octadecenoyloxy]-10-oxo-3,5,9-trioxa-4-phosphaheptacos-18-en-1-aminium 4-oxide"	ME1130298	0.80	1.20	1.09	1.12	1.02	1.09	1.18
"1,2-dioleoyl-sn-glycero-3-phospho-N,N-dimethylethanolamine"	ME1130360	0.95	1.22	1.06	1.11	0.94	1.10	1.12
"1-deoxy-D-threo-hexo-2,5-diulose 6-phosphate"	ME1130337	0.85	1.13	1.06	1.13	1.02	1.17	1.13
"(3beta,24R)-Ergost-5-en-3-yl 6-O-[(7Z,10Z,13Z)-7,10,13-hexadecatrienoyl]-beta-D-glucopyranoside"	ME1130255	0.88	1.15	1.08	1.13	0.96	1.16	1.13
Leu-Leu	ME1131142	0.92	1.69	1.03	1.03	1.16	0.86	0.81
N-(pentadecanoyl)sphinganine-1-phosphocholine	ME1131245	1.01	1.64	1.13	0.65	1.06	0.93	1.06
3-[(14Z)-14-Henicosen-1-yl]phenol	ME1130469	0.86	1.43	1.16	1.22	0.75	0.91	1.15
"(5Z,7E)-9,10-Secocholesta-5,7,10-triene"	ME1130283	0.86	1.43	1.16	1.22	0.75	0.91	1.15
Ornithine 2	ME1131365	0.80	1.57	1.09	1.21	0.81	0.93	1.08
Retinyl acetate	ME1131455	0.79	1.58	1.06	1.08	0.87	0.95	1.17
L(+)-Ornithine	ME1131130	0.76	1.64	1.02	1.02	0.98	1.05	1.01
7-Hexyl-2-methyl-2-(4-methyl-3-penten-1-yl)-2H-chromen-5-ol	ME1130618	0.68	1.76	1.23	0.94	0.84	1.11	0.95
Ornithine	ME1131364	0.73	1.72	1.23	1.04	0.77	1.08	0.92
Proline 4	ME1131422	0.78	1.59	1.12	0.99	0.90	1.09	0.92
3-Buten-1-amine	ME1130482	0.82	1.69	1.17	0.97	0.85	1.02	0.98
Choline	ME1130780	0.82	1.69	1.17	0.97	0.85	1.02	0.98
L-Methionine (R)-S-oxide	ME1131108	0.92	1.54	1.35	1.07	0.76	0.94	0.92
4-(Methylthio)-2-oxobutyric acid	ME1130536	0.86	1.51	1.44	1.04	0.71	1.02	0.92
L-Methionine sulfoxide	ME1131109	0.86	1.51	1.44	1.04	0.71	1.02	0.92
Proline 2	ME1131420	0.67	1.46	1.25	1.17	0.77	1.12	1.05
Proline 3	ME1131421	0.72	1.56	1.21	1.20	0.77	1.05	1.00
Trigonelline	ME1131559	0.70	1.60	1.26	1.14	0.79	1.07	0.94
"(12E)-14-Pentyloxacyclotetradec-12-ene-2,11-dione"	ME1130184	0.61	1.53	1.31	1.02	0.88	1.01	1.05
DL-Tryptophan 2	ME1130901	0.80	1.40	1.33	1.08	0.96	0.98	0.95
L-(+)-norleucine	ME1131084	0.69	1.45	1.32	1.18	0.87	0.99	0.98
AT0700000 2	ME1130718	0.93	1.53	1.41	0.74	1.01	1.12	0.74
propionylcarnitine 2	ME1131430	0.92	1.62	1.54	0.76	0.98	0.91	0.77
Prolylleucine 3	ME1131427	1.24	1.53	1.23	0.90	0.64	1.04	0.92
9-ethylpurin-6-amine	ME1130633	1.04	1.66	1.28	0.81	0.75	0.95	1.01
DL-Lactic Acid 4	ME1130891	0.98	1.54	1.33	0.82	0.90	1.08	0.85
5-Octyl-2-oxotetrahydro-3-furancarboxylic acid	ME1130593	0.94	1.51	1.36	0.77	0.80	1.04	0.98
Ascosalitoxin	ME1130712	0.94	1.54	1.42	0.76	0.78	1.01	0.96
"(5Z,8Z,11E,14Z,17Z)-5,8,11,14,17-Icosapentaenoic acid"	ME1130286	1.03	1.48	1.25	0.97	0.77	0.88	1.12
Hexonic acid	ME1131018	1.16	1.47	1.41	0.78	0.70	0.96	1.02
LECITHIN	ME1131138	1.10	1.44	1.39	0.83	0.79	0.89	1.06
Isovalerylglycine	ME1131061	1.16	1.36	1.48	0.89	0.76	0.85	0.99
Mevalonic acid	ME1131201	1.06	1.36	1.46	0.90	0.84	0.94	0.94
Platelet-activating factor	ME1131413	1.36	1.20	0.95	0.98	1.20	1.45	0.36
"1,3,7-Octanetriol"	ME1130364	1.20	0.94	1.40	1.05	1.10	1.23	0.49
"(2R,3R,4S,5S,6R)-3-(acetyloxy)-2-[(acetyloxy)methyl]-5-(hexanoyloxy)-6-[(2S,3R)-2,3,4-trihydroxybutoxy]oxan-4-yl tetradecanoate 3"	ME1130218	1.04	1.05	1.20	0.95	1.25	1.39	0.61
Embelin	ME1130919	1.26	1.08	1.08	1.04	1.26	1.22	0.52
"6,7-Dihydroxy-2-(4-hydroxyphenyl)-8-(3-methyl-2-buten-1-yl)-4-oxo-3,4-dihydro-2H-chromen-5-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside"	ME1130615	1.48	0.77	0.87	0.82	1.25	1.26	1.04
4-Hydroxy-5-methylfuran-3(2H)-one	ME1130550	1.36	0.77	0.82	1.19	1.11	1.23	0.83
DL-Lactic Acid 2	ME1130889	1.31	0.79	0.76	0.95	1.17	1.24	1.24
Thymidine	ME1131539	1.26	0.77	0.76	1.17	1.10	1.31	1.13
"(1aR,1bR,2R,4aR,7aS,7bR,8R,9R,9aS)-9a-(Decanoyloxy)-2-hydroperoxy-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1a,1b,2,4a,5,7a,7b,8,9,9a-decahydro-1H-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl benzoate"	ME1130193	1.38	0.80	0.68	1.18	1.21	1.23	1.03
Zebularine	ME1131593	1.40	0.78	0.65	1.06	1.23	1.37	1.01
4-amino-2-methyl-5-phosphooxymethylpyrimidine	ME1130543	1.17	1.01	0.41	1.22	1.30	1.33	1.06
