Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST000291)

(Analysis AN000464)

Metabolite	Structure	F1	F2	F3
Cupreine	ME104886	4.37	0.04	0.03
Cyclokievitone_2	ME104899	3.91	0.03	0.03
Parsonsine	ME105555	3.61	0.02	0.02
Triglochinin	ME105831	0.14	0.01	3.66
4-[(Hydroxymethyl)nitrosoamino]-1-(3-pyridinyl)-1-butanone	ME104431	0.35	0.05	2.65
7-Deoxyloganetin	ME104592	0.27	0.08	2.65
Tioconazole	ME105807	0.22	0.05	2.65
N-Trimethyl-2-aminoethylphosphonate_2	ME105519	0.32	0.14	2.54
N-Formyl-L-aspartate	ME105463	0.22	0.13	2.54
Pimelate_2	ME105616	0.23	0.16	2.62
Amoxicillin	ME104668	0.01	0.00	2.71
4-Oxocyclohexanecarboxylate_2	ME104493	0.16	0.16	2.68
Versicolorin B_2	ME105871	0.13	0.14	2.65
Zingerone_3	ME105895	0.14	0.13	2.72
Pimelate_5	ME105619	0.17	0.09	2.73
Furfural diethyl acetal_2	ME105093	0.19	0.10	2.71
Pimelate_4	ME105618	0.17	0.12	2.71
4,5-Methylenedioxy-6-hydroxyaurone_2	ME104430	0.04	0.17	2.72
4-Oxocyclohexanecarboxylate_5	ME104496	0.12	0.08	2.80
(R)-2-Hydroxybutane-1,2,4-tricarboxylate_2	ME104163	0.05	0.11	2.78
Sulfoquinovose_2	ME105767	0.10	0.10	2.73
Dihydroxyfumarate	ME104995	0.07	0.03	2.84
Sulfoquinovose_1	ME105766	0.07	0.05	2.87
5a,11a-Dehydrochlortetracycline	ME104518	NA	0.01	2.99
Chrysoeriol_2	ME104818	0.00	0.00	2.99
3-(2-Hydroxyphenyl)propanoate_4	ME104341	0.03	0.02	2.94
cis-2-Carboxycyclohexyl-acetic acid_3	ME104837	0.01	0.03	2.96
Bowdichione	ME104763	0.10	0.15	3.21
Photinus luciferin	ME105607	0.04	0.02	3.18
4^-Demethyldeoxypodophyllotoxin	ME104452	0.07	0.00	3.12
Acutumidine	ME104628	0.07	0.00	3.11
Dichlorophen	ME104966	0.08	0.38	1.51
Streptobiosamine_2	ME105747	0.04	0.10	1.51
2-trans,6-trans-Farnesal_2	ME104336	0.18	0.23	1.59
Faropenem sodium_2	ME105068	0.12	0.16	1.69
Nitramine	ME105486	0.01	0.01	2.19
Cyclophosphamide	ME104904	0.17	0.14	1.99
Uracil mustard	ME105853	0.10	0.14	1.88
2-[3-Ethyl-5-(4-methoxyphenyl)-1H-pyrazol-4-yl]phenol	ME104267	0.79	0.13	1.93
Indole-3-acetaldehyde_3	ME105193	0.74	0.17	2.08
L-Mimosine_2	ME105291	0.84	0.13	2.11
cis-2-Carboxycyclohexyl-acetic acid_2	ME104836	0.63	0.15	2.22
Penicillenic acid_1	ME105566	0.46	0.09	2.37
N(alpha)-Benzyloxycarbonyl-L-leucine_1	ME105380	0.50	0.42	2.08
L-Tyrosine methyl ester_2	ME105306	0.49	0.48	2.03
Benzene_1	ME104720	0.43	0.52	2.05
Phenol	ME105583	0.43	0.52	2.05
Hippurate	ME105162	0.45	0.48	2.07
Indole	ME105190	0.46	0.49	2.05
Bergaptol_1	ME104735	0.33	0.62	2.05
Velloquercetin	ME105866	0.31	0.52	2.14
Imazosulfuron	ME105182	0.37	0.50	2.13
Indole-3-acetaldehyde_2	ME105192	0.38	0.47	2.15
5-Methyldeoxycytidine diphosphate	ME104557	0.30	0.54	2.25
METHYL BETA-D-GALACTOSIDE	ME105337	0.31	0.47	2.21
Pentanoate_2	ME105571	0.60	0.34	2.06
Phosphoagmatine	ME105602	0.60	0.37	2.02
N,N-Dihydroxy-L-tyrosine	ME105385	0.34	0.35	2.22
Tolylacetate_2	ME105815	0.41	0.37	2.22
Phenylpyruvate_2	ME105599	0.51	0.36	2.14
Shikimate_1	ME105728	0.50	0.34	2.16
Succinate_2	ME105755	0.48	0.30	2.22
Propanoate_2	ME105647	0.49	0.25	2.26
Rilmenidine	ME105696	0.51	0.26	2.23
3-Methyl-cis,cis-hexadienedioate_2	ME104405	0.20	0.54	2.26
5-(2-Hydroxyethyl)-4-methylthiazole	ME104510	0.13	0.53	2.34
2,4-Diamino-6-nitrotoluene	ME104253	0.23	0.42	2.35
Otonecine_1	ME105541	0.27	0.39	2.34
Aromatic aldehyde_1	ME104693	0.30	0.38	2.32
(3-Arylcarbonyl)-alanine	ME104141	0.29	0.37	2.34
Benzyl alcohol_1	ME104733	0.29	0.38	2.33
D-Galactose 6-sulfate	ME104950	0.27	0.28	2.34
Pseudopelletierine	ME105658	0.28	0.29	2.38
1,2-Diamino-4-nitrobenzene_3	ME104189	0.23	0.37	2.40
Acetyltropine	ME104624	0.24	0.30	2.41
L-Adrenaline_1	ME105239	0.22	0.33	2.45
L-Tyrosine_2	ME105304	0.24	0.33	2.43
Prothiocarb	ME105655	0.25	0.32	2.44
Anthopleurine	ME104679	0.27	0.27	2.46
Orcinol_3	ME105535	0.28	0.27	2.45
4-Oxocyclohexanecarboxylate_6	ME104497	0.23	0.28	2.49
Toluene-cis-dihydrodiol_2	ME105812	0.22	0.26	2.52
Jasmone_2	ME105231	0.12	0.06	2.37
(+)-Medicarpin	ME104133	0.28	0.16	2.31
Penicillenic acid_2	ME105567	0.23	0.10	2.26
2-Heptanone_2	ME104294	0.11	0.23	2.21
CBS 113A	ME104803	0.24	0.22	2.27
Nifurthiazole	ME105479	0.18	0.23	2.25
Sterigmatocystin	ME105745	0.20	0.26	2.24
Diphenhydramine_2	ME105006	2.60	0.00	0.17
Diethanolamine_2	ME104971	2.66	0.02	0.33
N-(Acetyloxy)benzenamine_2	ME105377	2.68	0.01	0.31
Diphenhydramine_1	ME105005	2.80	0.01	0.19
S-(Hydroxyphenylacetothiohydroximoyl)-L-cysteine_1	ME105704	2.74	0.02	0.24
p-Hydroxyphenylacetothiohydroximate_2	ME105611	2.79	0.25	0.08
Scopoletin_2	ME105717	2.66	0.21	0.14
Tocainide	ME105808	2.63	0.14	0.23
Crotanecine_3	ME104876	2.73	0.14	0.13
Anastrozole	ME104671	2.70	0.10	0.08
Estazolam	ME105043	2.72	0.04	0.10
5-Carboxy-2-oxohept-3-enedioate	ME104535	2.74	0.15	0.22
Phosphocreatine_2	ME105605	2.81	0.17	0.17
Robustaol A	ME105699	3.16	0.05	0.03
WIN VI	ME105876	3.27	0.06	0.05
(-)-Vestitone_2	ME104127	3.04	0.01	0.02
Castanospermine_2	ME104799	2.97	0.01	0.02
Glyburide	ME105128	2.99	0.00	0.01
Nicarbazin	ME105470	2.92	0.02	0.05
beta-Chloro-alpha-phenylbenzeneethanamine hydrochloride	ME104741	2.90	0.05	0.12
Fluorene	ME105078	2.85	0.06	0.10
Meteloidine	ME105332	2.86	0.06	0.08
cis-1,2-Dihydro-3-ethylcatechol_4	ME104828	2.51	0.41	0.08
4-(beta-Acetylaminoethyl)imidazole_3	ME104426	2.59	0.32	0.09
Ethyl 3-oxohexanoate_3	ME105055	2.60	0.33	0.08
4-Dimethylallyl-L-abrine	ME104453	2.32	0.33	0.07
Zoxamide	ME105899	2.33	0.40	0.17
1,4-Naphthoquinone	ME104199	2.45	0.36	0.19
Thalidomide	ME105791	2.41	0.35	0.21
Fusarin C	ME105099	2.49	0.00	0.12
C20915	ME104784	2.52	0.02	0.04
Propiomazine	ME105648	2.43	0.08	0.03
8-(3,3-Dimethylallyl)spatheliachromene	ME104601	2.46	0.02	0.03
Xanthosine 5^-phosphate	ME105884	2.44	0.02	0.05
Miraxanthin-II	ME105358	2.22	0.14	0.07
Irisxanthone	ME105208	2.38	0.06	0.16
N-Guanylhistamine	ME105466	2.33	0.09	0.05
N-(L-Arginino)succinate	ME105382	2.34	0.12	0.09
Epithienamycin B	ME105038	2.46	0.01	0.45
Glycyl-leucine_2	ME105137	2.47	0.01	0.52
Xanthan_2	ME105880	2.49	0.02	0.49
Benzoin_1	ME104729	2.25	0.13	0.35
2-Aminophenol_3	ME104285	2.43	0.20	0.37
6-Hydroxypseudooxynicotine_2	ME104584	2.44	0.22	0.34
Lumichrome	ME105308	2.42	0.16	0.42
Prosulfuron	ME105654	2.39	0.20	0.41
N^-Nitrosoanabasine	ME105499	2.38	0.12	0.31
Gibberellin A8	ME105120	2.47	0.18	0.24
D-Mannitol 1-phosphate	ME105012	2.45	0.14	0.24
(+)-Elaeocarpine	ME104132	2.43	0.17	0.24
Kievitone	ME105233	2.03	0.01	0.28
Lindheimerine	ME105274	1.84	0.04	0.28
Betagarin	ME104744	1.56	0.03	0.21
Epithienamycin F	ME105039	1.73	0.09	0.08
Menadione sodium bisulfite	ME105324	1.98	0.72	0.30
Heptadecatrienoic acid	ME105153	1.93	0.45	0.47
Formononetin	ME105083	2.02	0.50	0.48
Fulvine	ME105089	1.97	0.52	0.51
Sulbactam sodium	ME105762	1.94	0.57	0.49
Agaritine	ME104634	1.94	0.51	0.36
N-Acetyl-L-leucine_2	ME105422	2.06	0.51	0.43
Istamycin FU-10	ME105229	2.05	0.54	0.41
N-Nitrosodi-n-butylamine_2	ME105503	2.04	0.56	0.40
8-Amino-7-oxononanoate_5	ME104606	1.99	0.64	0.37
gamma-Glutamyl-beta-aminopropiononitrile_3	ME105104	2.00	0.59	0.41
N-D-Glucosylarylamine_3	ME105448	1.86	0.31	0.62
Acetylcysteine_3	ME104623	2.04	0.38	0.58
Nicotine	ME105473	1.97	0.40	0.59
Retronecine_2	ME105690	2.00	0.45	0.55
(3E)-4-(2-Carboxyphenyl)-2-oxobut-3-enoate	ME104142	1.88	0.43	0.67
9-Oxononanoic acid_2	ME104612	1.89	0.44	0.67
Etomidate	ME105062	1.93	0.50	0.57
Triethanolamine	ME105830	1.91	0.48	0.58
1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one	ME104192	1.88	0.51	0.60
Cysteinyldopa	ME104906	1.85	0.52	0.63
Gentiopicrin	ME105117	1.88	0.49	0.64
L-Mimosine_1	ME105290	1.87	0.50	0.63
Sergeolide	ME105726	1.88	0.80	0.61
Tributyrin	ME105829	1.81	0.63	0.43
Sulbactam	ME105761	1.82	0.57	0.60
L-Aspartate 4-semialdehyde	ME105247	1.86	0.61	0.52
2,3-Dihydroxy-p-cumate_3	ME104245	1.82	0.64	0.54
(S)-2-Chloropropanoate	ME104168	1.81	0.62	0.54
Acetylcysteine_2	ME104622	2.10	0.41	0.49
Arbutin	ME104689	2.13	0.43	0.45
N-(3-Oxooctanoyl)homoserine lactone	ME105373	2.15	0.39	0.46
Acetylcysteine_1	ME104621	2.20	0.46	0.35
Ethyl cinnamate	ME105056	2.15	0.46	0.39
Clavamycin D	ME104850	2.21	0.33	0.45
Leukotriene A4	ME105256	2.26	0.35	0.40
Phenylacetaldehyde_4	ME105592	2.28	0.37	0.36
Ethyl (R)-3-hydroxyhexanoate	ME105049	2.30	0.45	0.34
3-Methoxybenzyl alcohol_4	ME104397	2.36	0.38	0.26
Ethyl 3-oxohexanoate_2	ME105054	2.33	0.36	0.31
4-(3-Methylbut-2-enyl)-L-tryptophan	ME104423	2.16	0.60	0.23
Gigantine	ME105121	2.22	0.50	0.18
2-Aminomuconate semialdehyde	ME104282	2.18	0.71	0.11
(S)-6-Hydroxynicotine_2	ME104170	2.10	0.83	0.08
4-Amino-4-deoxychorismate_3	ME104442	2.25	0.18	0.51
N2-Citryl-N6-acetyl-N6-hydroxy-L-lysine	ME105398	2.33	0.14	0.53
Melicopine	ME105319	2.20	0.10	0.70
Efavirenz	ME105035	2.18	0.15	0.60
sn-Glycero-3-phosphocholine	ME105733	2.21	0.10	0.60
4-O-beta-D-Glucosyl-4-hydroxycinnamate	ME104491	2.09	0.02	0.70
Benzoin_2	ME104730	2.08	0.01	0.67
5-Hydroxyindoleacetate_2	ME104543	2.06	0.17	0.77
5-L-Glutamyl-taurine	ME104552	2.08	0.26	0.61
Kurarinol	ME105235	1.97	0.17	0.61
Thiamphenicol	ME105794	2.03	0.16	0.62
6-Methoxymellein_2	ME104586	1.79	0.04	1.06
Butonate	ME104781	1.65	0.02	1.05
2-Amino-9,10-epoxy-8-oxodecanoic acid	ME104278	2.06	0.04	0.96
Fagaramide	ME105065	2.01	0.10	0.98
4-(Hydroxylamino)-N,N-dimethylaniline	ME104427	1.76	0.27	0.97
N-Acetylornithine_2	ME105430	1.86	0.21	0.94
Curcumin monoglucoside	ME104887	2.03	0.35	0.88
4^-Hydroxy-3^-prenylacetophenone	ME104469	1.95	0.32	0.73
Apigenin	ME104681	1.95	0.18	0.81
1,2-Dihydroxydibenzothiophene	ME104193	1.89	0.28	0.83
2,4,6-Trihydroxybenzophenone	ME104249	1.90	0.27	0.84
Dehydrovomifoliol_2	ME104937	1.53	0.28	1.19
Genipin_2	ME105116	1.45	0.31	1.25
Semicarbazide hydrochloride	ME105724	1.49	0.26	1.26
Baicalin	ME104708	1.53	0.19	1.33
Domoic acid	ME105020	1.43	0.20	1.39