5-Nitro-o-toluidine	ME1130591	1.40	0.85	0.48	1.22	1.53	0.96	1.07
D-(_)-Erythrulose	ME1130840	1.23	1.08	0.77	1.25	1.28	0.83	0.98
4-Hydroxy-5-methylfuran-3(2H)-one 2	ME1130551	1.11	1.05	0.76	1.26	1.21	1.00	1.10
"beta-D-galactosyl-(1<->1^)-N-icosanoyl-(4E,14Z)-sphingadienine"	ME1130731	1.29	0.96	0.66	1.21	1.24	0.98	1.15
Hex-2-ulose 3	ME1131016	1.19	0.97	0.59	1.37	1.24	1.00	1.05
Acetohydroxamic acid 2	ME1130648	1.26	1.05	0.84	1.31	1.03	0.93	1.04
Sulfuric acid 4	ME1131508	1.35	0.85	0.78	1.29	1.18	1.01	1.03
Bayer E 39 Soluble 2	ME1130724	0.90	1.20	0.69	0.87	1.56	1.21	1.07
"Pregnane-3,3-diol"	ME1131416	0.90	0.64	0.93	1.05	1.49	1.46	1.00
"(3beta)-Cholest-5-en-3-yl (5Z,8Z,12E,14Z)-11-hydroperoxy-5,8,12,14-icosatetraenoate"	ME1130260	0.86	0.68	0.98	1.16	1.39	1.32	1.11
4-Indolecarbaldehyde	ME1130559	0.79	0.72	0.92	1.36	1.35	1.36	1.01
D-(+)-Tryptophan	ME1130835	0.81	0.76	0.90	1.37	1.28	1.37	1.00
2-(4-Nonylphenoxy)ethanol	ME1130388	0.85	0.78	0.93	1.18	1.35	1.44	0.95
Bellendine	ME1130725	0.80	0.77	0.95	1.22	1.29	1.39	1.05
2-Deoxy-4-S-{2-deoxy-2-[(E)-(1-hydroxyethylidene)amino]-beta-D-glucopyranosyl}-2-[(Z)-(1-hydroxyethylidene)amino]-4-thio-D-glucopyranose	ME1130408	0.95	0.77	0.96	1.02	1.55	1.27	0.97
"N,N-Diethylethanolamine"	ME1131314	0.89	0.83	0.99	1.06	1.46	1.24	1.02
Piperidine 4	ME1131407	0.89	0.83	0.99	1.06	1.46	1.24	1.02
"3-Hydroxyoxacyclononacosane-2,25-dione"	ME1130499	0.94	0.96	0.92	1.03	1.25	1.32	1.04
L-Ergothioneine	ME1131095	0.78	0.92	1.01	1.08	1.36	1.33	1.02
anacardic acid	ME1130694	0.85	0.87	1.03	1.07	1.27	1.41	0.96
"(7E,10E,13E,16E)-7,10,13,16-Docosatetraenoic acid"	ME1130296	0.94	0.86	1.00	1.04	1.30	1.35	1.00
Petromyzonol	ME1131390	0.87	0.87	0.96	1.09	1.29	1.33	1.05
L-(+)-ERGOTHIONEINE	ME1131079	0.87	0.84	0.84	1.25	1.39	1.17	1.14
Pyrazinemethanethiol	ME1131436	0.84	0.87	0.90	1.19	1.35	1.21	1.14
"3-Hydroxy-3-methyl-5-oxo-5-[(3,12,24,25-tetrahydroxylanost-8-en-2-yl)oxy]pentanoic acid"	ME1130493	1.00	0.81	0.71	1.15	1.37	1.34	1.13
Clonixin	ME1130791	1.00	0.82	0.86	1.05	1.35	1.31	1.11
Palmitoyl sphingomyelin	ME1131380	1.00	0.77	0.92	1.17	1.23	1.24	1.17
Palmitoyl sphingomyelin 2	ME1131381	1.00	0.77	1.01	1.01	1.24	1.35	1.11
"3,6-epoxyhexacosa-hexaenoic acid"	ME1130530	0.85	0.77	0.62	1.33	1.40	1.43	1.10
Corticosterone	ME1130794	0.85	0.77	0.62	1.33	1.40	1.43	1.10
DL-Tryptophan 5	ME1130904	0.84	0.70	0.76	1.34	1.42	1.56	0.87
N6-Acetyl-L-lysine	ME1131329	0.85	0.81	0.75	1.28	1.45	1.36	0.91
(1Z)-1-Ethylidene-7-isopropyl-3-{[(2Z)-2-methyl-2-butenoyl]oxy}-4-methylene-2-oxooctahydro-1H-inden-5-yl (2E)-3-methyl-2-pentenoate	ME1130198	1.03	0.89	0.72	1.14	1.35	1.48	0.82
N-Phenyl-beta-D-glucopyranosylamine	ME1131307	0.83	1.03	0.77	1.21	1.32	1.45	0.89
Fructoselysine 4	ME1130948	0.80	1.04	0.78	1.17	1.37	1.42	0.92
L-allysine	ME1131090	0.79	1.07	0.81	1.20	1.33	1.41	0.90
Acetyl-_-methylcholine	ME1130657	0.89	0.93	0.81	1.24	1.25	1.47	0.92
Pipecolic acid 3	ME1131403	0.81	0.90	0.84	1.19	1.35	1.44	0.95
"3-(2,4-Dihydroxyphenyl)-7-(6-hydroxy-1-benzofuran-2-yl)-13-methyl-4,14-dioxapentacyclo[11.7.1.0~2,11~.0~5,10~.0~15,20~]henicosa-2,5,7,9,11,15,17,19-octaene-9,17,21-triol"	ME1130465	1.22	0.91	0.66	1.28	1.47	1.02	0.93
Taurine 6	ME1131514	1.16	0.92	0.76	1.32	1.36	1.02	0.96
Taurine 7	ME1131515	1.15	0.92	0.76	1.37	1.37	0.91	1.02
L-Alanyl-L-glutamine	ME1131088	1.06	1.06	0.72	1.33	1.45	0.91	0.98
N-Acetyl-L-leucine 3	ME1131271	1.06	1.00	0.56	1.27	1.61	1.03	0.96
"(2S)-3-Methyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)butanoic acid (non-preferred name)"	ME1130245	1.09	1.05	0.59	1.27	1.56	0.97	0.96
(Z)-N-[(2R)-2-Amino-1-hydroxy-3-{[(1E)-N-hydroxy-5-(methylsulfanyl)pentanimidoyl]sulfanyl}propylidene]glycine	ME1130320	1.09	1.04	0.60	1.24	1.55	1.00	0.99
3-(2-Hydroxyphenyl)-2-oxiranecarboxylic acid	ME1130464	0.80	0.99	0.74	1.28	1.67	1.07	0.95