3,4-Dihydroxymandelate	ME104353	1.28	0.31	1.36
1,5-Naphthalene diisocyanate	ME104200	1.25	0.36	1.39
3-Methyl-cis,cis-hexadienedioate_1	ME104404	1.29	0.34	1.37
Tropine_3	ME105840	1.27	0.35	1.38
D-Glucono-1,5-lactone	ME104952	1.34	0.39	1.34
Methyl 2-diazoacetamidohexonate	ME105336	1.27	0.41	1.32
1-Hydroxy-2-methyl-2-butenyl 4-diphosphate	ME104217	1.21	0.34	1.49
Bergaptol_3	ME104737	1.11	0.35	1.54
Versicolorin B_1	ME105870	1.16	0.30	1.54
Fuberidazole	ME105088	1.12	0.18	1.59
Aldicarb_2	ME104639	1.22	0.18	1.60
p-Hydroxyphenylacetothiohydroximate_1	ME105610	1.24	0.17	1.55
Clitidine_2	ME104854	1.21	0.64	1.15
Coumarin_2	ME104868	1.23	0.64	1.14
4-Heptyloxybenzoic acid_1	ME104457	1.25	0.67	1.08
Dehydrojuvabione_2	ME104934	1.28	0.61	1.11
(R)-(Homo)2-citrate	ME104158	1.27	0.64	1.10
5-Oxo-1,2-campholide	ME104566	1.31	0.65	1.04
(6S,9R)-Vomifoliol_2	ME104148	1.30	0.65	1.05
Asparagusate	ME104696	1.33	0.69	0.99
1-Phenyl-5-mercaptotetrazole	ME104224	1.33	0.66	1.01
Indole-3-acetaldoxime N-oxide	ME105194	1.35	0.64	1.01
Fosetyl	ME105086	1.30	0.57	1.12
3-Oxododecanoic acid_3	ME104416	1.30	0.61	1.08
Glaucarubinone	ME105124	1.32	0.60	1.08
Hypaphorine	ME105177	1.36	0.58	1.06
Dopaquinone_2	ME105024	1.35	0.58	1.08
Glycocholate	ME105135	1.34	0.58	1.08
alpha-Irone_1	ME104652	1.38	0.59	1.03
Dihydroeuparin	ME104990	1.42	0.52	1.06
N1-Acetylspermidine_2	ME105389	1.40	0.55	1.05
4-Methyl-2-oxopentanoate_2	ME104482	1.21	0.52	1.27
Triphenylsilanol	ME105835	1.18	0.53	1.28
E-64	ME105032	1.13	0.57	1.30
Vitexin	ME105873	1.13	0.55	1.33
Pregnenolone	ME105637	1.13	0.64	1.23
Chlorhexidine	ME104810	1.12	0.63	1.26
Scytalone_1	ME105719	1.13	0.61	1.26
2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate	ME104312	1.12	0.57	1.23
1-Naphthaleneacetic acid sodium salt	ME104219	1.15	0.58	1.27
3-[(3aS,4S,7aS)-7a-Methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoate_2	ME104362	1.16	0.58	1.26
Deoxyuridine	ME104945	1.23	0.56	1.21
N-Formylmethionine_2	ME105465	1.21	0.56	1.20
Scorpioidin	ME105718	1.21	0.58	1.20
Cibarian	ME104819	1.23	0.59	1.18
Riboflavin	ME105694	1.25	0.57	1.18
Sepiapterin	ME105725	1.25	0.55	1.19
2-Nitrofluorene	ME104317	1.33	0.47	1.20
Succinylproline_2	ME105760	1.29	0.43	1.20
S-(Hydroxyphenylacetothiohydroximoyl)-L-cysteine_2	ME105705	1.30	0.52	1.18
3-[(3aS,4S,7aS)-7a-Methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoate_3	ME104363	1.27	0.53	1.20
3-(4-Hydroxyphenyl)pyruvate_2	ME104345	1.28	0.51	1.21
1,1-Dichloroethylene epoxide	ME104182	1.24	0.50	1.26
2,5-Furandicarboxylate_4	ME104264	1.26	0.48	1.25
Neostigmine bromide	ME105453	1.28	0.47	1.24
Acetyl adenylate	ME104619	1.45	0.26	0.69
Dibenzo[1,4]dioxin-2,3-dione_2	ME104959	1.69	0.25	0.82
gamma-Glutamyl-beta-aminopropiononitrile_1	ME105102	1.68	0.38	0.89
(3S,5S)-Carbapenam-3-carboxylic acid_2	ME104144	1.71	0.38	0.91
Styrene	ME105751	1.69	0.39	0.91
Phenylethyl alcohol_3	ME105597	1.64	0.45	0.91
N-Vinyl-2-pyrrolidone_1	ME105521	1.67	0.43	0.90
Tetralin_2	ME105787	1.66	0.41	0.93
alpha-Fluoro-beta-ureidopropionic acid	ME104648	1.43	0.41	1.16
Alantolactone_2	ME104637	1.40	0.44	1.16
L-Tyrosine methyl ester 4-sulfate	ME105307	1.40	0.47	1.13
beta-Cotonefuran	ME104743	1.53	0.43	1.05
Benzoate_2	ME104726	1.53	0.49	0.98
2-Pyridyl hydroxymethane sulfonic acid_1	ME104332	1.49	0.48	1.03
Citalopram propionic acid	ME104845	1.49	0.51	1.00
Flucloxacillin	ME105077	1.58	0.34	0.99
cis-Aconitate_3	ME104844	1.44	0.34	1.09
Deidaclin	ME104938	1.55	0.32	1.10
Lamioside	ME105242	0.89	1.02	1.09
Pimelate_1	ME105615	0.91	0.99	1.10
2-(3^-Methylthio)propylmalic acid_2	ME104231	0.89	0.99	1.12
4-Amino-1-piperidinecarboxylic acid	ME104438	0.88	1.01	1.11
5-Valerolactone_1	ME104570	0.86	1.00	1.14
gamma-Undecalactone	ME105110	0.85	1.00	1.15
5-Hydroxypentanoate_1	ME104550	0.86	1.02	1.12
Sulcatone_3	ME105765	0.85	1.04	1.11
2,7-Anhydro-alpha-N-acetylneuraminic acid_2	ME104266	0.94	0.88	1.17
N-(2-Methoxyphenyl)-N^-(2-naphtyl)urea	ME105370	0.95	0.87	1.17
Cyclohexane-1,3-dione_1	ME104893	0.94	0.90	1.16
Tabtoxinine-beta-lactam	ME105770	0.94	0.90	1.15
Dihydroclavaminic acid	ME104989	0.95	0.91	1.14
2-Aminomuconate	ME104281	0.94	0.91	1.14
D-Arabinono-1,4-lactone_1	ME104921	0.94	0.92	1.14
Sebacic acid_2	ME105723	0.88	0.94	1.17
Aspidinol_2	ME104699	0.90	0.94	1.16
N-Formimino-L-glutamate	ME105461	0.90	0.93	1.18
3-Butyn-1-ol	ME104370	0.92	0.94	1.14
Flavonol	ME105076	0.92	0.94	1.14
Apiole_3	ME104685	0.90	0.96	1.13
Benzyl alcohol_2	ME104734	0.89	0.96	1.14
p-Cumate_1	ME105558	0.91	0.97	1.13
Stylopine	ME105750	0.92	0.96	1.12
4-Hydroxybenzoate	ME104470	0.86	0.93	1.21
N-Nitrosodiethylamine	ME105501	0.86	0.94	1.20
Ethyl tiglate_2	ME105059	0.85	0.95	1.20
L-CARNITINE	ME105250	0.85	0.94	1.20
2-Furoate	ME104292	0.91	0.90	1.19
DIMBOA	ME105002	0.91	0.88	1.21
Glycerol_1	ME105129	0.89	0.89	1.22
L-Metanephrine_1	ME105286	0.74	1.17	1.09
2-(6^-Methylthio)hexylmalic acid	ME104234	0.82	1.05	1.13
4-Amino-4-deoxychorismate_2	ME104441	0.82	1.06	1.12
Dodecylaldehyde	ME105017	0.84	1.11	1.12
Tauropine_2	ME105774	0.81	1.09	1.11
3-(3,4-Dichlorophenyl)-1-hydroxy-1-methylurea	ME104342	0.84	1.09	1.07
ADENINE	ME104631	0.86	1.09	1.06
Levamisole hydrochloride	ME105257	0.79	1.14	1.07
(1S,3R)-3-(2,2-Dichloroethenyl)-2,2-dimethylcyclopropanecarboxylate	ME104140	0.82	1.12	1.05
Iminoglycine_1	ME105185	0.81	1.15	1.04
Verrucarin A	ME105869	0.66	1.07	1.27
Quercitrin	ME105681	0.69	1.13	1.20
D-(-)-ARABINOSE	ME104910	0.73	1.06	1.21
THYMINE_2	ME105803	0.74	1.10	1.16
Savinin	ME105715	0.87	1.00	1.27
N-Cyclopropylammeline	ME105443	0.74	0.99	1.27
Xylitol	ME105887	0.77	1.01	1.22
Glycine_1	ME105133	1.10	0.67	1.22
Benzoyl isothiocyanate	ME104731	1.11	0.68	1.21
Pimelate_3	ME105617	1.11	0.68	1.21
Chloridazon	ME104811	1.14	0.69	1.17
Northienamycin_2	ME105513	1.14	0.69	1.17
4-Hexyloxyphenol_1	ME104463	1.14	0.66	1.19
Dehydroalanine_1	ME104930	1.16	0.66	1.18
1,3,8-Naphthalenertriol_1	ME104195	1.15	0.72	1.13
9-Oxononanoic acid_1	ME104611	1.15	0.72	1.13
3-HYDROXYKYNURENINE	ME104390	1.14	0.73	1.13
(+)-Camphor_2	ME104131	1.14	0.73	1.13
12-Hydroxydodecanoic acid_1	ME104210	1.17	0.70	1.12
Geranyl formate	ME105118	1.18	0.72	1.10
Bufotenine	ME104769	1.19	0.71	1.11
Pymetrozine	ME105667	1.19	0.71	1.10
11-O-Demethylpradimicinone I	ME104208	1.08	0.74	1.18
Dehydrovomifoliol_1	ME104936	1.09	0.74	1.17
Methyltrienolone	ME105347	1.08	0.74	1.20
Pyruvate_1	ME105678	1.07	0.73	1.19
Pterin	ME105661	1.10	0.70	1.19
Ethiofencarb	ME105045	1.10	0.71	1.17
Tryptamine	ME105843	1.11	0.72	1.17
p-Cymene_3	ME105564	1.11	0.75	1.14
Dihomomethionine	ME104982	1.10	0.75	1.15
2-Naphthylamine	ME104316	1.11	0.74	1.15
Scopoletin_1	ME105716	1.11	0.74	1.15
Hexahomomethionine	ME105159	1.12	0.77	1.11
Trihomomethionine_2	ME105833	1.13	0.76	1.11
Nevirapine_2	ME105458	1.11	0.77	1.12
4-Oxocyclohexanecarboxylate_3	ME104494	1.10	0.77	1.13
Carbetamide	ME104794	1.10	0.78	1.12
6-Methoxymellein_1	ME104585	1.02	0.81	1.17
3-Fluorocyclohexadiene-cis,cis-1,2-diol-1-carboxylate_2	ME104381	1.01	0.80	1.19
Metaxalone_2	ME105330	1.01	0.81	1.18
Adenosine	ME104632	1.04	0.78	1.18
Adenine	ME104630	1.03	0.78	1.19
Mescaline_1	ME105326	1.03	0.78	1.18
3-Hydroxyanthranilate	ME104385	1.06	0.76	1.18
Europine	ME105063	1.06	0.76	1.18
Isoxanthopterin	ME105227	1.04	0.76	1.20
Progesterone	ME105642	1.05	0.75	1.20
Orcinol_1	ME105533	0.98	0.87	1.15
Calcium levulinate anhydrous	ME104788	0.99	0.88	1.14
N-Cyclohexylformamide_1	ME105441	0.99	0.87	1.14
Tetrahydrocortisone	ME105785	0.97	0.84	1.18
Apigenin 7,4^-dimethyl ether	ME104682	0.99	0.84	1.17
Neopterin_2	ME105452	1.00	0.83	1.17
2,4-Dihydroxypteridine	ME104254	1.00	0.85	1.16
alpha-Ribazole_2	ME104658	1.01	0.84	1.15
Dibutyl adipate_1	ME104963	1.07	0.79	1.14
Strigolactone ABC-rings_2	ME105749	1.07	0.79	1.13
Apiole_2	ME104684	1.05	0.81	1.14
Indole-3-acetate_1	ME105195	1.06	0.80	1.14
N-Acetylmuramic acid 6-phosphate	ME105427	1.06	0.78	1.16
N-Methyltryptamine	ME105497	1.08	0.77	1.15
N1-Methyl-2-pyridone-5-carboxamide	ME105391	1.04	0.83	1.12
L-Tryptophan	ME105301	1.05	0.84	1.11
10-Oxodecanoate_2	ME104205	1.05	0.83	1.12
1,2,3-Trihydroxybenzene_1	ME104183	1.06	0.83	1.12
cis-2,3-Dihydro-2,3-dihydroxybiphenyl_2	ME104833	1.06	0.83	1.12
N^-Nitrosoanatabine	ME105500	1.08	0.83	1.10
Allylestrenol_1	ME104642	1.07	0.83	1.11
Cucurbic acid_1	ME104880	1.07	0.82	1.12
11beta,21-Dihydroxy-5beta-pregnane-3,20-dione	ME104206	1.04	0.83	1.14
Cuauhtemone_3	ME104879	1.04	0.82	1.15
Ferrous lactate_1	ME105074	1.03	0.82	1.15
1,2-Diamino-4-nitrobenzene_2	ME104188	1.02	0.86	1.12
Fortimicin FU-10	ME105085	1.01	0.86	1.13
5-Aminopentanamide	ME104534	1.02	0.85	1.14
Helveticoside	ME105152	1.03	0.84	1.13
4,5-Methylenedioxy-6-hydroxyaurone_1	ME104429	1.04	0.69	1.27
Menadione	ME105323	1.02	0.70	1.28
Cyanopyrazine	ME104888	1.02	0.75	1.22
N-Methylhexanamide_1	ME105493	1.04	0.74	1.22
Levetiracetam_1	ME105258	1.04	0.71	1.25
Dibenzo[1,4]dioxin-2,3-dione_1	ME104958	1.02	0.74	1.25
4-(2-Aminophenyl)-2,4-dioxobutanoate_1	ME104421	1.03	0.72	1.24
O-Phospho-L-homoserine	ME105530	1.02	0.73	1.24
2-Aminoadenosine	ME104279	0.97	0.76	1.26
Homostachydrine_1	ME105170	0.99	0.77	1.24
1-Aminocyclopropane-1-carboxylate_1	ME104215	0.99	0.81	1.20
Cytosine_1	ME104908	0.99	0.81	1.21
Tropinone	ME105841	0.97	0.81	1.22
Cajanol	ME104787	0.98	0.81	1.21
Pantothenate	ME105551	0.98	0.81	1.22
Bendiocarb_1	ME104716	0.96	0.80	1.24
Homostachydrine_2	ME105171	0.95	0.80	1.25
Phosphoenolpyruvate	ME105606	0.94	0.84	1.22
Trihomomethionine_1	ME105832	0.94	0.84	1.22
4-Heptyloxyphenol_3	ME104461	0.95	0.82	1.24
Corticosterone_1	ME104865	0.95	0.82	1.22
Oblongolide_1	ME105523	1.07	1.00	0.93
Diacetyl	ME104954	1.07	0.99	0.94
L-ARGININE	ME105243	1.07	0.98	0.94
Nicotinamide	ME105472	1.09	0.95	0.96