Fructoselysine	ME1130945	0.96	0.91	0.60	1.43	1.50	1.18	0.92
Gly-Leu	ME1130980	0.91	0.98	0.67	1.35	1.41	1.25	0.93
L-(+)-Citrulline 3	ME1131077	0.88	1.01	0.70	1.02	1.58	1.27	1.05
"(2S)-4-Methyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)pentanoic acid (non-preferred name) 5"	ME1130251	0.94	0.96	0.62	1.22	1.67	1.13	0.95
Glycyl-L-leucine	ME1130996	0.97	0.95	0.64	1.24	1.59	1.20	0.91
"1,2-Benzoquinone 2"	ME1130359	0.91	1.07	0.78	1.11	1.44	1.24	0.94
b-Angelica lactone	ME1130719	0.95	1.00	0.66	1.20	1.55	1.15	1.00
lactide	ME1131133	0.95	1.01	0.67	1.19	1.50	1.21	0.97
3-Butynoic acid 4	ME1130488	0.91	1.03	0.68	1.16	1.49	1.24	0.99
Maltol	ME1131172	0.92	1.01	0.69	1.17	1.46	1.21	0.99
Diethylpyrocarbonate 3	ME1130864	0.89	1.03	0.66	1.17	1.53	1.27	0.95
DL-Lysine 6	ME1130896	0.90	0.99	0.70	1.16	1.52	1.27	0.97
Fructoselysine 6	ME1130950	0.88	1.00	0.69	1.19	1.49	1.28	0.97
N6-Acetyl-L-lysine 3	ME1131331	0.91	0.95	0.64	1.22	1.54	1.25	0.96
Pyrone 3	ME1131442	0.90	1.01	0.66	1.26	1.48	1.23	0.96
Hopantenic acid	ME1131033	1.11	0.97	0.59	1.30	1.48	1.34	0.71
"(5Z,17R)-23-Amino-20-hydroxy-20-oxido-14-oxo-15,19,21-trioxa-20lambda~5~-phosphatricos-5-en-17-yl (6Z,9Z,12Z)-6,9,12-octadecatrienoate"	ME1130282	1.19	0.68	0.58	1.23	1.53	1.33	0.96
DL-Tryptophan 3	ME1130902	1.03	0.73	0.59	1.35	1.59	1.23	0.99
"2-(3,4-Dihydroxyphenyl)-3-(beta-D-erythro-hexopyranosyloxy)-5-hydroxy-6-methoxy-4-oxo-4H-chromen-7-yl hydrogen sulfate"	ME1130387	1.05	1.34	0.80	1.02	1.34	0.93	1.02
MM11253	ME1131218	0.98	1.31	0.68	1.15	1.29	1.03	1.05
Mesaconic acid	ME1131188	0.86	1.13	0.74	1.30	1.37	1.21	0.88
"5-(5-{5-[(2S)-1-Isopropyl-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}-2-pyridinyl)pyrimidine"	ME1130581	0.97	1.00	0.79	1.26	1.29	1.25	0.94
MMDPPO 2	ME1131220	0.95	1.05	0.87	1.28	1.24	1.15	0.95
ACETYL ARGININE	ME1130653	1.01	1.03	0.68	1.35	1.27	1.15	1.01
Methylone	ME1131198	1.06	1.06	0.76	1.37	1.26	1.04	0.94
5-Imino-2-methyl-1-cyclopenten-1-ol	ME1130588	0.97	1.16	0.70	1.35	1.31	1.07	0.94
Miglitol	ME1131216	1.03	1.14	0.70	1.35	1.33	1.03	0.92
Ac-Ala-OH	ME1130641	1.03	1.13	0.70	1.34	1.31	1.03	0.96
muramic acid	ME1131223	1.02	1.13	0.69	1.36	1.31	1.05	0.94
L-Isoleucine	ME1131106	0.90	1.10	0.86	1.33	1.27	1.05	0.99
Piperidine 3	ME1131406	0.91	1.08	0.80	1.35	1.33	1.04	0.99
Succinyl proline	ME1131499	0.95	1.10	0.80	1.32	1.17	1.18	0.98
Benzoguanamine	ME1130727	0.94	1.14	0.82	1.31	1.21	1.14	0.94
muramic acid 3	ME1131225	0.96	1.14	0.78	1.30	1.22	1.14	0.96
"(2S)-4-(Methylsulfanyl)-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)butanoic acid"	ME1130246	0.92	1.20	0.79	1.32	1.22	1.09	0.96
L-(-)-Methionine 2	ME1131072	0.94	1.16	0.77	1.39	1.18	1.06	1.00
O-(3-Carboxypropanoyl)homoserine	ME1131348	0.96	1.13	0.76	1.35	1.20	1.10	1.01
N-Acetylglucosaminitol 3	ME1131281	0.81	1.15	0.82	1.45	1.18	1.08	1.00
N-Acetylglucosaminitol 2	ME1131280	0.87	1.19	0.86	1.43	1.22	1.07	0.85
DL-Glutamic acid	ME1130886	0.89	1.18	0.94	1.33	1.17	1.10	0.91
neuraminic acid	ME1131337	0.91	1.16	0.86	1.39	1.17	1.10	0.91
N-_-Acetyl-L-asparagine	ME1131313	0.86	1.05	1.01	1.32	1.22	1.10	0.93
Tricine	ME1131555	0.92	0.91	1.01	1.25	1.32	1.19	0.89
"(2S)-3-Hydroxy-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)propanoic acid (non-preferred name)"	ME1130244	0.81	1.22	0.89	1.26	1.17	1.23	0.91
N2-Succinyl-L-glutamic acid 5-semialdehyde	ME1131325	0.79	1.24	0.90	1.23	1.19	1.24	0.91
Formiminoglutamic Acid 2	ME1130940	0.71	1.16	0.96	1.29	1.20	1.26	0.92
N-Glycosyl-L-asparagine 2	ME1131291	0.78	1.09	0.93	1.29	1.20	1.30	0.90
Hydroxyproline	ME1131038	0.93	1.25	0.92	1.22	1.13	1.14	0.91
L-Threonine 3	ME1131123	0.89	1.16	0.96	1.28	1.06	1.16	0.98
oxazolidinone 2	ME1131371	0.89	1.16	0.96	1.29	1.06	1.16	0.98
"(2S)-3-Hydroxy-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)butanoic acid (non-preferred name)"	ME1130243	0.89	1.18	0.84	1.06	1.30	1.21	1.00
MFCD00153866	ME1131209	0.98	1.22	0.70	0.99	1.30	1.24	1.06