5-METHYLCYTOSINE HYDROCLORIDE	ME104556	1.08	0.96	0.96
Sulcatone_2	ME105764	1.08	0.96	0.97
Thymidine	ME105801	1.06	0.97	0.97
Isobutyronitrile_1	ME105209	1.07	0.97	0.96
L-Valine	ME105311	1.07	0.97	0.96
5,6-Dihydrothymine_1	ME104514	1.08	0.97	0.95
Tos-Arg-CH2Cl	ME105818	1.07	0.97	0.95
L-Lysine 1,6-lactam	ME105285	1.06	0.98	0.96
(S)-ATPA_1	ME104171	1.06	0.98	0.96
5-Methyl-2^-deoxycytidine	ME104553	1.07	0.98	0.95
Glutathionylaminopropylcadaverine	ME105127	1.07	0.98	0.96
Boschnialactone_2	ME104760	1.09	0.96	0.95
D-Octopine	ME105014	1.09	0.96	0.94
N-Acetyl-L-leucine_1	ME105420	1.10	0.96	0.95
N-Nitrosopiperidine	ME105505	1.10	0.95	0.95
4-Methylthio-2-oxobutanoic acid	ME104485	1.11	0.94	0.95
Tetrahomomethionine	ME105784	1.10	0.95	0.94
THYMINE_1	ME105802	1.11	0.95	0.94
Valclavam	ME105862	1.12	0.96	0.92
4-Hydroxymethylphenylhydrazine	ME104474	1.11	0.97	0.92
N(PAI)-METHYL-L-HISTIDINE	ME105383	1.11	0.96	0.93
N-Succinyl-L-glutamate	ME105514	1.10	0.98	0.93
Dibasic sodium phosphate	ME104957	1.10	0.99	0.91
2-Heptanone_1	ME104293	1.10	0.98	0.92
Barbaloin	ME104713	1.10	0.99	0.92
p-Cymene_1	ME105562	1.13	0.98	0.89
Traumatic acid_2	ME105827	1.14	0.99	0.87
Cycloheptanecarboxylic acid_2	ME104892	1.12	1.00	0.88
Triticonazole	ME105837	1.12	1.00	0.88
6-Hydroxypseudooxynicotine_1	ME104583	1.13	1.02	0.85
Tetralin_3	ME105788	1.13	1.02	0.86
N-Acetyl-L-phenylalanine_2	ME105424	1.14	1.01	0.85
Tetralin_1	ME105786	1.14	1.00	0.86
6-Deoxyjacareubin	ME104579	1.15	1.02	0.83
4-(beta-Acetylaminoethyl)imidazole_1	ME104424	1.13	1.04	0.83
Kikkanol A	ME105234	1.13	1.04	0.83
Aprobarbital	ME104688	1.13	1.03	0.84
Gemfibrozil_4	ME105114	1.13	1.03	0.84
5-Amino-4-imidazole carboxylate	ME104526	1.06	1.04	0.90
HC Blue No. 2	ME105148	1.04	1.04	0.91
3-Methyladenine_2	ME104402	1.06	1.01	0.93
Metaxalone_1	ME105329	1.06	1.02	0.92
MYO-INOSITOL	ME105363	1.09	1.00	0.91
(+)-Camphor_1	ME104130	1.07	1.02	0.91
FORMYL-L-METHIONYL PEPTIDE	ME105084	1.08	1.01	0.91
Oxidized Latia luciferin_3	ME105546	1.08	1.06	0.85
Tetralin_4	ME105789	1.10	1.06	0.84
N-Isopropylammelide_2	ME105481	1.10	1.05	0.84
Nithiazide	ME105484	1.10	1.05	0.85
D-Lysopine	ME105011	1.07	1.06	0.88
ALPHA-HYDROXYISOBUTYRIC ACID	ME104649	1.08	1.05	0.87
1^-Acetoxychavicol acetate_2	ME104214	1.07	1.05	0.87
3-Methyl-2-oxobutanoic acid_1	ME104399	1.07	1.06	0.87
D-Fructose 6-phosphate	ME104949	1.09	1.03	0.89
Nifuradene	ME105478	1.08	1.03	0.90
Piperidione_1	ME105624	1.10	1.03	0.87
Pyridoxamine	ME105674	1.09	1.04	0.87
CATECHOL	ME104801	0.99	0.93	1.08
Bakkenolide A_2	ME104711	0.98	0.93	1.09
2-deoxy-D-galactose (fructose/glucose)	ME104286	0.98	0.94	1.08
N6-Methyl-L-lysine_1	ME105401	0.98	0.94	1.08
3-Oxododecanoic acid_1	ME104414	1.00	0.95	1.06
Hercynine	ME105154	0.99	0.94	1.07
N-Acetyl-L-histidine_1	ME105418	0.99	0.94	1.07
4-IMIDAZOLEACETIC ACID	ME104477	1.00	0.93	1.07
alpha-Oxo-benzeneacetic acid_2	ME104656	1.00	0.94	1.07
Isoquinoline_1	ME105221	1.00	0.92	1.08
Ozagrel hydrochloride	ME105548	1.00	0.92	1.07
4-Nitro-6-oxohepta-2,4-dienedioate	ME104486	0.99	0.91	1.10
5-Aminolevulinate_1	ME104530	0.99	0.91	1.10
5-Hydroxyisourate	ME104545	0.99	0.92	1.09
Bakkenolide A_1	ME104710	0.99	0.92	1.09
(-)-Limonene_1	ME104116	0.97	0.91	1.12
3-Fluorocyclohexadiene-cis,cis-1,2-diol-1-carboxylate_3	ME104382	0.98	0.90	1.11
5-Valerolactone_2	ME104571	0.98	0.90	1.11
N-Dimethyl-2-aminoethylphosphonate	ME105449	0.97	0.92	1.11
N-Acetyl-L-citrulline	ME105412	0.96	0.92	1.11
N-Acetyl-L-glutamate 5-semialdehyde_2	ME105416	0.96	0.93	1.11
Polysulfide	ME105629	0.96	0.93	1.11
Benzoate_1	ME104725	0.97	0.94	1.09
N-((R)-Pantothenoyl)-L-cysteine_2	ME105369	0.96	0.94	1.10
L-HISTIDINE	ME105266	0.96	0.95	1.09
4-Vinylcyclohexene_2	ME104509	0.96	0.96	1.09
4-Chlorobiphenyl	ME104449	0.95	0.96	1.09
L-Threonine	ME105300	0.95	0.96	1.09
Phendimetrazine_2	ME105581	0.95	0.98	1.07
Retinoate	ME105687	0.95	0.97	1.08
(9Z,12Z)-(8R)-Hydroxyoctadeca-9,12-dienoic acid_1	ME104155	0.95	0.97	1.08
(-)-Menthyl acetate_3	ME104123	0.95	0.97	1.08
3-Hydroxykynurenamine	ME104389	0.94	0.97	1.09
Valine	ME105863	0.94	0.97	1.08
N2-Acetyl-L-aminoadipate_1	ME105393	0.98	0.97	1.05
Bisphenol B	ME104753	0.98	0.98	1.04
Methohexital	ME105335	0.99	0.97	1.04
3-Oxododecanoic acid_2	ME104415	0.98	0.95	1.07
Benzo[a]pyrene-7,8-dihydrodiol-9,10-oxide	ME104722	0.98	0.96	1.06
Indolelactate_1	ME105202	0.99	0.96	1.06
S-Allyl-L-cysteine_2	ME105714	0.99	0.96	1.06
Tolylacetate_3	ME105816	1.05	0.94	1.01
2,2-Dichloro-1,1-ethanediol	ME104237	1.04	0.95	1.01
5,6-DIHYDROURACIL	ME104517	1.04	0.94	1.01
4-GUANIDINOBUTANOATE	ME104456	1.03	0.95	1.02
L-Arogenate_1	ME105244	1.03	0.94	1.02
Aristolochic acid	ME104692	1.04	0.94	1.02
3-Methoxybenzyl alcohol_2	ME104395	1.04	0.94	1.02
3-UREIDOPROPIONATE	ME104420	1.04	0.94	1.02
Gossypetin	ME105139	1.04	0.92	1.03
Glycyl-leucine_1	ME105136	1.05	0.92	1.03
2-Isopropylmaleate_2	ME104310	1.05	0.92	1.03
3-Methyladenine_1	ME104401	1.05	0.92	1.03
Potassium dibasic phosphate	ME105632	1.04	0.93	1.03
Acetone cyanohydrin_2	ME104618	1.04	0.93	1.03
Latia luciferin_2	ME105249	1.04	0.93	1.03
17beta-Methylestra-1,3,5(10)-trien-3-ol	ME104212	1.05	0.93	1.02
Proclavaminic acid_1	ME105640	1.05	0.93	1.02
4-Pyridoxolactone_1	ME104505	1.05	0.93	1.03
Inosine	ME105205	1.05	0.93	1.03
4-Vinylcyclohexene_1	ME104508	1.04	0.92	1.04
Fenoldopam	ME105071	1.03	0.93	1.04
Fluoroacetamide	ME105079	1.03	0.93	1.04
alpha-Sinensal_4	ME104663	1.01	0.93	1.06
Dibutyl adipate_2	ME104964	1.01	0.94	1.05
Diethanolamine_1	ME104970	1.01	0.94	1.05
Suberic acid_1	ME105752	1.03	0.96	1.01
3-(Imidazol-4-yl)-2-oxopropyl phosphate_1	ME104348	1.02	0.96	1.02
Nonanoic acid_1	ME105510	1.02	0.96	1.02
Cycloheptanecarboxylic acid_1	ME104891	1.00	0.96	1.04
Hexylamine	ME105160	1.00	0.96	1.05
Phenolphthalin	ME105584	1.01	0.95	1.03
URACIL	ME105852	1.01	0.96	1.03
4a-Hydroxytetrahydrobiopterin	ME104437	1.01	0.96	1.03
Dichloromethane	ME104965	1.01	0.96	1.03
Phaseollidin hydrate	ME105576	1.02	0.94	1.04
N1-Acetylspermidine_1	ME105388	1.02	0.95	1.03
2-Amino-4-hydroxy-6-(D-erythro-1,2,3-trihydroxypropyl)-7,8-dihydropteridine	ME104273	1.02	0.95	1.04
Cumene_4	ME104885	1.01	0.95	1.04
BETAINE	ME104745	1.01	0.90	1.09
Maclurin	ME105313	1.02	0.90	1.09
Ectoine	ME105034	1.01	0.89	1.11
Phensuximide	ME105585	1.00	0.90	1.10
3^,5^-Cyclic IMP	ME104358	1.05	0.86	1.09
N-Trimethyl-2-aminoethylphosphonate_1	ME105518	1.05	0.85	1.10
2-Isopropylmaleate_1	ME104309	1.03	0.88	1.10
3-(2-Hydroxyphenyl)propanoate_2	ME104339	1.03	0.88	1.09
Gerrardine	ME105119	1.03	0.88	1.09
2,3,5-Trihydroxytoluene	ME104238	1.04	0.87	1.10
alpha-Ionone_2	ME104651	1.04	0.86	1.10
Phenylamil	ME105594	1.03	0.87	1.11
Furfuryl alcohol_3	ME105096	1.03	0.87	1.10
GUANINE	ME105144	1.03	0.87	1.10
URATE	ME105854	1.02	0.92	1.06
Pimozide	ME105621	1.03	0.92	1.05
2-(3^-Methylthio)propylmalic acid_1	ME104230	1.03	0.91	1.05
N-ACETYL-DL-GLUTAMIC ACID	ME105408	1.03	0.91	1.06
Podophyllotoxone	ME105628	1.03	0.91	1.06
alpha-Irone_2	ME104653	1.04	0.89	1.07
S,S-Dimethyl-beta-propiothetin	ME105707	1.03	0.90	1.08
9-Methylthiononanaldoxime	ME104610	1.03	0.90	1.07
N-ACETYLNEURAMINATE	ME105428	1.03	0.90	1.07
Xanthine_1	ME105881	1.05	0.88	1.07
4-Hydroxy-2-quinolinecarboxylic acid_2	ME104467	1.05	0.87	1.08
alpha-Sinensal_3	ME104662	1.05	0.87	1.07
Cyclokievitone_1	ME104898	1.06	0.87	1.07
Rishitin	ME105698	1.06	0.87	1.08
2-Iodophenol methyl ether	ME104308	1.06	0.88	1.06
Testosterone glucuronide	ME105783	1.05	0.89	1.06
Frutinone A	ME105087	1.05	0.89	1.06
Phenylethyl alcohol_2	ME105596	1.05	0.89	1.06
Toluene_2	ME105810	1.06	0.89	1.05
3-Methylguanine_1	ME104408	1.06	0.89	1.04
Succinic anhydride_1	ME105756	1.07	0.89	1.04
4-Imidazolone-5-propanoate	ME104478	1.07	0.89	1.04
Methyldopa anhydrous_1	ME105340	1.07	0.89	1.04
Brugine	ME104764	1.07	0.88	1.04
Dihydrobiopterin_1	ME104987	1.07	0.88	1.05
(1-Ribosylimidazole)-4-acetate_1	ME104138	1.08	0.90	1.03
Cinncassiol E	ME104823	1.08	0.89	1.03
N-ACETYL-L-ASPARTIC ACID	ME105411	1.08	0.88	1.04
PIPECOLATE	ME105622	1.08	0.89	1.04
(S)-6-Hydroxynicotine_1	ME104169	1.06	0.91	1.04
Cytosine_2	ME104909	1.06	0.90	1.03
Glycine_2	ME105134	1.07	0.90	1.02
Guanidinoethyl methyl phosphate_2	ME105143	1.02	1.11	0.86
Castanospermine_1	ME104798	1.02	1.10	0.87
Theophylline_1	ME105792	1.02	1.11	0.87
4-Hexyloxyphenol_2	ME104464	1.01	1.09	0.89
Ruscopine	ME105700	1.03	1.09	0.88
Anthranilate	ME104680	1.02	1.15	0.83
Dihydro-4,4-dimethyl-2,3-furandione_2	ME104984	1.04	1.13	0.84
Dihydro-4,4-dimethyl-2,3-furandione_3	ME104985	1.00	1.07	0.93
Azelaic acid	ME104707	0.99	1.06	0.95
Catechol	ME104800	1.00	1.05	0.95
HYPOXANTHINE	ME105178	1.03	1.04	0.93
GUANIDINOACETATE	ME105141	1.02	1.05	0.93
Diethyl 2-methyl-3-oxosuccinate	ME104972	1.02	1.04	0.94
Fumarate	ME105090	1.02	1.04	0.94
10-Desacetyltaxuyunnanin C	ME104202	1.02	1.07	0.92
7-Methyluric acid_1	ME104597	1.03	1.06	0.91
TAURINE	ME105771	1.00	1.12	0.89
3-Fluoro-cis,cis-muconate	ME104379	0.99	1.10	0.91
5-Aminolevulinate_2	ME104531	0.99	1.11	0.90
S-Ribosyl-L-homocysteine_2	ME105742	0.98	1.09	0.93
8-Amino-7-oxononanoate_1	ME104602	0.99	1.09	0.92
ETHANOLAMINE PHOSPHATE	ME105044	0.98	1.09	0.92
1,2,6-Hexanetriol	ME104186	0.97	1.09	0.95
N-Acetylmethionine_1	ME105425	0.98	1.08	0.94
Methyleugenol_1	ME105343	1.03	0.97	1.00
(R)-2-Hydroxybutane-1,2,4-tricarboxylate_1	ME104162	1.03	0.97	1.00
UROCANATE	ME105860	1.04	0.97	1.00
N-ACETYLPUTRESCINE	ME105431	1.04	0.97	0.99
N-Acetyl-L-glutamate_1	ME105413	1.04	0.97	0.99
N6-Methyl-L-lysine_2	ME105402	1.04	0.97	0.99
Cyclohexanol	ME104895	1.04	0.97	0.99
3-AMINOISOBUTANOATE	ME104366	1.04	0.97	0.99
6-Acetophenazine-1-carboxylic acid	ME104573	1.04	0.97	0.99
Octylamine	ME105527	1.03	1.00	0.96
Phaseollidin	ME105575	1.03	1.00	0.97
Nonane-4,6-dione_1	ME105508	1.03	0.99	0.98
Phenanthrene-4,5-dicarboxylate	ME105579	1.03	0.99	0.98
D-Arabinono-1,4-lactone_2	ME104922	1.04	0.98	0.98
5-AMINOLEVULINIC ACID	ME104533	1.05	0.98	0.97
Succinic anhydride_2	ME105757	1.04	0.99	0.97
5-Hydroxymethyluracil	ME104549	1.04	0.99	0.97
cis-1,2-Dihydro-3-ethylcatechol_2	ME104826	1.04	0.99	0.97
Cucurbic acid_2	ME104881	1.00	0.97	1.03
O-Decanoyl-L-carnitine	ME105528	1.00	0.97	1.03
Phenylethyl alcohol_1	ME105595	1.01	0.98	1.02
Aldicarb_1	ME104638	1.01	0.97	1.02
(-)-Menthyl acetate_2	ME104122	1.01	0.97	1.02
Tributyl phosphate	ME105828	0.98	0.99	1.03
alpha-Sinensal_2	ME104661	1.00	0.98	1.02
3-Fluoro-1-(4-hydroxyphenyl)-1-propanone	ME104378	0.99	0.99	1.02
Butanal_2	ME104774	0.99	0.98	1.02
Zingerone_1	ME105893	1.00	1.01	1.00
4-Heptyloxyphenol_1	ME104459	1.00	1.00	0.99
Trp-P-1	ME105842	1.00	1.01	0.99
2-(3^-Methylthio)propylmalic acid_4	ME104233	1.00	1.01	0.99
(9Z)-(13S)-12,13-Epoxyoctadeca-9,11-dienoic acid_1	ME104151	1.00	1.01	0.99
Phytuberin	ME105612	0.99	1.00	1.01
Cadaverine	ME104785	0.99	1.00	1.01
Oxidized Latia luciferin_2	ME105545	0.99	1.00	1.01
2-Ethylhexyl phthalate_1	ME104288	0.99	1.00	1.00
5-Sulfosalicylate_1	ME104568	0.99	1.00	1.00
3-[(3aS,4S,7aS)-7a-Methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoate_1	ME104361	0.99	1.01	1.00
Capsi-amide	ME104793	0.99	1.01	1.00
Buddledin A_2	ME104766	1.00	1.00	1.01
Tos-Lys-CH2Cl	ME105819	1.00	0.99	1.01
Linoleate	ME105275	1.00	0.99	1.01
(+/-)-5-[(tert-Butylamino)-2^-hydroxypropoxy]-1,2,3,4-tetrahydro-1-naphthol	ME104136	1.00	0.99	1.01
2-Oxooctadecanoic acid_1	ME104327	1.00	0.99	1.01
3-Butylidene-7-hydroxyphthalide_1	ME104368	1.00	0.99	1.01
Zinnimidine_2	ME105897	1.00	1.00	1.00
trans-1,2-Dichloroethene	ME105821	1.00	1.00	1.00
Precocene II_1	ME105634	1.00	1.00	1.00
Coniferyl alcohol_3	ME104862	1.00	1.00	1.00
Buddledin A_1	ME104765	1.00	1.00	1.00
3-Phosphonooxypyruvate	ME104417	1.00	1.00	1.00
9,12,13-TriHOME	ME104609	1.00	1.00	1.00
Dodecanamide	ME105015	1.00	0.99	1.00
Thymyl acetate_2	ME105805	1.00	0.99	1.00
NEPSILON,NEPSILON,NEPSILON-TRIMETHYLLYSINE	ME105454	1.02	0.97	1.01
Nifedipine	ME105477	1.02	0.97	1.01
cis-1,2-Dihydronaphthalene-1,2-diol_2	ME104830	1.02	0.98	1.01
Oxidized Latia luciferin_1	ME105544	1.01	0.98	1.01
Hexadecasphinganine	ME105158	1.01	0.98	1.01
Dodemorph	ME105018	1.01	0.98	1.01
1-Octanal_2	ME104221	1.01	0.98	1.01
Cholesterol sulfate	ME104815	1.01	0.98	1.01
Tris(butoxyethyl)phosphate	ME105836	1.01	0.98	1.00
(-)-Menthyl acetate_1	ME104121	1.02	0.98	1.00
p-Benzoquinone	ME105556	1.02	0.98	1.00
alpha-Sinensal_1	ME104660	1.01	0.99	0.99
Zinnimidine_1	ME105896	1.01	0.99	1.00
Xanthan_1	ME105879	1.01	0.99	1.00
Phthalate_1	ME105608	1.01	0.99	1.00
Montanin A	ME105359	1.01	0.99	1.00
Coniferyl alcohol_2	ME104861	1.01	0.99	1.00
Botrydial	ME104762	1.01	0.99	1.00
(9Z)-(7S,8S)-Dihydroxyoctadecenoic acid_1	ME104153	1.01	0.99	1.00
2-Thiophenesulfonamide	ME104334	1.01	0.99	1.00
1-Octanal_1	ME104220	1.01	0.99	1.00
2-Hydroxycyclohexan-1-one_2	ME104300	1.01	0.99	1.00
gamma-L-Glutamyl-L-cysteine	ME105108	1.01	1.00	0.99
Temazepam	ME105778	1.02	1.00	0.99
Gemfibrozil_2	ME105112	1.02	0.99	0.99
Dehydrojuvabione_1	ME104933	1.02	0.99	0.99
D-Alanyl-D-alanine_2	ME104917	1.02	0.99	0.99
2-Aminobenzenesulfonate	ME104280	1.02	0.99	0.99
Aethusin	ME104633	1.02	0.99	0.99
7-Methylxanthine	ME104599	1.02	1.02	0.96
Ethyl 3-(N-butylacetamido)propionate_1	ME105050	1.02	1.03	0.95
N1-Acetyl-tabtoxinine-beta-lactam	ME105390	1.02	1.01	0.97
2-Hydroxycyclohexan-1-one_1	ME104299	1.01	1.01	0.98
Diethylene glycol_2	ME104975	1.01	1.01	0.98
L-LYSINE	ME105284	1.01	1.02	0.97
Pyocyanine	ME105668	1.01	1.02	0.97
Pentanoate_1	ME105570	1.00	1.02	0.98
2-Ethylhexyl phthalate_2	ME104289	0.99	1.03	0.97
Biotin amide	ME104748	1.00	1.03	0.97
Phendimetrazine_1	ME105580	1.00	1.03	0.97
4-Heptyloxyphenol_2	ME104460	0.98	1.01	1.01
Retinol	ME105688	0.98	1.00	1.02
1,8-Diazacyclotetradecane-2,9-dione	ME104201	0.99	1.02	0.99
3-(2-Hydroxyphenyl)propanoate_1	ME104338	0.99	1.03	0.99
cis-1,2-Dihydronaphthalene-1,2-diol_1	ME104829	0.99	1.03	0.99
alpha-Curcumene_1	ME104646	0.97	1.04	0.99
Methasulfocarb	ME105334	0.98	1.04	0.99
3,4-Methylenedioxymethamphetamine	ME104355	0.98	1.03	0.99
Chloromethiuron	ME104812	0.98	1.03	0.99
6-endo-Hydroxycineole_1	ME104580	0.97	1.02	1.01
Phenmetrazine	ME105582	0.97	1.02	1.00
3-Methylbutanamine	ME104403	0.98	1.02	1.00
Myristoleic acid_1	ME105366	0.98	1.02	1.00
p-Cumate_4	ME105561	0.96	1.04	1.00
Warfarin	ME105874	0.96	1.04	1.00
Glycerone	ME105131	0.96	1.03	1.00
4-Oxocyclohexanecarboxylate_1	ME104492	0.97	1.03	1.00
Diethylene glycol_3	ME104976	0.97	1.03	1.00
XYLITOL	ME105886	0.95	1.05	1.00
(6S,9R)-Vomifoliol_1	ME104147	0.94	1.05	1.01
S-Ribosyl-L-homocysteine_1	ME105741	0.93	1.05	1.01
2-Aceto-2-hydroxybutanoate	ME104269	0.94	1.04	1.01
Vermelone_1	ME105867	0.95	1.04	1.01
4-Pyridoxate_1	ME104502	0.97	1.05	0.98
Furfural diethyl acetal_1	ME105092	0.98	1.05	0.97
gamma-Coniceine	ME105101	0.94	1.07	0.99
4-Aminobiphenyl	ME104446	0.95	1.06	0.98
L-ALLOTHREONINE	ME105241	0.95	1.06	0.98
cis-2,3-Dihydro-2,3-dihydroxybiphenyl_1	ME104832	0.95	1.06	0.99
Inulicin	ME105206	0.95	1.06	0.99
Dimexano	ME105004	0.96	1.05	0.99
Drazoxolon_2	ME105026	0.96	1.06	0.99
N-Methylethanolamine phosphate	ME105492	0.97	1.07	0.96
2,5-Dihydroxypyridine_2	ME104258	0.96	1.07	0.97
N-Acetyl-D-tryptophan	ME105410	0.96	1.07	0.97
2-Oxoglutarate	ME104326	0.95	1.08	0.97
Citrate_1	ME104848	0.95	1.08	0.97
Galipine	ME105100	0.95	1.12	0.93
Glutarate	ME105126	0.94	1.09	0.97
Diclomezine	ME104968	0.93	1.10	0.97
Buspirone_1	ME104770	0.94	1.10	0.97
cis-Aconitate_1	ME104842	0.94	1.10	0.97
4-Chlorophenoxyacetate	ME104450	0.95	1.10	0.95
2,5-Furandicarboxylate_1	ME104261	0.94	1.11	0.95
epsilon-Caprolactam	ME105041	0.93	1.11	0.96
11-Hydroxycanthin-6-one	ME104207	0.92	1.09	0.99
Oblongolide_2	ME105524	0.92	1.08	1.00
D-Urobilinogen_1	ME105030	0.88	1.12	0.98
Nitralin	ME105485	0.89	1.12	0.99
4-Pyridoxate_3	ME104504	0.91	1.12	0.97
CITRATE	ME104847	0.91	1.10	0.98
Dehydrocycloguanandin	ME104932	0.89	1.04	1.07
GLYCINE	ME105132	0.88	1.06	1.06
Indan-1-ol_1	ME105187	0.89	1.06	1.05
Orthophosphate	ME105537	0.91	1.06	1.03
2-(Acetamidomethylene)succinate	ME104235	0.91	1.05	1.03
4-Propylphenol_2	ME104501	0.91	1.05	1.04
2-(3^-Methylthio)propylmalic acid_3	ME104232	0.93	1.04	1.03
L-ORNITHINE	ME105294	0.92	1.03	1.05
Euxanthone	ME105064	0.93	1.00	1.07
L-SERINE	ME105299	0.94	1.00	1.06
L-GLUTAMINE	ME105264	0.91	1.01	1.08
N-Monomethyl-2-aminoethylphosphonate	ME105498	0.92	1.01	1.07
Melamine	ME105318	0.96	1.01	1.04
N-Methyl-(R,S)-tetrahydrobenzylisoquinoline	ME105488	0.96	1.00	1.04
Gemfibrozil_1	ME105111	0.95	1.00	1.05
Allylestrenol_2	ME104643	0.96	0.99	1.05
Calystegin B2_3	ME104791	0.95	0.99	1.06
N-(6-Aminohexanoyl)-6-aminohexanoate_1	ME105374	0.95	1.03	1.02
Tyr-OEt	ME105850	0.95	1.02	1.02
Atractylone	ME104703	0.96	1.02	1.02
Cinoxacin	ME104824	0.96	1.02	1.02
Indole-3-acetate_2	ME105196	0.95	1.02	1.04
O-Carbamoyl-L-serine	ME105526	0.95	1.01	1.04
(-)-Limonene_3	ME104118	0.94	1.02	1.03
TRANS-4-HYDROXYPROLINE	ME105823	0.94	1.02	1.04
3-Dehydroshikimate_2	ME104374	1.22	0.90	0.89
p-Xylene_2	ME105665	1.22	0.90	0.88
L-Cysteine	ME105254	1.21	0.91	0.88
PHOSPHOCHOLINE	ME105603	1.22	0.91	0.88
Otonecine_2	ME105542	1.23	0.91	0.86
Cyclohexane-1,3-dione_2	ME104894	1.24	0.89	0.87
Fasoracetam	ME105069	1.23	0.90	0.88
Tolylacetate_1	ME105814	1.23	0.90	0.87
(+)-Bornane-2,5-dione_1	ME104128	1.23	0.90	0.87
3,4-Dihydroxyphenylethyleneglycol	ME104354	1.23	0.90	0.87
5-Sulfosalicylate_2	ME104569	1.23	0.90	0.87
Piceatannol	ME105613	1.21	0.88	0.89
4-Pyridoxolactone_3	ME104507	1.21	0.89	0.90
Heterodendrin_2	ME105157	1.21	0.89	0.90
Deserpidine	ME104947	1.22	0.87	0.90
LL-2,6-Diaminoheptanedioate_2	ME105281	1.23	0.86	0.91
2-Oxoadipate_1	ME104320	1.22	0.86	0.92
Metronidazole	ME105350	1.22	0.86	0.92
2-Hydroxy-2,4-pentadienoate	ME104297	1.14	0.95	0.92
6-Oxocineole_2	ME104589	1.14	0.95	0.92
D-(+)-GALACTOSAMINE	ME104911	1.15	0.96	0.88
p-Xylene_1	ME105664	1.16	0.96	0.88
4-COUMARATE	ME104451	1.15	0.95	0.90
Rhododendrin	ME105693	1.16	0.95	0.89
Imidazol-5-yl-pyruvate_2	ME105184	1.16	0.93	0.91
Dipropyl disulfide_2	ME105009	1.18	0.92	0.91
Thiomorpholine 3-carboxylate	ME105798	1.18	0.92	0.91
8-Amino-7-oxononanoate_4	ME104605	1.18	0.93	0.90
Testolate	ME105781	1.18	0.92	0.90
2-Oxosuberate_2	ME104331	1.18	0.92	0.90
Indole-5,6-quinone_3	ME105200	1.18	0.92	0.90
Crotanecine_1	ME104874	1.18	0.93	0.89
4-Methyl-2-oxopentanoate_1	ME104481	1.17	0.93	0.90
Indospicine	ME105204	1.17	0.94	0.89
Androsterone	ME104673	1.15	0.92	0.93
Topiramate	ME105817	1.14	0.92	0.94
L-Citrulline	ME105251	1.17	0.91	0.93
BETA-ALANINE	ME104738	1.18	0.91	0.92
L-Methionine S-oxide	ME105289	1.17	0.91	0.92
Paramethadione_1	ME105553	1.16	0.91	0.92
Cuauhtemone_1	ME104877	1.16	0.91	0.93
Dimepiperate	ME105003	1.16	0.90	0.93
Demethylalangiside	ME104940	1.23	0.94	0.82
3-(Imidazol-4-yl)-2-oxopropyl phosphate_2	ME104349	1.21	0.95	0.84
2-Hydroxy-6-oxo-6-(2-hydroxyphenoxy)-hexa-2,4-dienoate	ME104298	1.22	0.93	0.85
L-Leucine	ME105282	1.22	0.93	0.85
Dehydroalanine_2	ME104931	1.17	0.97	0.86
N-Hydroxy-L-valine	ME105469	1.18	0.98	0.84
6alpha-Hydroxycortisol	ME104574	1.20	0.93	0.88
p-Cumate_2	ME105559	1.19	0.93	0.88
Cyclacillin	ME104889	1.18	0.95	0.87
2-Amino-3,7-dideoxy-D-threo-hept-6-ulosonic acid	ME104271	1.19	0.94	0.87
6-Acetamido-3-oxohexanoate	ME104572	1.19	0.95	0.86
Umbelliferone	ME105851	1.19	0.95	0.86
Compactin diol lactone	ME104859	1.29	0.79	0.92
6-Hydroxyindolelactate	ME104582	1.28	0.80	0.92
Acrylamide	ME104626	1.28	0.81	0.91