Gly-Ser	ME1130982	0.85	1.21	1.06	0.91	1.29	1.30	0.85
({5-[(2S)-2-Carboxy-2-(trimethylammonio)ethyl]-1H-imidazol-2-yl}sulfanyl)oxidanide	ME1130171	1.03	1.07	0.96	1.08	1.24	1.18	0.94
N-Acetylglucosaminitol	ME1131279	0.90	1.13	0.97	1.08	1.26	1.22	0.95
Taurine	ME1131509	0.99	1.09	1.03	1.04	1.25	1.26	0.82
HC red 3	ME1131010	1.01	1.23	0.95	0.95	1.29	1.20	0.86
N1-(4-pyridyl)-2-(benzoylamino)benzamide	ME1131324	0.98	1.18	0.97	1.03	1.24	1.22	0.88
acetyltaurine 2	ME1130664	1.14	0.99	0.85	1.17	1.27	1.09	0.99
N-methylsulfonyl-6-(2-propargyloxyphenyl)hexanamide	ME1131297	1.09	1.01	0.85	1.08	1.33	1.16	0.99
acetyltaurine	ME1130663	1.09	0.99	0.89	1.11	1.26	1.16	1.00
Taurine 3	ME1131511	1.07	0.95	0.85	1.14	1.31	1.18	1.00
4-Methyleneglutamine 3	ME1130563	1.01	1.16	0.70	1.18	1.36	1.12	0.96
L-(+)-Citrulline 2	ME1131076	1.00	1.02	0.82	1.17	1.43	1.12	0.95
3-Buten-1-amine 4	ME1130485	1.01	1.06	0.78	1.22	1.46	0.99	0.96
L-Valine 3	ME1131128	1.01	1.07	0.79	1.22	1.44	1.00	0.97
"2,6-Diamino-7-hydroxynonanedioic acid"	ME1130449	1.13	1.04	0.86	1.01	1.52	1.06	0.86
N-Acetyl-L-histidine	ME1131267	1.16	1.12	0.95	1.07	1.31	1.10	0.79
"2-decene-4,6,8-triyn-1-al"	ME1130407	0.98	1.09	0.73	1.48	1.08	1.39	0.73
"5,2^-O-Dimethyluridine 2"	ME1130597	1.08	1.02	0.78	1.34	1.02	1.39	0.87
ALA-GLU 2	ME1130679	1.15	0.98	0.72	1.47	1.08	1.17	0.91
ACETYL ARGININE 2	ME1130654	1.08	0.96	0.73	1.44	0.99	1.15	1.15
Creatine 2	ME1130798	0.94	0.97	0.86	1.48	0.94	1.18	1.13
Lactamide 2	ME1131132	0.91	1.31	1.07	1.22	1.12	1.10	0.76
"2,3,4,5-Tetrahydroxypentanal"	ME1130441	0.75	1.35	1.09	1.38	1.04	1.18	0.71
L-Serine 3	ME1131118	0.70	1.28	0.99	1.36	1.13	1.20	0.84
1-(1Z-octadecenyl)-2-oleoyl-sn-glycero-3-phosphoserine	ME1130327	1.16	1.12	0.96	1.34	0.92	1.16	0.84
4-Oxo-2-propylpentanoic acid	ME1130566	1.06	1.05	1.04	1.22	1.10	1.14	0.86
O-(Carbamoylamino)homoserine	ME1131350	0.90	1.04	1.07	1.25	1.12	1.21	0.77
Taurine 8	ME1131516	1.10	1.13	1.02	1.16	1.00	1.31	0.77
Triethylamine	ME1131556	1.13	1.01	1.18	1.11	1.04	1.18	0.76
Acrylic acid 3	ME1130668	1.17	1.22	1.00	1.01	0.73	1.21	1.16
laurilsulfate	ME1131137	1.29	1.32	0.71	0.94	0.75	1.16	1.21
"1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine"	ME1130325	1.21	0.99	1.19	0.74	1.27	0.80	1.27
"(2R)-2,3-Bis(hexadecyloxy)propyl 2-(dimethylamino)ethyl hydrogen phosphate"	ME1130224	1.25	0.91	1.26	0.67	1.20	1.01	1.15
HPOB	ME1131034	1.27	0.90	1.13	0.82	1.29	0.98	1.10
O-Acetyl-DL-serine	ME1131359	1.43	0.94	0.82	0.87	1.29	1.00	1.15
"1a-[(2E,14E,18E,22E)-3,7,11,15,19,23-Hexamethyl-25-(2,6,6-trimethyl-2-cyclohexen-1-yl)-2,14,18,22-pentacosatetraen-1-yl]-7a-methyl-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione"	ME1130380	1.33	0.95	0.96	0.74	1.18	1.00	1.34
"(4S)-N-(2,3-dihydroxytetracosanoyl)-4-hydroxysphinganine"	ME1130277	1.27	1.15	0.85	0.82	1.15	0.98	1.22
(-)-Lupinine	ME1130168	1.12	0.71	1.10	1.17	1.13	0.99	1.26
"2a,4a,7-Trihydroxy-3-(hydroxymethyl)-6,6,7b-trimethyl-2,2a,4a,5,6,7,7a,7b-octahydro-1H-cyclobuta[e]inden-2-yl 3-chloro-6-hydroxy-4-methoxy-2-methylbenzoate"	ME1130459	1.23	0.94	0.93	0.93	1.26	0.91	1.31
Sulfuric acid	ME1131505	1.20	0.98	0.95	1.06	1.26	0.87	1.17
methadone-d9	ME1131191	1.36	0.89	0.85	1.17	1.11	0.89	1.21
Perfluoro-1-octanesulfonic acid (PFOS)	ME1131388	1.16	0.93	0.90	1.13	1.13	1.01	1.24
1-Stearoyl-2-hydroxy-sn-glycero-3-PE	ME1130354	1.44	1.11	0.95	0.96	1.01	0.97	1.06
Trifluoroacetic acid	ME1131557	1.38	1.31	0.89	1.02	0.94	0.83	0.98
Creatine 5	ME1130801	1.13	1.44	0.90	0.94	1.12	1.14	0.84
Trametinib-13C-d3	ME1131547	1.38	1.26	1.01	0.94	1.11	1.09	0.71
"3,4-dihydroxybutyric acid"	ME1130524	1.39	1.20	0.84	0.87	1.15	1.07	0.94
"(17Z)-N-[(2S,3R,4E)-1-{[alpha-D-Galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxy-4-octadecen-2-yl]-17-hexacosenamide"	ME1130190	1.29	1.34	0.93	0.97	1.00	1.08	0.89
3-Methylhistidine	ME1130506	1.29	1.22	0.91	0.98	1.09	1.08	0.93
"(2,7-Dimethyloctahydro-1H-cyclopenta[c]pyridin-4-yl)methanol"	ME1130201	1.11	0.98	1.16	1.07	1.07	0.88	1.21
1-Hexadecanoylpyrrolidine	ME1130340	1.04	0.96	1.13	1.11	1.01	0.96	1.23
"(3E,5E,7E,9E)-5,7-Diethyl-9-methyl-3,5,7,9-tridecatetraene"	ME1130263	1.04	0.98	1.07	1.10	1.08	1.00	1.22
MFCD00800489	ME1131212	1.07	1.02	1.07	1.08	1.05	1.00	1.19
Palmitamide	ME1131377	1.07	1.02	1.07	1.08	1.05	1.00	1.19
Linoleamide	ME1131150	1.09	1.00	1.10	1.06	1.07	0.99	1.21
Oleamide	ME1131362	1.10	0.99	1.08	1.08	1.05	0.98	1.21
Santene	ME1131475	1.06	1.05	1.14	1.01	1.07	0.99	1.17
"(E,E)-2,4-Dodecadienal"	ME1130309	1.04	1.03	1.10	1.03	1.09	0.94	1.18
(9Z)-9-Hexadecenamide	ME1130306	1.06	1.01	1.10	1.03	1.10	1.00	1.20
Pumiliotoxin 251D	ME1131433	1.05	1.00	1.13	1.05	1.11	0.98	1.17
"(15R,21S)-18,21,22-Trihydroxy-3-methyl-18-oxido-12-oxo-13,17,19-trioxa-18lambda~5~-phosphadocosan-15-yl 22-methyltricosanoate"	ME1130187	0.90	1.06	1.00	1.17	1.14	1.09	1.13
Homocitrulline	ME1131029	0.87	1.10	0.89	1.07	1.11	1.17	1.28
Pyruvic acid 3	ME1131446	0.91	1.09	0.93	1.11	1.04	1.15	1.20
MECHLORETHAMINE OXIDE	ME1131174	1.03	1.15	1.00	0.99	0.96	1.20	1.16
"(18R,24S)-21,24,25-Trihydroxy-21-oxido-15-oxo-16,20,22-trioxa-21lambda~5~-phosphapentacosan-18-yl (11Z)-11-docosenoate"	ME1130191	1.09	1.12	1.00	1.03	1.02	1.04	1.20
ascopyrone M 2	ME1130708	1.03	1.14	0.88	1.09	1.02	1.04	1.28
LT9970000 3	ME1131157	1.03	1.14	0.88	1.09	1.02	1.04	1.28
4-Hydroxy-but-2-enoic acid	ME1130552	1.03	1.13	0.98	1.07	1.01	1.01	1.22
D-(_)-Erythrose	ME1130837	1.06	1.12	0.93	1.10	1.01	1.03	1.24
2-Oxo-4-pentenoic acid	ME1130432	1.04	1.11	0.94	1.09	1.01	1.03	1.25
D-3-Deoxyglucosone	ME1130841	1.04	1.12	0.94	1.08	1.01	1.03	1.25
2-palmitoyl-sn-glycero-3-phosphocholine	ME1130435	1.07	1.25	1.08	0.94	0.95	0.93	1.27
"5-[3-{[6-O-(Carboxyacetyl)-2-O-{2-O-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoyl]-beta-D-glucopyranosyl}-beta-D-galactopyranosyl]oxy}-7-({6-O-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoyl]-beta-D-glucopyranosyl}oxy)-5-hydroxy-2-chromeniumyl]-2,3-dihydroxyphenyl beta-D-glucopyranosiduronic acid"	ME1130584	1.18	1.27	0.97	0.99	0.91	1.05	1.10
Benzothiazole	ME1130728	1.15	1.26	0.84	1.01	1.08	0.92	1.17
O-(Hydroxy{(2R)-2-hydroxy-3-[(2-methoxyoctadecyl)oxy]propoxy}phosphoryl)-L-serine 2	ME1131355	1.14	1.24	0.92	1.15	0.95	0.91	1.19
O-(Hydroxy{(2R)-2-hydroxy-3-[(2-methoxynonadecyl)oxy]propoxy}phosphoryl)-L-serine	ME1131353	1.28	1.12	0.77	1.06	1.17	1.08	1.02
O-(Hydroxy{(2R)-2-hydroxy-3-[(2-methoxyicosyl)oxy]propoxy}phosphoryl)-L-serine	ME1131352	1.27	0.95	0.74	1.16	1.16	1.19	1.05
Meglutol	ME1131177	1.27	1.02	0.69	1.03	1.14	1.18	1.17
N-acetyl-L-2-aminoadipic acid	ME1131264	1.21	1.08	0.65	1.05	1.15	1.20	1.14
"(R)-Tetrahydrofuran-3-yl4-(6-(5-(4-ethoxy-1-isopropylpiperidin-4-yl)pyridin-2-yl)pyrrolo[1,2-b]pyridazin-4-yl)piperazine-1-carboxylate"	ME1130314	1.20	0.94	0.76	1.13	1.12	1.15	1.18
Pyridoxal	ME1131437	1.24	1.07	0.79	1.05	1.14	1.08	1.11
"1,2-Benzoquinone"	ME1130358	1.14	1.05	0.79	1.09	1.10	1.15	1.17
Tulipalin A 2	ME1131562	1.21	1.01	0.79	1.08	1.09	1.17	1.12
ascopyrone M	ME1130707	1.20	1.04	0.81	1.08	1.11	1.13	1.12
3-Butynoic acid 2	ME1130486	1.21	1.03	0.79	1.05	1.11	1.15	1.14
Pyrone	ME1131440	1.19	1.04	0.81	1.05	1.11	1.15	1.14
DL-Glutamine	ME1130887	1.14	1.09	0.88	1.19	1.07	1.24	0.90
"1,2-Dipalmitoyl-d6-rac-glycero-3-PC"	ME1130361	1.07	1.12	0.95	1.11	1.02	1.19	0.96
Nicotinamide	ME1131338	1.08	1.14	0.93	1.00	1.09	1.27	0.99
3-Hydroxybutyric acid	ME1130495	1.26	0.95	0.96	0.95	1.14	1.26	0.97
Codonopsine	ME1130792	1.06	1.00	0.89	1.04	1.19	1.29	1.01
2-Formyloxymethylclavam	ME1130410	1.13	1.03	0.91	0.98	1.20	1.31	0.92
Aceglutamide 2	ME1130644	1.13	1.03	0.93	0.97	1.22	1.28	0.93
"5,2^-O-Dimethyluridine"	ME1130596	1.10	1.03	0.91	1.06	1.17	1.30	0.92
N-Succinyl-L-diaminopimelic acid	ME1131309	1.13	1.01	0.91	1.02	1.18	1.34	0.91