Coproporphyrin I	ME104864	1.30	0.80	0.90
5-Guanidino-2-oxopentanoate	ME104540	1.30	0.82	0.88
Thidiazuron_2	ME105796	1.30	0.81	0.89
5-exo-Hydroxy-1,2-campholide	ME104539	1.26	0.83	0.92
L-Octanoylcarnitine	ME105292	1.25	0.83	0.92
Coniferyl alcohol_1	ME104860	1.24	0.86	0.90
(R)-Mevalonate_3	ME104166	1.24	0.85	0.90
Cyclopentanone_1	ME104901	1.26	0.84	0.90
Pendimethalin	ME105565	1.25	0.85	0.90
5-Guanidino-3-methyl-2-oxopentanoate	ME104541	1.25	0.85	0.91
Avizafone	ME104706	1.25	0.84	0.91
Dehydrojuvabione_3	ME104935	1.27	0.87	0.86
Cyclopentanone_2	ME104902	1.26	0.86	0.88
Aromatic aldehyde_2	ME104694	1.27	0.86	0.87
(S)-2,3,4,5-Tetrahydropyridine-2-carboxylate	ME104167	1.27	0.86	0.87
Boschnialactone_1	ME104759	1.29	0.84	0.86
Dihydro-4,4-dimethyl-2,3-furandione_1	ME104983	1.27	0.85	0.89
(-)-Jasmonic acid	ME104115	1.28	0.84	0.88
N-Acetyl-D-fucosamine	ME105405	1.28	0.84	0.88
Monuron	ME105360	1.29	0.83	0.88
Propyl cinnamate_1	ME105650	1.29	0.83	0.89
2-Hydroxyfelbamate_1	ME104303	1.33	0.88	0.79
Sorgolactone	ME105737	1.34	0.88	0.78
Heliotrine_2	ME105151	1.31	0.90	0.79
1-(1-Oxopropyl)-1H-imidazole	ME104176	1.33	0.90	0.77
5,6-Dihydrothymine_3	ME104516	1.32	0.91	0.77
S-Acetylphosphopantetheine_2	ME105710	1.31	0.93	0.75
Oryzalin	ME105538	1.35	0.91	0.75
S-(2-Hydroxyethyl)-N-acetyl-L-cysteine	ME105702	1.33	0.92	0.75
p-Aminobenzamidine dihydrochloride	ME105549	1.28	0.88	0.84
5-Nitro-ortho-anisidine_1	ME104560	1.33	0.86	0.81
Butanoylphosphate	ME104778	1.30	0.87	0.82
(-)-Menthyl acetate_4	ME104124	1.31	0.87	0.82
4-Oxoproline_1	ME104498	1.30	0.86	0.84
Isoquinoline_2	ME105222	1.30	0.86	0.84
Phenylacetylglutamine	ME105593	1.32	0.86	0.83
(S)-Dihydroorotate	ME104174	1.31	0.86	0.83
4-Heptyloxybenzoic acid_2	ME104458	1.27	0.93	0.80
Allidochlor_1	ME104640	1.28	0.91	0.81
Guanosine	ME105147	1.29	0.91	0.80
cis-4-Carboxymethylenebut-2-en-4-olide_2	ME104840	1.24	0.92	0.84
S-Acetylphosphopantetheine_1	ME105709	1.24	0.91	0.85
N-Nitrosoguvacoline	ME105504	1.27	0.90	0.83
N-(3-Oxododecanoyl)homoserine lactone	ME105371	1.26	0.91	0.83
Pilocarpine	ME105614	1.26	0.91	0.83
3-Fluorocyclohexadiene-cis,cis-1,2-diol-1-carboxylate_1	ME104380	1.25	0.80	0.95
Hydantoin-5-propionate_2	ME105173	1.24	0.81	0.94
Porphobilinogen_2	ME105631	1.24	0.81	0.94
5-Hydroxy-L-tryptophan_2	ME104547	1.24	0.82	0.93
Crotanecine_2	ME104875	1.24	0.82	0.94
Ginkgolide B	ME105122	1.21	0.84	0.95
Pulcherriminic acid	ME105662	1.21	0.84	0.95
gamma-Glutamyl-beta-aminopropiononitrile_2	ME105103	1.20	0.82	0.96
Butanoic acid_3	ME104777	1.22	0.82	0.96
D-Erythrose	ME104946	1.22	0.81	0.97
Latia luciferin_1	ME105248	1.21	0.81	0.98
S-(2-Methylpropanoyl)-dihydrolipoamide	ME105703	1.21	0.82	0.97
Bakkenolide A_3	ME104712	1.24	0.78	0.98
4-Hydroxy-3-nitrosobenzamide	ME104468	1.25	0.77	0.97
Cytidine	ME104907	1.25	0.78	0.97
(-)-Menthone_2	ME104120	1.25	0.78	0.97
7-Mercaptoheptanoylthreonine	ME104596	1.21	0.79	1.00
Cumene_2	ME104883	1.22	0.79	0.98
2-trans,6-trans-Farnesal_1	ME104335	1.23	0.79	0.99
3-Sulfomuconate	ME104419	1.23	0.79	0.98
Codeine-6-glucuronide	ME104856	1.20	0.75	0.98
Diisopropyl phthalate_1	ME104998	1.21	0.76	1.02
Thymyl acetate_1	ME105804	1.23	0.77	1.00
Benzyl (2R,3S)-2-methyl-3-hydroxybutanoate	ME104732	1.22	0.77	1.01
5-(alpha-Phenylethyl)semioxamazide	ME104513	1.23	0.76	1.01
Guanidinoethyl methyl phosphate_1	ME105142	1.22	0.76	1.01
1-Pyrenylsulfate_1	ME104226	1.23	0.70	1.07
6beta-Hydroxy-D-homo-17a-oxaandrost-4-ene-3,17-dione	ME104576	1.22	0.72	1.06
Strigolactone ABC-rings_1	ME105748	1.28	0.71	1.02
(3S,5S)-Carbapenam-3-carboxylic acid_1	ME104143	1.24	0.73	1.04
Ripazepam	ME105697	1.23	0.74	1.03
Aspidinol_1	ME104698	1.25	0.71	1.04
Vanillyl alcohol_2	ME105865	1.26	0.72	1.03
Diisopropyl phthalate_2	ME104999	1.33	0.73	0.95
4-Isopropylbenzaldehyde	ME104479	1.31	0.74	0.95
N-(3-Oxohexanoyl)homoserine lactone	ME105372	1.31	0.73	0.96
Pyridoxal	ME105673	1.32	0.71	0.97
Ginkgolide C	ME105123	1.33	0.70	0.95
L-Pipecolate	ME105297	1.33	0.71	0.95
6beta-Hydroxy-17beta-estradiol	ME104575	1.27	0.79	0.95
dl-Methylephedrine hydrochloride	ME105010	1.27	0.77	0.96
Indole-5,6-quinone_4	ME105201	1.28	0.76	0.96
L-Formylkynurenine_3	ME105262	1.26	0.74	0.99
N-Succinyl-LL-2,6-diaminoheptanedioate	ME105515	1.25	0.74	1.00
5-Hydroxypentanoate_2	ME104551	1.30	0.71	0.99
Proclavaminic acid_2	ME105641	1.29	0.73	0.98
Psicofuranine_2	ME105660	1.29	0.73	0.98
2-Hydroxyfelbamate_2	ME104304	1.28	0.73	0.99
Bisphenol A dimethacrylate	ME104752	1.28	0.73	0.98
Sodium sulfate	ME105736	1.18	0.89	0.93
N(pi)-Methyl-L-histidine	ME105384	1.19	0.88	0.93
S-Adenosyl-L-homocysteine	ME105711	1.19	0.88	0.93
3-Methylguanine_2	ME104409	1.19	0.87	0.93
Indole-5,6-quinone_2	ME105199	1.19	0.87	0.94
Cyclohexanone	ME104896	1.16	0.88	0.96
Reduced FMN	ME105684	1.16	0.88	0.95
trans-4-Hydroxycyclohexanecarboxylate	ME105822	1.17	0.90	0.94
Metazachlor	ME105331	1.17	0.88	0.95
ALPHA-AMINOADIPATE	ME104645	1.17	0.89	0.94
p-Cumate_3	ME105560	1.17	0.89	0.95
O-Succinyl-L-homoserine	ME105540	1.18	0.87	0.95
Tyramine_2	ME105849	1.18	0.86	0.96
3^,5^-Cyclic GMP	ME104357	1.19	0.86	0.96
beta-Citryl-L-glutamate	ME104742	1.19	0.86	0.95
(9Z)-(13S)-12,13-Epoxyoctadeca-9,11-dienoic acid_2	ME104152	1.17	0.85	0.98
Diisopropyl sulfate	ME105001	1.18	0.84	0.98
Cumene_1	ME104882	1.18	0.85	0.96
Benzofuran_1	ME104727	1.18	0.85	0.97
L-Tryptophanamide	ME105302	1.18	0.85	0.97
Tauropine_1	ME105773	1.19	0.84	0.97
5-Amino-4-imidazolecarboxyamide_1	ME104527	1.19	0.84	0.96
L-Glutamine	ME105265	1.19	0.85	0.96
MANNOSE	ME105316	1.17	0.87	0.96
O-Butanoylcarnitine	ME105525	1.17	0.87	0.96
Sulcatone_1	ME105763	1.16	0.87	0.97
3-Dehydroquinate_2	ME104372	1.16	0.87	0.97
D-Alanyl-D-serine	ME104918	1.16	0.87	0.97
N-((R)-Pantothenoyl)-L-cysteine_1	ME105368	1.17	0.86	0.97
5^-Methylthioadenosine	ME104558	1.17	0.86	0.97
Cerulenin_1	ME104806	1.17	0.86	0.97
S-(Phenylacetothiohydroximoyl)-L-cysteine	ME105706	1.15	0.86	0.99
3-Dehydroquinate_1	ME104371	1.15	0.87	0.99
Paramethadione_2	ME105554	1.14	0.87	0.99
Febrifugine	ME105070	1.16	0.85	0.99
2,4-Bis(acetamido)-2,4,6-trideoxy-beta-L-altropyranose_1	ME104250	1.16	0.86	0.99
Benzo[b]naphtho[2,1-d]thiophene_1	ME104723	1.16	0.86	0.98
N1,N12-Diacetylspermine	ME105387	1.16	0.86	0.98
Nicotyrine_1	ME105475	1.13	0.84	1.03
Xanthurenic acid	ME105885	1.13	0.84	1.04
Cyclopentanone_3	ME104903	1.13	0.83	1.04
Hymexazol O-glucoside	ME105175	1.13	0.83	1.04
1,2,3-Trihydroxybenzene_2	ME104184	1.15	0.82	1.03
2-Oxobutanoate_1	ME104323	1.14	0.83	1.03
Clitidine_1	ME104853	1.14	0.83	1.03
3-Dehydroshikimate_1	ME104373	1.15	0.84	1.00
L-2-Aminoadipate	ME105238	1.16	0.84	1.00
Sebacic acid_1	ME105722	1.15	0.83	1.02
N-Nitrosodi-n-butylamine_1	ME105502	1.15	0.83	1.01
5-Hydroxyindoleacetate_1	ME104542	1.16	0.83	1.01
Dictamnine	ME104969	1.16	0.83	1.01
Jasmone_1	ME105230	1.14	0.86	1.00
Quinolinate	ME105682	1.15	0.85	1.01
Boschnialactone_3	ME104761	1.14	0.85	1.00
5-Hydroxy-L-tryptophan_1	ME104546	1.14	0.85	1.01
Ethyl isovalerate	ME105057	1.14	0.85	1.01
Hyoscyamine methylbromide	ME105176	1.14	0.84	1.02
Lipoamide	ME105277	1.14	0.84	1.02
1-(beta-D-Ribofuranosyl)-1,4-dihydronicotinamide	ME104179	1.13	0.85	1.02
METHYLMALONATE	ME105345	1.13	0.85	1.01
Heterodendrin_1	ME105156	1.13	0.87	1.00
Acadesine	ME104615	1.13	0.87	1.00
Acetone cyanohydrin_1	ME104617	1.13	0.87	1.00
Ethionine_1	ME105046	1.13	0.87	1.01
ISOCITRIC ACID	ME105211	1.12	0.87	1.01
5-Acetamidopentanoate_1	ME104519	1.12	0.87	1.01
Dopamine_1	ME105021	1.12	0.87	1.01
Aspartame	ME104697	1.13	0.86	1.01
THTA	ME105800	1.12	0.86	1.01
Histamine	ME105164	1.12	0.86	1.02
2,3-Dihydroxy-p-cumate_1	ME104243	1.12	0.87	1.02
Metipranolol	ME105348	1.11	0.87	1.02
2-Oxo-6-methylthiohexanoic acid	ME104318	1.11	0.87	1.02
L-Phenylalanine_1	ME105295	1.11	0.87	1.02
L-Arogenate_2	ME105245	1.11	0.89	1.00
Pentahomomethionine	ME105568	1.11	0.89	1.00
4-Amino-5-hydroxymethyl-2-methylpyrimidine_2	ME104444	1.12	0.88	1.01
Uridine	ME105859	1.11	0.88	1.01
Protopine	ME105656	1.11	0.88	1.01
N-Amidino-L-glutamate	ME105432	1.11	0.88	1.01
Guanine_2	ME105146	1.11	0.88	1.01
Epoxiconazole	ME105040	1.11	0.88	1.01
Dethiobiotin	ME104948	1.11	0.88	1.01
2,3-Dihydroxy-p-cumate_2	ME104244	1.11	0.88	1.01
4-ACETAMIDOBUTANOATE	ME104433	1.11	0.88	1.01
Xylobiose	ME105888	1.11	0.86	1.03
Serotonin	ME105727	1.11	0.86	1.03
7-Aminomethyl-7-carbaguanine	ME104591	1.11	0.86	1.03
Nicotyrine_2	ME105476	1.11	0.86	1.03
4-Fluorocyclohexadiene-cis,cis-1,2-diol_2	ME104455	1.12	0.85	1.03
Diethylene glycol_1	ME104974	1.11	0.85	1.03
2-Oxopropyl-CoM	ME104329	1.11	0.85	1.04
Ifosfamide	ME105181	1.11	0.85	1.04
Dipropyl disulfide_1	ME105008	1.10	0.87	1.03
5-Hydroxy-L-tryptophan_3	ME104548	1.09	0.88	1.03
DEOXYCYTIDINE	ME104942	1.09	0.88	1.03
L-Tyrosine_1	ME105303	1.10	0.86	1.05
cis-Aconitate_2	ME104843	1.08	0.87	1.05
Toluene-cis-dihydrodiol_1	ME105811	1.08	0.87	1.05
1,2-Diamino-4-nitrobenzene_1	ME104187	1.09	0.87	1.04
Proglinazine	ME105643	1.09	0.86	1.04
Linamarin	ME105273	1.13	0.88	0.98
4-Acetamidobutanoate_1	ME104434	1.13	0.89	0.98
2,3,6-Trihydroxypyridine	ME104239	1.13	0.89	0.98
2-Oxoglutaramate	ME104325	1.13	0.89	0.98
5^-DEOXYADENOSINE	ME104538	1.13	0.88	0.99
Isofenphos	ME105213	1.13	0.88	0.99
Tussilagine_1	ME105845	1.12	0.89	0.99
N-Acetylaspartylglutamate	ME105404	1.12	0.89	0.99
3-Methoxybenzyl alcohol_1	ME104394	1.12	0.89	0.99
alpha-Ribazole_1	ME104657	1.12	0.89	0.99
L-Formylkynurenine_1	ME105260	1.13	0.89	0.99
N-ACETYL-DL-SERINE	ME105409	1.13	0.89	0.99
4-Hydroxy-2-butynal	ME104465	1.15	0.90	0.96
2-Acetoxyamino-1-methyl-6-phenylimidazo[4,5-b]pyridine	ME104270	1.15	0.89	0.97
1-Pyrroline-2-carboxylate	ME104228	1.14	0.88	0.97
12alpha-Hydroxyamoorstatin	ME104209	1.14	0.89	0.96