DL-3-Hydroxykyunrenine	ME1130874	1.21	1.05	0.85	1.07	1.12	1.28	0.93
Aceglutamide	ME1130643	1.20	0.99	0.88	1.06	1.22	1.22	0.93
Adipamide	ME1130673	1.19	1.00	0.90	1.05	1.21	1.25	0.90
Melengestrol acetate 2	ME1131180	1.04	1.23	0.89	1.18	1.14	0.95	1.06
Aceturic acid 2	ME1130651	1.11	1.24	0.87	1.13	1.09	1.09	0.98
N.pi.-Methyl-L-histidine	ME1131318	1.13	1.20	0.86	1.09	1.17	1.07	0.98
Crotonic acid 2	ME1130809	1.08	1.22	0.97	1.07	1.17	1.06	0.92
beta-D-Mannopyranose	ME1130732	1.07	1.16	0.97	1.04	1.17	1.11	0.97
D-Mannoheptulose	ME1130846	1.05	1.18	0.92	1.08	1.15	1.14	0.98
D-rhamnose	ME1130850	1.05	1.18	0.92	1.08	1.15	1.14	0.98
O-(3-Carboxypropanoyl)homoserine 2	ME1131349	1.02	1.26	0.88	1.15	1.24	1.07	0.88
"8-amino-3,8-dideoxy-alpha-D-manno-oct-2-ulosonic acid"	ME1130624	1.00	1.26	0.78	1.12	1.29	1.11	0.94
"8-Methyl-8-azabicyclo[3.2.1]octane-1,2,3,4,6-pentol"	ME1130632	0.94	1.20	0.83	1.15	1.23	1.09	0.99
Glucoheptonic Acid	ME1130966	1.19	1.12	0.89	1.17	0.93	1.11	1.08
D-(+)-Glucose 2	ME1130830	1.10	1.14	0.89	1.16	0.97	1.13	1.09
Acrylic acid 2	ME1130667	1.10	1.15	0.95	1.12	0.95	1.14	1.09
Furfuranol	ME1130951	1.16	1.13	0.92	1.11	0.95	1.14	1.09
4-Hydroxy-2-butynal	ME1130548	1.16	1.13	0.92	1.11	0.95	1.14	1.09
ascopyrone M 3	ME1130709	1.16	1.13	0.92	1.11	0.95	1.14	1.09
"(2S)-1-(Henicosanoyloxy)-3-hydroxy-2-propanyl (10Z,13Z,16Z)-10,13,16-docosatrienoate"	ME1130235	1.13	1.09	0.96	1.05	1.05	1.08	1.05
D-(_)-Erythrose 2	ME1130838	1.17	1.09	0.90	1.13	1.08	1.09	1.05
Levulinic acid 2	ME1131147	1.17	1.11	0.88	1.11	1.07	1.09	1.04
Diethylpyrocarbonate 2	ME1130863	1.17	1.11	0.88	1.11	1.07	1.09	1.04
Ethanoic anhydride	ME1130925	1.17	1.11	0.88	1.11	1.07	1.09	1.04
p-Toluenesulfonic acid	ME1131375	1.11	1.04	0.95	1.18	1.14	1.11	0.97
13C3-Lactate	ME1130374	1.23	1.02	0.99	1.09	1.16	1.03	0.96
Adenine	ME1130670	1.20	1.04	0.92	1.16	1.14	1.04	1.00
N-nonadecanoylsphingosine-1-phosphocholine	ME1131299	1.16	1.11	0.96	1.10	1.13	1.03	0.99
1-Myristoyl-2-arachidonoyl-sn-glycero-3-phosphocholine	ME1130343	1.14	1.02	1.01	1.05	1.12	1.06	1.09
"(21R,27S)-24,27,28-Trihydroxy-24-oxido-19,23,25-trioxa-24lambda~5~-phosphaoctacosan-21-yl (6Z,9Z,12Z,15Z)-6,9,12,15-octadecatetraenoate"	ME1130204	1.11	1.03	0.99	1.07	1.08	1.10	1.12
"(21R,27S)-24,27,28-Trihydroxy-24-oxido-19,23,25-trioxa-24lambda~5~-phosphaoctacosan-21-yl (9Z)-9-nonadecenoate"	ME1130205	1.14	1.08	0.99	0.99	1.13	1.07	1.01
Glucose 1-phosphate	ME1130969	1.07	1.08	1.02	1.06	1.08	1.12	1.06
Ceramide (d18:1/24:0)	ME1130775	1.11	1.11	1.02	1.01	1.11	1.08	1.06
"N-[(2S,3R,4E)-3-Hydroxy-4-octadecen-2-yl]hexacosanamide"	ME1131250	1.04	1.09	1.02	1.01	1.12	1.06	1.09
N-docosanoylsphingosine-1-phosphate	ME1131288	1.06	1.13	1.02	1.04	1.11	1.07	1.07
Menaquinone 9	ME1131182	1.18	1.10	1.02	1.06	1.07	0.94	1.09
plastoquinol-9	ME1131412	1.14	1.17	0.99	1.01	1.12	1.00	1.06
2-Oxo-4-pentenoic acid 2	ME1130433	1.09	1.17	0.93	0.92	1.15	1.13	1.09
Î_-Glu-Gly	ME1131045	1.04	1.10	0.90	1.06	1.12	1.17	1.11
"{4-[(2S)-5-(carbamoylamino)-2-[(2S)-2-[6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanamido]-3-methylbutanamido]pentanamido]phenyl}methyl N-[(1S)-1-{[(1S)-1-{[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-2-{[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]carbamoyl}-1-methoxy-2-met"	ME1130322	1.17	1.18	1.07	1.00	1.11	1.03	0.95
Trifluoroacetic acid 2	ME1131558	1.12	1.19	1.09	1.02	1.08	1.05	0.94
"s-Triazolo[4,3-a]pyridin-3-ol"	ME1131467	1.06	1.11	1.14	0.98	1.07	1.17	0.96
13C5-15N-Glutamic acid	ME1130375	1.09	1.11	1.15	0.99	1.07	1.15	0.94
4-Fluorophenylacetone	ME1130547	1.08	1.11	1.16	0.98	1.07	1.15	0.94
13C5-15N-Glutamic acid 2	ME1130376	1.12	1.12	1.03	1.06	1.11	1.13	0.93
eln484228	ME1130918	1.11	1.15	1.02	1.05	1.11	1.15	0.91
Hex-2-ulose	ME1131014	1.09	1.17	1.07	1.01	1.08	1.12	0.95
"(2R)-1-[(1Z)-1-Hexadecen-1-yloxy]-3-[(hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl)oxy]-2-propanyl (9Z)-9-pentadecenoate"	ME1130219	1.08	1.17	1.02	1.02	1.09	1.16	0.96
Hydrogen bromide	ME1131036	1.07	1.14	1.05	0.99	1.09	1.18	0.97
DL-Cerulenin 2	ME1130882	0.97	1.13	1.18	1.14	1.06	1.03	0.99
DL-Lactic Acid 3	ME1130890	0.99	1.11	1.07	1.10	1.07	1.11	0.99
(S)-(+)-allantoin	ME1130316	1.05	1.15	1.06	1.06	1.07	1.12	1.00
MFCD00041932	ME1131203	0.94	1.09	1.13	1.07	1.09	1.07	1.02
Dihydrouridine	ME1130867	0.99	1.09	1.12	1.05	1.17	1.11	0.98
Ganglioside GD2 (d18:1/12:0)	ME1130956	1.01	1.05	1.10	1.05	1.11	1.13	1.05
"6-Methyl-9,10-didehydroergoline-8-carboxylic acid"	ME1130605	1.03	1.24	1.09	0.93	1.20	1.04	0.95
Nemadectin	ME1131336	0.98	1.31	0.97	1.01	1.10	1.05	1.05
"2-amino-2,3,7-trideoxy-D-lyxo-hept-6-ulosonic acid"	ME1130399	1.17	0.91	1.03	0.84	1.41	1.15	0.98
Tetrahydrouridine	ME1131527	1.11	0.98	1.14	0.87	1.29	1.23	0.87
Phenobarbital 2	ME1131393	1.04	0.77	1.17	1.07	1.27	1.16	1.01
D-Carnitine	ME1130843	0.97	1.01	1.03	1.11	1.21	1.16	1.02
Eldecalcitol	ME1130917	0.99	0.95	1.04	1.02	1.24	1.22	1.03
Allysine 2	ME1130685	1.00	1.01	1.13	0.99	1.30	1.08	0.99
NSC 92778	ME1131346	1.05	1.03	1.23	1.02	1.20	0.99	0.97
Varanic acid	ME1131577	1.00	0.99	1.18	0.95	1.16	1.20	1.00
"(8E,10Z)-8,10-Tetradecadienal"	ME1130300	1.11	0.94	1.15	0.95	1.15	1.10	1.09
xestoaminol B	ME1131586	1.11	0.94	1.15	0.95	1.15	1.10	1.09
DL-Arginine 4	ME1130879	1.05	0.91	1.38	1.09	0.97	0.95	1.14
"(2S)-1-{[11-(3,4-Dimethyl-5-propyl-2-furyl)undecanoyl]oxy}-3-hydroxy-2-propanyl 13-(3-methyl-5-pentyl-2-furyl)tridecanoate"	ME1130236	0.94	1.12	1.37	1.05	0.95	0.88	1.19
(+)-Goniothalesdiol	ME1130175	0.86	1.04	1.45	0.97	1.05	0.93	1.12
"(2S,3R,4E,6E)-2-Amino-4,6-tetradecadiene-1,3-diol"	ME1130230	0.89	1.06	1.31	0.95	1.11	1.02	1.12
"4,5-(methanoxyethano)isolongifol-4-ene"	ME1130577	0.87	1.02	1.29	0.94	1.12	1.07	1.16
O-{Hydroxy[(2R)-2-(pentadecanoyloxy)-3-(tetradecanoyloxy)propoxy]phosphoryl}-L-serine	ME1131357	0.86	1.04	1.22	1.04	1.05	1.12	1.17
(-)-Andrographolide	ME1130166	0.89	1.09	1.19	1.03	1.10	1.06	1.09
DL-Lactic Acid	ME1130888	0.96	1.04	1.20	1.04	1.14	0.98	1.11
D-(-)-Glutamine 2	ME1130827	1.03	1.09	1.19	0.84	0.97	1.20	1.18
4-Oxoproline 2	ME1130569	0.93	1.12	1.27	0.91	1.00	1.09	1.13
Sphingosine (d18:1) Alkyne	ME1131493	1.00	1.05	1.27	0.96	0.96	1.07	1.13
Taurine 4	ME1131512	1.03	1.14	1.28	0.77	1.10	1.18	1.00
Taurine 5	ME1131513	1.08	1.14	1.19	0.82	1.12	1.13	1.02
Citric acid	ME1130789	1.13	1.02	1.23	1.00	1.04	1.03	1.03
Sulfuric acid 2	ME1131506	1.16	1.10	1.21	0.95	0.98	1.06	1.03
"(17Z,21R)-27-Amino-24-hydroxy-24-oxido-19,23,25-trioxa-24lambda~5~-phosphaheptacos-17-en-21-yl (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoate"	ME1130188	1.16	1.13	1.19	0.94	0.98	0.99	1.11
MFCD00135289	ME1131207	1.16	1.13	1.19	0.94	0.98	0.99	1.11
amino-beta-benzoylpropionic acid	ME1130691	1.03	1.13	1.36	0.90	1.13	0.99	0.97
penicisteroid F	ME1131383	1.12	1.17	1.26	0.93	1.06	1.03	0.92
Sulfuric acid 3	ME1131507	1.08	1.17	1.26	0.94	0.98	1.06	0.97
4-(Dimethoxymethyl)pyrimidine	ME1130535	1.14	0.98	1.28	1.43	0.97	0.77	0.93
Crotonic acid 3	ME1130810	1.17	1.20	1.09	1.21	0.88	0.72	1.19
Linoleamide 2	ME1131151	1.28	0.99	1.11	1.25	0.76	0.91	1.18
(S)-2-amino-6-oxopimelic acid	ME1130317	0.98	1.45	0.96	1.27	0.97	0.68	1.18
Proline	ME1131419	0.89	1.26	0.79	1.39	1.34	0.57	1.25
Tulipalin A	ME1131561	0.90	1.24	0.78	1.40	1.34	0.56	1.26
DL-Lysine 3	ME1130893	0.81	1.08	0.89	1.24	1.33	0.87	1.27
Hex-2-ulose 4	ME1131017	0.99	0.92	0.92	1.25	1.33	0.91	1.12
L(-)-Carnitine	ME1131129	1.02	1.06	1.09	1.21	1.21	0.78	1.13
Bayer E 39 Soluble	ME1130723	0.64	1.17	0.52	1.11	1.39	1.26	1.40
elasnin 2	ME1130916	0.70	0.99	0.73	1.05	1.14	1.37	1.36
D-Alanine methyl ester	ME1130842	1.11	0.57	0.84	1.17	1.17	1.12	1.51
N-pentadecanoylsphingosine-1-phosphocholine	ME1131305	1.04	0.67	0.76	1.22	1.29	1.28	1.23
N-pentadecanoylsphingosine-1-phosphocholine 2	ME1131306	1.09	0.67	0.71	1.25	1.19	1.34	1.25