cis-1,2-Dihydronaphthalene-1,2-diol_3	ME104831	1.14	0.89	0.97
3-(4-Hydroxyphenyl)pyruvate_1	ME104344	1.11	0.93	0.97
Zalcitabine_1	ME105891	1.11	0.93	0.96
4-Hydroxybutanoic acid_2	ME104472	1.11	0.93	0.96
Urate_1	ME105855	1.11	0.93	0.96
5,6-Dihydrothymine_2	ME104515	1.10	0.93	0.97
Succinylproline_1	ME105759	1.10	0.93	0.97
(1-Ribosylimidazole)-4-acetate_2	ME104139	1.10	0.93	0.96
Hydantoin-5-propionate_1	ME105172	1.10	0.94	0.96
Alantolactone_1	ME104636	1.13	0.92	0.95
4-(2-Aminophenyl)-2,4-dioxobutanoate_2	ME104422	1.13	0.92	0.95
21-Hydroxypregn-4-ene-3,20-dione hydrogen succinate	ME104268	1.13	0.92	0.95
3-Oxo-delta4-steroid	ME104413	1.13	0.92	0.95
Pentobarbital_1	ME105573	1.13	0.90	0.96
4-Hydroxyphenylacetate_1	ME104475	1.12	0.92	0.97
Forchlorfenuron_1	ME105080	1.12	0.91	0.97
SPERMIDINE	ME105739	1.12	0.91	0.97
Panfuran S	ME105550	1.12	0.92	0.96
Boc-Asn-OPhNO2	ME104758	1.13	0.91	0.96
Hypoxylone	ME105179	1.12	0.91	0.96
Homoarginine	ME105165	1.08	0.94	0.98
LEUCINE	ME105255	1.08	0.94	0.99
Syringin	ME105768	1.08	0.93	0.99
3-(Dimethylamino)propyl benzoate	ME104347	1.05	0.95	1.00
CREATININE_1	ME104872	1.06	0.94	0.99
Imidazol-5-yl-pyruvate_1	ME105183	1.06	0.93	1.00
Xanthosine	ME105883	1.10	0.92	0.98
Hinokitiol glucoside	ME105161	1.09	0.92	0.98
3-(4-Hydroxyphenyl)pyruvate_3	ME104346	1.09	0.92	0.99
4-Acetamido-2-amino-6-nitrotoluene	ME104432	1.09	0.92	0.99
Biotin	ME104747	1.11	0.91	0.98
Phenyl acetate_2	ME105587	1.10	0.91	0.99
5-Methylthio-D-ribose	ME104559	1.10	0.91	0.99
Ethyl tiglate_1	ME105058	1.10	0.91	0.99
Tyramine_1	ME105848	1.10	0.88	1.02
Psicofuranine_1	ME105659	1.10	0.89	1.01
Deoxycoformycin	ME104941	1.10	0.89	1.01
5-OXO-L-PROLINE	ME104567	1.10	0.89	1.01
cis-1,2-Dihydro-3-ethylcatechol_1	ME104825	1.10	0.89	1.01
Phenylacetaldehyde_1	ME105589	1.09	0.89	1.02
Nicotinurate	ME105474	1.09	0.89	1.02
2,3-Dihydrothienamycin	ME104241	1.09	0.89	1.02
Istamycin C1	ME105228	1.09	0.89	1.02
Ricinine	ME105695	1.10	0.89	1.02
N6,N6-Dimethyladenosine	ME105399	1.10	0.89	1.02
O-Propanoylcarnitine_1	ME105531	1.10	0.89	1.02
N-ACETYL-D-GALACTOSAMINE	ME105406	1.09	0.91	1.00
Urate-3-ribonucleoside	ME105857	1.09	0.91	1.00
1-Methyladenosine	ME104218	1.10	0.90	1.01
N-Carbamoyl-L-aspartate	ME105439	1.10	0.90	1.01
Pirbuterol	ME105626	1.09	0.90	1.01
L-Methionine	ME105288	1.09	0.90	1.01
L-Homocitrulline_2	ME105269	1.09	0.90	1.01
Drazoxolon_1	ME105025	1.09	0.90	1.01
2,7-Anhydro-alpha-N-acetylneuraminic acid_1	ME104265	1.09	0.90	1.01
3-METHYLHISTAMINE	ME104411	1.09	0.90	1.01
Fagomine	ME105066	1.07	0.92	1.01
3alpha,7alpha-Dihydroxy-12-oxo-5beta-cholanate_1	ME104364	1.07	0.91	1.01
L-Aspartate	ME105246	1.07	0.91	1.01
5-Nitro-ortho-anisidine_3	ME104562	1.08	0.91	1.02
2,5-Furandicarboxylate_3	ME104263	1.08	0.90	1.01
Thymyl acetate_3	ME105806	1.08	0.91	1.01
N-Acetyl-L-glutamate 5-semialdehyde_1	ME105415	1.08	0.91	1.01
Propanoate_1	ME105646	1.08	0.91	1.01
Arg-OEt	ME104691	1.07	0.93	1.01
5-Methylcytosine_1	ME104554	1.07	0.92	1.00
D-Glucose	ME104953	1.08	0.92	1.00
L-Iduronate 2-sulfate	ME105272	1.12	0.82	1.06
Calystegin B2_1	ME104789	1.10	0.84	1.06
3-Methylguanine_3	ME104410	1.11	0.83	1.06
Citrate_2	ME104849	1.11	0.83	1.06
N-Sulfo-D-glucosamine_1	ME105516	1.09	0.83	1.08
N-Methyl-2-pyrrolidinone_2	ME105490	1.10	0.83	1.08
L-Formylkynurenine_2	ME105261	1.10	0.83	1.07
Prenyl caffeate	ME105638	1.10	0.83	1.07
4-Hydroxy-2-quinolinecarboxylic acid_1	ME104466	1.08	0.84	1.08
4-Propylphenol_1	ME104500	1.08	0.84	1.08
5-(3^-Carboxy-3^-oxopropenyl)-4,6-dihydroxypicolinate	ME104511	1.09	0.84	1.07
L-Phenylalanine_2	ME105296	1.09	0.84	1.07
Pyrazinoic acid	ME105670	1.07	0.85	1.08
Phenylpyruvate_3	ME105600	1.08	0.86	1.06
3beta-(Acetyloxy)-5beta-methyl-6beta-chloroestr-9-en-17-one	ME104367	1.08	0.85	1.07
S-Acetyldihydrolipoamide	ME105708	1.08	0.85	1.06
Midodrine_1	ME105354	1.08	0.80	1.11
Tropine_2	ME105839	1.09	0.80	1.11
Amabiline_1	ME104664	1.10	0.82	1.09
Guanine_1	ME105145	1.10	0.81	1.09
Vanillyl alcohol_1	ME105864	1.10	0.81	1.09
LL-2,6-Diaminoheptanedioate_1	ME105280	1.11	0.81	1.08
Phenyl acetate_1	ME105586	1.11	0.81	1.08
Methyl farnesoate_1	ME105338	1.11	0.80	1.09
Tuberonic acid glucoside	ME105844	1.11	0.80	1.09
Ectocarpen	ME105033	1.12	0.79	1.08
Scytalone_2	ME105720	1.11	0.79	1.10
5^-Deoxy-5-fluorocytidine_1	ME104536	1.20	0.73	1.05
10-Oxodecanoate_1	ME104204	1.21	0.74	1.05
Agnuside	ME104635	1.21	0.74	1.05
Isosorbide mononitrate	ME105224	1.21	0.75	1.04
N2-Acetyl-L-aminoadipate_2	ME105394	1.22	0.74	1.04
O-Propanoylcarnitine_2	ME105532	1.18	0.77	1.05
Potassium sulfate	ME105633	1.19	0.76	1.06
1,2-Dihydrosantonin_1	ME104190	1.19	0.74	1.06
6-Oxocineole_1	ME104588	1.19	0.75	1.06
Traumatic acid_1	ME105826	1.19	0.75	1.06
6-Carboxy-5,6,7,8-tetrahydropterin	ME104577	1.19	0.75	1.05
N-Acetyl-L-phenylalanine_1	ME105423	1.20	0.75	1.05
2,3-Dimethylmaleate_3	ME104248	1.17	0.76	1.07
(-)-Sympatol	ME104125	1.16	0.77	1.07
Otonecine_3	ME105543	1.16	0.77	1.07
Calystegin B2_2	ME104790	1.16	0.77	1.07
Indole-3-acetaldehyde_1	ME105191	1.16	0.77	1.07
Dodecanedioic acid	ME105016	1.15	0.77	1.08
Myriocin_2	ME105365	1.15	0.78	1.07
4-Oxoproline_2	ME104499	1.18	0.74	1.08
gamma-Glutamyl-gamma-aminobutyraldehyde_2	ME105106	1.19	0.73	1.08
(E)-4-(Trimethylammonio)but-2-enoate	ME104157	1.16	0.75	1.09
Ethyl(E,Z)-decadienoate	ME105061	1.16	0.74	1.10
Slaframine	ME105731	1.13	0.81	1.06
3-Methyleneoxindole_2	ME104407	1.14	0.80	1.06
Naphthalene-1,2-diol	ME105433	1.14	0.80	1.07
Nona-2,6-dienal	ME105507	1.13	0.80	1.06
Actinidine	ME104627	1.13	0.80	1.07
Isopentenyl diphosphate_1	ME105217	1.13	0.80	1.07
Nonane-4,6-dione_2	ME105509	1.17	0.80	1.03
L-Cladinose_1	ME105252	1.17	0.81	1.02
Ethosuximide	ME105048	1.16	0.81	1.03
N-Acetyl-L-glutamate 5-semialdehyde_3	ME105417	1.17	0.81	1.03
Lichenin_1	ME105270	1.16	0.79	1.05
Methyleugenol_2	ME105344	1.15	0.79	1.05
2-Oxooctadecanoic acid_2	ME104328	1.14	0.81	1.05
Butoctamide hydrogen succinate_1	ME104779	1.16	0.80	1.04
Furametpyr	ME105091	1.16	0.80	1.04
Trimethylamine N-oxide	ME105834	1.16	0.81	1.04
Butanoic acid_1	ME104775	1.15	0.81	1.04
3-HYDROXY-3-METHYLGLUTARATE	ME104384	1.15	0.81	1.04
5^-Deoxy-5-fluorocytidine_2	ME104537	1.15	0.81	1.04
2,3-Dimethylmaleate_1	ME104246	1.19	0.79	1.02
Neopterin_1	ME105451	1.19	0.78	1.03
2,5-Dioxopentanoate_1	ME104259	1.17	0.83	1.00
2-Ethylhexyl phthalate_3	ME104290	1.18	0.83	0.99
Phenylacetaldehyde_2	ME105590	1.18	0.83	0.99
3^,5^-Cyclic AMP	ME104356	1.17	0.82	1.01
3-Hydroxyhexobarbital_1	ME104387	1.18	0.81	1.01
Ankorine	ME104677	1.19	0.81	1.00
Diphenylcarbazide	ME105007	1.18	0.82	1.00
Xanthine_2	ME105882	1.19	1.00	0.80
Dibenzylsuccinate	ME104962	1.19	0.99	0.82
N-Isopropylammelide_4	ME105483	1.20	0.98	0.81
Capillanol	ME104792	1.21	0.99	0.81
D-Gluconic acid	ME104951	1.20	0.99	0.81
5-Acetylamino-6-amino-3-methyluracil_4	ME104524	1.20	1.03	0.77
L-Metanephrine_2	ME105287	1.18	1.05	0.77
4-Fluorocyclohexadiene-cis,cis-1,2-diol_1	ME104454	1.14	1.05	0.81
Nicotianamine	ME105471	1.17	1.04	0.79
TRANS-CINNAMATE	ME105824	1.16	1.03	0.80
N-ACETYL-L-LEUCINE	ME105421	1.07	1.13	0.80
Mescaline_2	ME105327	1.08	1.09	0.83
1-Octanal_4	ME104223	1.10	1.10	0.81
5-Acetylamino-6-amino-3-methyluracil_1	ME104521	1.10	1.11	0.79
3-Butylidene-7-hydroxyphthalide_2	ME104369	1.15	1.15	0.70
6-Methoxytaxifolin	ME104587	1.11	1.15	0.74
Difloxacin	ME104980	1.12	1.15	0.72
Theophylline_2	ME105793	1.15	1.12	0.73
4-Pyridoxate_2	ME104503	1.12	1.13	0.75
Diethylphosphoric acid	ME104979	1.12	1.13	0.76
1-Pyrenylsulfate_2	ME104227	1.13	1.11	0.76
Bendiocarb_2	ME104717	1.14	1.11	0.75
Aminopyrine	ME104667	1.32	1.12	0.66
N-Methyl-2-pyrrolidinone_1	ME105489	1.30	1.08	0.62
Glyphosate-isopropylammonium	ME105138	1.27	1.11	0.62
Yersiniabactin_1	ME105889	1.29	1.10	0.62
Benzamide	ME104719	1.23	1.14	0.63
2,3-Dihydroxycyclopentaneundecanoic acid	ME104242	1.27	1.17	0.56
Pyrazinamide	ME105669	1.27	1.14	0.59
Abacavir	ME104613	1.27	0.98	0.75
Butabarbital	ME104772	1.29	0.96	0.75
N2-Acetyl-L-aminoadipate_5	ME105397	1.29	0.96	0.75
(S)-ATPA_2	ME104172	1.24	1.01	0.75
Cerulenin_2	ME104807	1.25	0.99	0.77
delta-Guanidinovaleric acid	ME104939	1.25	0.97	0.78
Stearidonic acid	ME105744	1.26	1.03	0.71
2-Amino-4-chloro-4-pentenoic acid	ME104272	1.28	1.04	0.67
erythro-3-Hydroxy-Ls-aspartate	ME105042	1.28	1.05	0.67
1-(5^-Phosphoribosyl)-5-amino-4-imidazolecarboxamide	ME104177	1.29	1.02	0.67
Mexiletine	ME105351	1.29	1.02	0.69
2,4-DB	ME104252	1.34	0.98	0.65
Dibenzothiophene_1	ME104960	1.34	1.01	0.65
Bay-K-8644	ME104715	1.31	0.97	0.72
1,3,7-Trimethyluric acid	ME104194	1.34	0.96	0.70
Zingerone_2	ME105894	1.33	0.98	0.69
Cyclopenta[cd]pyrene	ME104900	0.90	1.18	0.92
PYRIDOXAL	ME105672	0.90	1.17	0.94
1-Octanal_3	ME104222	0.87	1.20	0.93
2-Amino-5-phosphopentanoic acid	ME104277	0.87	1.18	0.94
CREATININE_2	ME104873	0.91	1.14	0.95
Ethyl 3-(N-butylacetamido)propionate_2	ME105051	0.89	1.15	0.97
Clopyralid	ME104855	0.87	1.17	0.97
N-Acetyl-D-glucosaminate	ME105407	0.87	1.15	0.97
Ureidoacrylate	ME105858	0.81	1.20	1.00
HISTAMINE	ME105163	0.81	1.24	0.95
N-Acetoxy-4-aminobiphenyl	ME105403	0.81	1.22	0.97
Maleimide	ME105314	0.83	1.21	0.96
AMCC	ME104666	0.83	1.22	0.95
(-)-Hygroline	ME104114	0.83	1.22	0.95
Levetiracetam_2	ME105259	0.97	1.17	0.86
gamma-Glutamyltyramine	ME105107	0.98	1.19	0.83
2-Hydroxymuconate semialdehyde_1	ME104306	0.98	1.18	0.84
(+)-Bornane-2,5-dione_2	ME104129	0.97	1.18	0.85
Pyridoxine_2	ME105676	0.95	1.15	0.90
Succinate_1	ME105754	0.94	1.16	0.89
2,5-Dihydroxypyridine_1	ME104257	0.98	1.14	0.89
Luteolin	ME105310	0.98	1.15	0.87
7-Hydroxy-3-(4-methoxyphenyl)-4-propyl-2H-1-benzopyran-2-one	ME104594	0.86	1.25	0.89
2-Methylpropanamine	ME104314	0.88	1.25	0.87
Acetylagmatine	ME104620	0.88	1.25	0.87