3-(1-Methyl-1H-pyrrol-2-yl)pyridine	ME1130462	0.81	0.51	0.88	1.43	1.36	1.45	1.06
N-(hexadecanoyl)-beta-D-galactosylsphingosine	ME1131244	0.83	0.48	0.71	1.22	1.40	1.51	1.35
PF-6274484	ME1131391	0.94	1.10	1.10	0.71	0.83	1.19	1.62
Articaine	ME1130706	1.07	0.93	0.59	1.61	0.68	1.25	1.36
3-Butynoic acid 5	ME1130489	1.20	0.91	0.68	1.26	1.00	0.74	1.72
Pyrogallol	ME1131439	1.23	0.79	0.71	1.27	1.11	0.87	1.51
Pyrone 4	ME1131443	1.21	0.78	0.73	1.25	1.07	0.87	1.59
ascopyrone P	ME1130711	1.23	0.91	0.68	1.24	1.10	0.87	1.47
Meglutol 2	ME1131178	1.22	0.90	0.73	1.18	1.11	0.94	1.43
Uric acid 3	ME1131570	0.66	0.92	1.05	1.10	1.01	1.09	1.67
Hex-2-ulose 2	ME1131015	0.94	1.05	0.91	1.17	0.97	0.94	1.53
Tocopherol	ME1131544	0.99	0.94	0.94	1.26	0.79	1.01	1.57
ENU	ME1130921	0.86	0.86	1.69	0.82	1.33	0.98	0.96
Istamycin AO	ME1131062	0.71	0.75	1.68	0.94	1.51	0.93	0.99
NP-022233	ME1131343	0.66	0.70	1.72	0.99	1.32	1.11	1.00
met-glu	ME1131190	0.85	0.74	1.22	0.89	1.46	1.07	1.22
"5^-O-[({[(2S)-2,3-Bis{[(2E,6E,10E)-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraen-1-yl]oxy}propoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]cytidine"	ME1130599	0.37	0.77	1.39	1.06	1.74	1.01	1.15
O-[{(2R)-2-(Dodecanoyloxy)-3-[(9Z)-9-hexadecenoyloxy]propoxy}(hydroxy)phosphoryl]-L-serine	ME1131356	0.50	0.62	1.64	1.02	1.59	1.01	1.11
"(1R,9S)-11-(1-Methyl-4-piperidinyl)-5-[4-(trifluoromethoxy)phenyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one"	ME1130194	0.74	0.56	1.45	1.08	1.50	0.98	1.19
Nefazodone	ME1131335	0.76	0.57	1.42	1.08	1.55	0.93	1.19
N-Undecanoylglycine 2	ME1131312	0.88	1.16	1.48	1.09	1.56	0.62	0.52
"2-Heptyl-4,5-dimethyl-1,3-oxazole"	ME1130412	0.88	1.27	1.46	1.27	1.16	0.78	0.64
"(3E,5E)-tridecadienoic acid"	ME1130264	0.85	1.22	1.69	1.22	1.11	0.75	0.62
Gabapentin	ME1130952	0.76	1.37	1.47	1.07	1.19	0.92	0.71
ibufenac	ME1131046	0.84	1.31	1.48	1.10	1.12	0.74	0.85
nylon cyclic dimer	ME1131347	0.97	1.20	1.71	1.35	1.29	0.62	0.35
11-Nitro-1-undecene	ME1130371	0.82	1.29	1.66	1.16	1.33	0.79	0.42
N-Nonanoylglycine 2	ME1131303	0.78	1.33	1.85	1.00	1.27	0.86	0.38
N-Undecanoylglycine	ME1131311	0.78	1.26	1.81	1.04	1.26	0.79	0.50
cropropamide	ME1130805	1.01	0.78	1.75	1.17	1.33	0.67	0.77
Levetiracetam	ME1131145	1.18	0.93	1.36	1.11	1.17	0.90	0.85
4-amino-2-hydroxyamino-6-nitrotoluene	ME1130542	1.01	1.03	1.53	1.07	1.09	0.93	0.85
Sphingosine (d12:1)	ME1131492	0.93	1.05	1.45	0.99	1.26	0.92	0.89
hydroxyacetone phosphate	ME1131037	0.91	1.73	0.41	0.77	1.65	1.06	0.96
2-(3-Phenylpropyl)pyridine	ME1130386	0.97	1.73	0.83	1.17	1.27	0.32	1.16
Pyruvic acid	ME1131444	1.08	1.84	1.06	0.72	0.73	1.37	0.65
hercynine	ME1131012	1.29	1.99	1.00	0.51	1.21	0.74	0.75
CHLORIC ACID	ME1130776	1.13	1.77	0.47	1.03	1.05	1.07	0.95
240I539PWQ	ME1130456	1.06	1.97	0.87	0.99	0.79	0.87	0.94
240I539PWQ 2	ME1130457	1.09	1.90	0.85	1.07	0.80	0.84	0.95
L-alpha-Glycerylphosphorylcholine	ME1131091	1.21	1.75	0.75	1.01	0.90	0.90	0.97
Choline 2	ME1130781	1.34	1.65	0.76	1.09	0.86	0.74	1.04
Malondialdehyde	ME1131171	1.41	1.73	0.73	1.00	0.84	0.70	1.06
N-(2-Amino-3-carboxypropanoyl)glutamine	ME1131235	1.31	2.07	0.88	1.17	0.38	0.62	1.03
(3S)-3-{[(3S)-3-Aminobutanoyl]amino}-5-methylhexanoic acid	ME1130271	1.10	2.21	1.16	1.00	0.61	0.46	0.97
4-Vinylpyridine	ME1130576	1.16	2.16	0.99	0.83	0.74	0.65	0.95
Bellidifolin	ME1130726	1.09	1.82	1.31	0.76	0.86	0.76	0.90
N(alpha)-gamma-L-glutamylhistamine	ME1131319	1.28	1.88	1.11	0.80	0.65	0.79	0.96

Factors:

F1	Sample source:Serum \| Sex:Female \| Treatment:Control
F2	Sample source:Serum \| Sex:Female \| Treatment:High_MPs
F3	Sample source:Serum \| Sex:Female \| Treatment:Low_MPs
F4	Sample source:Serum \| Sex:Male \| Treatment:Control
F5	Sample source:Serum \| Sex:Male \| Treatment:High_MPs
F6	Sample source:Serum \| Sex:Male \| Treatment:Low_MPs
F7	Sample source:Serum \| Sex:NA \| Treatment:QC

Data matrix