Fenoprofen	ME105072	0.91	1.23	0.88
1,3-Dichloro-2-propanol	ME104198	0.93	1.20	0.88
Furfuryl alcohol_1	ME105094	0.93	1.19	0.88
Oxidized Oplophorus luciferin	ME105547	0.78	1.31	0.91
3^-Demethylstaurosporine	ME104375	0.78	1.29	0.92
Indole-3-acetate_3	ME105197	0.78	1.29	0.93
Aniline	ME104675	0.74	1.31	0.95
2-Aminophenol_1	ME104283	0.78	1.26	0.96
D-2-Hydroxyisocaproate_2	ME104913	0.75	1.28	0.97
(-)-Menthone_1	ME104119	0.75	1.27	0.98
ortho-Anisidine	ME105536	0.80	1.36	0.84
Hydrocortisone succinate	ME105174	0.73	1.46	0.90
Wedelolactone	ME105875	0.75	1.36	0.88
D-Cathinone_1	ME104925	0.72	1.40	0.87
Deoxyribose	ME104944	0.70	1.39	0.91
2-Oxoadipate_2	ME104321	1.04	1.21	0.76
Retronecine_1	ME105689	1.05	1.20	0.75
4-Nitrophenol	ME104488	1.06	1.18	0.76
(9Z)-(7S,8S)-Dihydroxyoctadecenoic acid_2	ME104154	1.07	1.19	0.74
Caffeine	ME104786	1.10	1.19	0.71
7-Methyluric acid_2	ME104598	1.08	1.24	0.69
2-Naphthol	ME104315	1.06	1.23	0.71
Pyruvate oxime	ME105680	1.06	1.23	0.71
Acronycidine	ME104625	1.01	1.24	0.75
(Z)-But-1-ene-1,2,4-tricarboxylate	ME104175	1.00	1.28	0.72
Phosphamidon	ME105601	0.96	1.27	0.79
2-Amino-5-chlorophenol	ME104276	0.99	1.23	0.78
Diisopropyl phthalate_3	ME105000	0.99	1.20	0.81
Dihydrozeatin riboside	ME104996	0.97	1.22	0.81
p-Cymene_2	ME105563	0.98	1.22	0.80
4-Methylene-L-glutamine_1	ME104483	0.91	1.33	0.76
L-Homocitrulline_1	ME105268	0.89	1.34	0.77
2-Oxoadipate_3	ME104322	0.92	1.31	0.78
Nebularine	ME105450	0.89	1.31	0.80
cis-1,2-Dihydro-3-ethylcatechol_3	ME104827	0.87	1.29	0.84
Chlorphenesin carbamate	ME104813	0.90	1.28	0.82
Sodium salicylate	ME105735	0.92	1.28	0.80
N-Ethylmaleimide-S-glutathione	ME105455	0.88	1.41	0.71
Homocarnosine	ME105166	0.92	1.36	0.72
2-(Hydroxymethyl)-3-(acetamidomethylene)succinate	ME104236	0.95	1.34	0.72
Spermidine	ME105740	0.95	1.34	0.74
Ethyl 3-oxohexanoate_1	ME105053	0.99	1.35	0.67
N-Isopropylammelide_1	ME105480	0.94	1.40	0.66
Clavamycin E	ME104851	0.95	1.36	0.68
Sodium ortho-phenylphenate	ME105734	0.94	1.37	0.69
Buspirone_2	ME104771	1.19	1.32	0.75
Methyldopa anhydrous_2	ME105341	1.22	1.23	0.56
Methamphetamine	ME105333	1.20	1.20	0.60
Biotin sulfoxide	ME104750	1.18	1.22	0.60
Ethyl tiglate_3	ME105060	1.20	1.22	0.59
(9Z,12Z)-(8R)-Hydroxyoctadeca-9,12-dienoic acid_2	ME104156	1.15	1.23	0.62
Aniracetam	ME104676	1.15	1.22	0.64
(R)-(Homo)3-citrate_1	ME104159	1.15	1.21	0.64
Coumarin_3	ME104869	1.13	1.21	0.66
Terbutaline_2	ME105780	1.11	1.23	0.66
N-Carbamyl-L-glutamate	ME105440	1.16	1.27	0.57
Pentalenene	ME105569	1.12	1.27	0.61
4^,5,6,7-Tetramethoxyflavone	ME104428	1.12	1.31	0.52
Testololactone	ME105782	1.09	1.37	0.54
Benzofuran_2	ME104728	1.07	1.31	0.62
Diamidafos	ME104955	1.06	1.34	0.60
Mescaline_3	ME105328	1.07	1.33	0.59
1,2,3-Trihydroxybenzene_3	ME104185	1.05	1.27	0.68
Butanoic acid_2	ME104776	1.07	1.28	0.65
Pentanoate_3	ME105572	1.73	0.46	0.81
4-Bromophenylthiourea_1	ME104447	1.67	0.50	0.83
cis-3,4-Leucopelargonidin	ME104838	1.65	0.53	0.82
Phosphocreatine_1	ME105604	1.65	0.54	0.81
Apiole_4	ME104686	1.69	0.55	0.77
Tetraneurin A	ME105790	1.66	0.50	0.76
(-)-Limonene_2	ME104117	1.69	0.58	0.72
5-Acetamidopentanoate_2	ME104520	1.72	0.60	0.67
N2-Acetyl-L-aminoadipate_3	ME105395	1.71	0.60	0.70
Boc-Asn_3	ME104757	1.62	0.61	0.77
Sakuranin	ME105712	1.59	0.60	0.79
Dolichotheline	ME105019	1.65	0.61	0.70
4-Acetamidobutanoate_3	ME104436	1.65	0.62	0.73
Cumene_3	ME104884	1.63	0.63	0.74
Promacyl	ME105644	1.66	0.62	0.58
Bergaptol_2	ME104736	1.73	0.68	0.59
Isoetharine	ME105212	1.73	0.64	0.63
N-Nitrosoproline	ME105506	1.71	0.63	0.65
Thidiazuron_1	ME105795	1.63	0.74	0.59
Indolelactate_2	ME105203	1.60	0.76	0.64
Virol B	ME105872	1.62	0.76	0.62
Diethyl sulfate	ME104973	1.64	0.68	0.69
Piperazine adipate	ME105623	1.62	0.70	0.68
Dopamine_2	ME105022	1.59	0.67	0.73
Cyclohexylamine	ME104897	1.58	0.71	0.71
S-Methyl-1-thio-D-glycerate	ME105732	1.56	0.71	0.73
5-Acetylamino-6-formylamino-3-methyluracil	ME104525	1.47	0.94	0.60
Dazomet	ME104924	1.47	0.91	0.62
5^-O-beta-D-Glucosylpyridoxine	ME104565	1.44	0.99	0.60
(4Z,7Z,10Z,13Z,16Z,19Z)-Docosahexaenoic acid ethyl ester	ME104146	1.43	0.98	0.62
Clavulanic acid	ME104852	1.43	0.97	0.61
Northienamycin_1	ME105512	1.41	0.95	0.63
5-Acetylamino-6-amino-3-methyluracil_3	ME104523	1.43	0.94	0.63
Menadiol_2	ME105321	1.44	0.93	0.62
7-Methylxanthosine	ME104600	1.39	1.02	0.59
5-Aminolevulinate_3	ME104532	1.43	1.01	0.56
N-(Acetyloxy)benzenamine_3	ME105378	1.45	0.99	0.56
Cinncassiol B	ME104822	1.47	0.79	0.74
Pyridoxine_1	ME105675	1.48	0.78	0.74
Midazolam_2	ME105353	1.45	0.85	0.70
N-Heptanoylhomoserine lactone	ME105467	1.46	0.83	0.71
N-Formimino-L-aspartate	ME105460	1.50	0.79	0.71
p-Benzosemiquinone	ME105557	1.49	0.82	0.69
Phenacetin_1	ME105577	1.48	0.82	0.70
Phenylpyruvate_1	ME105598	1.54	0.80	0.66
Ethyl 3-(N-butylacetamido)propionate_3	ME105052	1.53	0.77	0.70
Dihydroaceanthrylene	ME104986	1.52	0.76	0.72
7-Ethoxycoumarin	ME104593	1.53	0.76	0.71
Carpacin_2	ME104797	1.53	0.76	0.71
D-2-Hydroxyisocaproate_3	ME104914	1.38	0.84	0.78
Pyridine	ME105671	1.39	0.83	0.78
Phenyl acetate_3	ME105588	1.38	0.82	0.80
alpha-Ionone_1	ME104650	1.37	0.83	0.79
Phenylacetaldehyde_3	ME105591	1.38	0.83	0.79
Urocanate	ME105861	1.36	0.89	0.76
Porphobilinogen_1	ME105630	1.39	0.86	0.75
N-(6-Aminohexanoyl)-6-aminohexanoate_2	ME105375	1.38	0.87	0.75
AMPA	ME104669	1.37	0.87	0.76
CREATINE	ME104871	1.37	0.87	0.76
Midazolam_1	ME105352	1.41	0.86	0.72
Zalcitabine_2	ME105892	1.42	0.86	0.72
4-Pyridoxolactone_2	ME104506	1.40	0.84	0.76
5-Nitro-ortho-anisidine_2	ME104561	1.41	0.85	0.75
Midodrine_2	ME105355	1.41	0.84	0.74
N-Cyclohexylformamide_2	ME105442	1.47	0.87	0.66
2-Dimethylamino-5,6-dimethylpyrimidin-4-ol	ME104287	1.41	0.92	0.67
5-Acetylamino-6-amino-3-methyluracil_2	ME104522	1.41	0.93	0.66
N,N^-Dimethylurea	ME105386	1.39	0.95	0.67
S-(2-Chloroacetyl)glutathione	ME105701	1.40	0.96	0.65
Propofol	ME105649	1.36	0.92	0.72
L-Proline	ME105298	1.38	0.90	0.72
5-(3-Hydroxy-4-acetoxybut-1-ynyl)-2,2^-bithiophene	ME104512	1.38	0.91	0.71
Pentobarbital_2	ME105574	1.37	0.91	0.71
Benzo[b]naphtho[2,1-d]thiophene_2	ME104724	1.42	0.89	0.69
Nevirapine_1	ME105457	1.42	0.89	0.69
Nonanoic acid_2	ME105511	1.39	0.90	0.69
4-Hydroxymandelonitrile	ME104473	1.40	0.90	0.70
Biotin sulfone	ME104749	1.40	0.91	0.69
Butopyronoxyl	ME104782	1.37	0.67	0.96
Furfuryl alcohol_2	ME105095	1.36	0.72	0.92
Menadiol_1	ME105320	1.38	0.70	0.92
Biphenyl-2,3-diol	ME104751	1.40	0.66	0.94
Dianthalexin	ME104956	1.41	0.67	0.92
L-Glutamate	ME105263	1.43	0.65	0.92
N-Formylmethionine_1	ME105464	1.44	0.66	0.90
Centarol	ME104805	1.44	0.68	0.87
2-Aminophenol_2	ME104284	1.42	0.69	0.89
Vermelone_2	ME105868	1.43	0.68	0.89
N-Benzyloxycarbonylglycine	ME105436	1.43	0.71	0.86
Resveratrol_2	ME105686	1.45	0.70	0.84
Autumnolide	ME104705	1.36	0.81	0.83
Tebuconazole_1	ME105775	1.36	0.80	0.85
Streptobiosamine_1	ME105746	1.32	0.82	0.86
2-Maleylacetate	ME104311	1.34	0.80	0.86
cis-2,3-Dihydroxy-2,3-dihydro-p-cumate	ME104834	1.33	0.80	0.87
Dopaquinone_1	ME105023	1.40	0.73	0.88
Cuauhtemone_2	ME104878	1.37	0.78	0.85
alpha-N-Acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine	ME104654	1.37	0.76	0.87
2-Oxosuberate_1	ME104330	1.35	0.78	0.87
Podocarpic acid	ME105627	1.36	0.77	0.87
Toluene_1	ME105809	1.36	0.77	0.87
2,3-Dimethylmaleate_2	ME104247	1.34	0.74	0.91
Protoporphyrinogen IX	ME105657	1.35	0.74	0.91
2,4-DP	ME104256	1.35	0.76	0.89
Encecalin	ME105036	1.36	0.74	0.90
alpha-Santonin	ME104659	1.37	0.75	0.89
Abscisate	ME104614	1.36	0.75	0.89
Propyl cinnamate_2	ME105651	1.36	0.75	0.89
Oseltamivir	ME105539	1.47	0.72	0.80
Lophophorine	ME105293	1.44	0.77	0.79
Tebuconazole_2	ME105776	1.46	0.75	0.78
Menadiol_3	ME105322	1.43	0.75	0.82
N-Acetyl-L-glutamate_2	ME105414	1.43	0.74	0.84
Deoxycytidine	ME104943	1.40	0.76	0.83
Isoflurophate_1	ME105215	1.41	0.78	0.81
3^^-Hydroxy-geranylhydroquinone	ME104386	1.39	0.80	0.81
Indole-5,6-quinone_1	ME105198	1.39	0.79	0.82
PUTRESCINE	ME105663	1.39	0.78	0.82
Dihydroxycarbazepine	ME104994	1.52	0.53	0.87
4-Nitrocatechol	ME104487	1.56	0.50	0.91
4-Hydroxyphenylacetate_2	ME104476	1.54	0.54	0.91
Sinapyl alcohol	ME105730	1.56	0.53	0.91
N-(Acetyloxy)benzenamine_4	ME105379	1.60	0.49	0.90
N-Methylhexanamide_2	ME105494	1.61	0.51	0.87
Atheroline	ME104702	1.59	0.54	0.87
Bisthiosemi	ME104754	1.61	0.54	0.85
Prosulfocarb	ME105653	1.48	0.56	0.96
D-Alanyl-D-alanine_1	ME104916	1.45	0.60	0.95
Omethoate	ME105529	1.44	0.60	0.96
Carpacin_1	ME104796	1.54	0.67	0.80
Mallotophenone	ME105315	1.55	0.64	0.81
Miotine_1	ME105356	1.52	0.70	0.78
Precocene II_2	ME105635	1.51	0.68	0.81
2-Hydroxymethylclavam	ME104305	1.52	0.58	0.90
Myriocin_1	ME105364	1.52	0.60	0.88
L-Adrenaline_2	ME105240	1.47	0.63	0.90
2-Hydroxyethylphosphonate	ME104302	1.48	0.64	0.88
cis-2-Carboxycyclohexyl-acetic acid_1	ME104835	1.47	0.64	0.88
gamma-Glutamyl-gamma-aminobutyraldehyde_1	ME105105	1.52	0.63	0.86
L-Tyrosine methyl ester_1	ME105305	1.49	0.66	0.85
Myristoleic acid_2	ME105367	1.49	0.66	0.86
Cetraxate	ME104808	1.40	1.25	0.41
4-Bromophenylthiourea_2	ME104448	1.33	1.21	0.48
5-Amino-4-imidazolecarboxyamide_2	ME104528	1.32	1.21	0.47
Bz-Arg-OEt	ME104783	1.35	1.37	0.38
gamma-L-Glutamyl-L-cysteinyl-beta-alanine	ME105109	1.21	1.31	0.48
Methyl farnesoate_2	ME105339	1.28	1.31	0.42
Spectinomycin dihydrochloride	ME105738	1.55	1.09	0.44
3,5-Dichloro-4-hydroxyphenylpyruvate	ME104359	1.48	1.01	0.39
Tranylcypromine	ME105825	1.53	1.01	0.45
Resveratrol_1	ME105685	1.40	1.08	0.51
5-Amino-6-(5^-phosphoribosylamino)uracil	ME104529	1.45	1.16	0.47
Coenzyme B	ME104858	1.48	1.16	0.37
Netilmicin	ME105456	1.47	1.11	0.42
L-Histidinol	ME105267	1.57	1.13	0.30
alpha-[3-(Nitrosoamino)propyl]-3-pyridinemethanol	ME104644	1.54	1.25	0.21
p-Xylene_3	ME105666	1.50	1.27	0.22
L-2-Amino-4-(hydroxymethylphosphinyl)butanoate	ME105237	1.74	1.03	0.22
L-Lysinamide	ME105283	1.84	0.93	0.18
Jatrophatrione	ME105232	1.62	0.93	0.44
3-Fluoro-D-alanine	ME104383	1.54	0.95	0.51
Dihydrolipoate	ME104992	1.55	0.90	0.55
2-Hydroxy-1,4-benzoquinone_1	ME104295	1.60	0.88	0.53
N-Isopropylammelide_3	ME105482	1.59	0.92	0.50
Coumarin_1	ME104867	1.57	0.84	0.59
4-Methylene-L-glutamine_2	ME104484	1.64	0.84	0.52
Coumestrol	ME104870	1.63	0.84	0.53
4-Amino-2-hydroxylamino-6-nitrotoluene	ME104439	1.77	0.77	0.36
Barbiturate	ME104714	1.69	0.86	0.45
L-Kynurenine	ME105279	1.71	0.81	0.48
Phenacetin_2	ME105578	1.73	0.83	0.44
Dichlozoline	ME104967	1.70	0.95	0.39
4-Acetamidobutanoate_2	ME104435	1.71	0.90	0.39
2-Hydroxy-1,4-benzoquinone_2	ME104296	1.74	0.88	0.38
Ascorbate	ME104695	1.73	0.91	0.36
5-Nitro-ortho-anisidine_4	ME104563	1.81	0.84	0.35
cis-4-Carboxymethylenebut-2-en-4-olide_1	ME104839	1.78	0.90	0.32
Amphetamine	ME104670	0.25	0.99	1.76
Glycerol_2	ME105130	0.42	0.94	1.90
6-Demethylsterigmatocystin	ME104578	0.43	0.64	1.89
Chlortetracycline	ME104814	0.43	0.76	1.80
Apraclonidine	ME104687	0.50	0.71	1.79
Urate_2	ME105856	0.48	0.74	1.78
N-Vinyl-2-pyrrolidone_2	ME105522	0.59	0.61	1.80
1-Phenylethylamine	ME104225	0.65	0.58	1.77
3alpha,7alpha-Dihydroxy-12-oxo-5beta-cholanate_2	ME104365	0.67	0.54	1.80
Succinimide	ME105758	0.71	0.64	1.66
2-Hydroxymuconate semialdehyde_2	ME104307	0.76	0.54	1.70
2-Pyridyl hydroxymethane sulfonic acid_2	ME104333	0.71	0.55	1.74
D-2-Hydroxyisocaproate_1	ME104912	0.70	0.59	1.71
Homogentisate_1	ME105167	0.73	0.39	1.87
Lichenin_2	ME105271	0.71	0.46	1.83
10-Hydroxydecanoic acid	ME104203	0.67	0.47	1.84
D-Cathinone_2	ME104926	0.67	0.49	1.84
Isopentenyl diphosphate_2	ME105218	0.57	0.42	1.81
N-Sulfo-D-glucosamine_2	ME105517	0.62	0.52	1.86
Thiobenzamide S,S-dioxide	ME105797	0.60	0.52	1.89
3-Methyleneoxindole_1	ME104406	0.57	0.49	1.94
Methyldopa anhydrous_3	ME105342	0.57	0.49	1.94
N-(Acetyloxy)benzenamine_1	ME105376	0.60	0.47	1.93
Orcinol_2	ME105534	0.60	0.47	1.94
Chrysoeriol_1	ME104817	0.92	0.09	1.65
Danielone	ME104920	1.02	0.15	1.83
Dihydrobiopterin_2	ME104988	1.06	0.15	1.79
Propynoate	ME105652	0.99	0.52	1.49
(R)-2,3-Dihydroxypropane-1-sulfonate	ME104161	0.99	0.51	1.50
Procarbazine	ME105639	0.89	0.54	1.56
3-Mercaptolactate	ME104393	0.92	0.53	1.54
Cyclamate	ME104890	0.93	0.55	1.52
Cefepime	ME104804	1.08	0.30	1.66
alpha-Curcumene_2	ME104647	0.94	0.41	1.64
Taurine	ME105772	0.95	0.42	1.63
N2-Acetyl-L-aminoadipate_4	ME105396	0.97	0.47	1.56
3,9-Dihydroxypterocarpan	ME104360	0.96	0.43	1.57
Diethylene glycol_5	ME104978	0.96	0.44	1.60
Homogentisate_2	ME105168	0.98	0.36	1.66
Angelicin	ME104674	1.01	0.33	1.57
M1	ME105312	1.03	0.37	1.60
1-(5^-Phosphoribosyl)-5-formamido-4-imidazolecarboxamide	ME104178	0.88	0.38	1.74
Fenpiclonil	ME105073	0.89	0.41	1.70
Choline phosphate	ME104816	0.83	0.41	1.76
3-Isopropylcatechol	ME104392	0.84	0.44	1.72
4-Heptyloxyphenol_4	ME104462	0.83	0.45	1.72
2-(2^-Methylthio)ethylmalic acid	ME104229	0.83	0.49	1.67
Pyruvate_2	ME105679	0.80	0.52	1.67
Pregnan-21-al	ME105636	0.76	0.45	1.72
Cyclosulfamuron	ME104905	0.78	0.50	1.72
3-Methyl-2-oxobutanoic acid_2	ME104400	0.79	0.47	1.74
5-Nitro-ortho-anisidine_5	ME104564	0.76	0.48	1.76
8-Amino-7-oxononanoate_6	ME104607	0.90	0.31	1.79
Radium-226	ME105683	0.94	0.30	1.75
7-Aminocephalosporanic acid	ME104590	0.83	0.28	1.84
2,4-Dinitrotoluene	ME104255	0.83	0.35	1.82
2-Amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole	ME104275	0.79	0.37	1.84
1-(Methylnitrosoamino)-4-(3-pyridinyl)-1,4-butanediol_2	ME104181	0.99	0.65	1.35
Coniferyl alcohol_4	ME104863	1.03	0.62	1.35
Genipin_1	ME105115	1.01	0.62	1.37
(S)-beta-Methylindolepyruvate	ME104173	1.00	0.62	1.38
2-Oxo-8-methylthiooctanoic acid	ME104319	1.00	0.59	1.40
3-(2-Hydroxyphenyl)propanoate_3	ME104340	0.99	0.61	1.41
3-Dimethylallyl-4-hydroxymandelic acid	ME104376	0.95	0.64	1.42
Chlorfenac	ME104809	0.97	0.63	1.40
2-Methyl-4-chlorophenoxybutyric acid	ME104313	1.09	0.62	1.29
3-Nitrofluoranthene	ME104412	1.06	0.62	1.32
8-Amino-7-oxononanoate_3	ME104604	1.06	0.64	1.30
N-Feruloylglycine	ME105459	1.06	0.64	1.29
(R)-(Homo)3-citrate_2	ME104160	1.04	0.58	1.38
4-Nitrosobiphenyl	ME104490	1.07	0.58	1.35
Ethionine_2	ME105047	1.05	0.60	1.35
2,3-Dehydro-UWM6	ME104240	1.16	0.54	1.50
3,4-Dihydroxy-L-phenylalanine	ME104352	1.15	0.49	1.36
Isobutyronitrile_2	ME105210	1.10	0.49	1.41
4-Amino-4-deoxychorismate_1	ME104440	1.06	0.51	1.43
alpha-Oxo-benzeneacetic acid_1	ME104655	1.05	0.53	1.42
1-Aminocyclopropane-1-carboxylate_2	ME104216	0.92	0.70	1.38
3-Ethoxyandrosta-3,5-dien-17beta-ol propanoate	ME104377	0.91	0.68	1.41
Furmecyclox_1	ME105097	0.86	0.66	1.46
Carisoprodol	ME104795	0.88	0.67	1.42
Isovalerylcarnitine	ME105226	0.88	0.67	1.44
1^-Acetoxychavicol acetate_1	ME104213	0.81	0.62	1.57
Butanal_1	ME104773	0.78	0.72	1.50
Gemfibrozil_3	ME105113	0.84	0.66	1.50
Suberic acid_2	ME105753	0.82	0.67	1.51
2-Amino-4-oxo-6-(1^,2^,3^-trihydroxypropyl)-diquinoid-7,8-dihydroxypterin	ME104274	0.86	0.88	1.26
N-D-Glucosylarylamine_2	ME105447	0.88	0.83	1.30
3-Methyl-19-nor-17alpha-pregna-1,3,5(10)-trien-17-ol	ME104398	0.86	0.84	1.30
(3S,5S)-Carbapenam-3-carboxylic acid_3	ME104145	0.85	0.84	1.32
MTIC	ME105361	0.90	0.81	1.29
Wyerone	ME105878	0.89	0.83	1.26
2-trans,6-trans-Farnesal_3	ME104337	0.91	0.75	1.34
3-(4-Hydroxyphenyl)lactate	ME104343	0.88	0.78	1.34
2,5-Furandicarboxylate_2	ME104262	0.88	0.76	1.36
6-endo-Hydroxycineole_2	ME104581	0.89	0.77	1.35
Isoflurophate_2	ME105216	0.98	0.71	1.31
(-)-Carvone	ME104113	0.93	0.79	1.28
Toluene-cis-dihydrodiol_3	ME105813	0.94	0.77	1.29
Isoprothiolane	ME105220	0.96	0.73	1.30
beta-Carboline_2	ME104740	0.94	0.74	1.31
2-Oxobutanoate_2	ME104324	0.94	0.75	1.31
N2^-Acetylgentamicin C1a	ME105392	0.94	0.75	1.31
Bufadienolide	ME104767	0.81	0.78	1.41
N-Formyl-4-amino-5-aminomethyl-2-methylpyrimidine	ME105462	0.81	0.76	1.43
beta-Carboline_1	ME104739	0.80	0.90	1.30
Dasytrichone	ME104923	0.80	0.90	1.28
3-Sulfocatechol	ME104418	0.81	0.84	1.35
Yersiniabactin_2	ME105890	0.81	0.85	1.34
2-Hydroxycyclohexan-1-one_3	ME104301	0.80	0.81	1.39
Aspulvinone E	ME104700	0.83	0.81	1.36
4-Ketocyclophosphamide	ME104480	0.74	0.87	1.39
8-Oxoguanine	ME104608	0.76	0.89	1.35
Indanofan	ME105189	0.78	0.87	1.35
N-Methylpelletierine_2	ME105496	0.59	0.71	1.69
(7R)-7-(5-Carboxy-5-oxopentanoyl)aminocephalosporinate	ME104150	0.63	0.81	1.56
3,3^-Dimethoxybenzidine-4,4^-diisocyanate	ME104350	0.73	0.71	1.56
Formetanate	ME105082	0.70	0.74	1.55
N-Acetylmethionine_2	ME105426	0.67	0.74	1.59
Phthalate_2	ME105609	0.64	0.73	1.63
5-Methylcytosine_2	ME104555	0.48	0.92	1.60
Naringenin 7-O-beta-D-glucoside	ME105435	0.53	1.13	1.51
Naringenin	ME105434	0.52	1.02	1.47
Shikimate_2	ME105729	0.49	1.05	1.46
Hesperetin	ME105155	0.56	0.92	1.43
1,2-Dihydrosantonin_2	ME104191	0.55	0.93	1.52
Dihydrokaempferol	ME104991	0.54	0.96	1.50
3-Methoxybenzyl alcohol_3	ME104396	0.65	0.94	1.41
Thiorphan	ME105799	0.63	0.97	1.40
N-Methylaniline	ME105491	0.65	0.86	1.49
N-Methylpelletierine_1	ME105495	0.65	0.86	1.43
n-Decanohydroxamic acid_2	ME105445	0.23	1.69	1.45
1,3,8-Naphthalenertriol_2	ME104196	0.63	1.27	1.10
Apiole_1	ME104683	0.61	1.33	1.06
DCI	ME104928	0.57	1.34	1.06
(R)-Mevalonate_2	ME104165	0.55	1.11	1.34
D-SORBITOL	ME105027	0.62	1.19	1.20
n-Decanohydroxamic acid_1	ME105444	0.57	1.20	1.26
D-Cathinone_3	ME104927	0.39	1.52	1.09
L-Urobilin	ME105309	0.46	1.29	1.23
Isoscoparine	ME105223	0.42	1.41	1.36
(+)-Norephedrine_2	ME104135	0.35	1.42	1.22
Ibuprofen	ME105180	0.31	1.37	1.32
(-)-Vestitone_1	ME104126	0.30	1.30	1.27
trans,trans-Farnesyl phosphate	ME105820	0.09	2.19	0.97
4-Hydroxybutanoic acid_1	ME104471	0.39	1.79	0.82
Diethylene glycol_4	ME104977	0.46	1.77	0.78
Guanadrel	ME105140	0.35	1.80	1.01
3-Hydroxy-L-glutamate	ME104391	0.30	1.80	0.91
Cinnamaldehyde_2	ME104821	0.30	1.83	0.87
D-2-Hydroxyisocaproate_4	ME104915	0.25	2.06	0.62
Liriodenine	ME105278	0.36	2.07	0.60
Benzene_2	ME104721	0.25	1.97	0.78
Indan-1-ol_2	ME105188	0.34	1.96	0.70
Ferrous lactate_2	ME105075	0.36	1.92	0.79
Piperidione_2	ME105625	0.38	1.89	0.73
3,4-Dihydroxy-3,4-dihydro-9-fluorenone	ME104351	0.98	1.94	0.08
Furmecyclox_2	ME105098	0.79	2.09	0.05
Gliotoxin	ME105125	0.93	2.21	0.20
Miotine_2	ME105357	0.43	2.21	0.30
Dihydrozeatin-O-glucoside	ME104997	0.46	2.21	0.33
1-(Methylnitrosoamino)-4-(3-pyridinyl)-1,4-butanediol_1	ME104180	0.42	2.23	0.34
4-Amino-5-hydroxymethyl-2-methylpyrimidine_1	ME104443	0.43	2.23	0.34
Debromoaplysiatoxin	ME104929	0.52	1.99	0.12
Cinnamaldehyde_1	ME104820	0.60	2.05	0.35
Pyridoxine_3	ME105677	0.59	2.10	0.31
N-Acetyl-L-histidine_2	ME105419	0.64	1.95	0.41
2,4-Bis(acetamido)-2,4,6-trideoxy-beta-L-altropyranose_2	ME104251	0.61	1.94	0.45
Bufferin	ME104768	0.61	1.90	0.45
Ancymidol	ME104672	0.77	1.95	0.33
Homogentisate_3	ME105169	0.69	1.92	0.38
Pantothenol	ME105552	0.69	1.94	0.32
4-Oxocyclohexanecarboxylate_4	ME104495	0.48	1.84	0.68
Iprovalicarb	ME105207	0.51	1.85	0.69
cis-4-Carboxymethylenebut-2-en-4-olide_3	ME104841	0.52	1.85	0.64
Linuron	ME105276	0.54	1.81	0.65
Rhein	ME105692	0.59	1.70	0.70
Faropenem sodium_1	ME105067	0.59	1.75	0.65
(R)-Mevalonate_1	ME104164	0.61	1.73	0.66
L-Cladinose_2	ME105253	0.59	1.83	0.58
Iminoglycine_2	ME105186	0.69	1.83	0.48
Boc-Asn_2	ME104756	0.67	1.82	0.51
Heliotrine_1	ME105150	0.67	1.85	0.53
Propane-1,2-diol	ME105645	0.82	1.71	0.60
Bendiocarb_3	ME104718	0.76	1.71	0.53
1,3,8-Naphthalenertriol_3	ME104197	0.75	1.75	0.50
4-Nitrophenyl-3-ketovalidamine	ME104489	0.73	1.77	0.51
(6Z,9Z,12Z)-Octadecatrienoic acid	ME104149	0.94	1.51	0.55
7-Hydroxymethyl-12-methylbenz[a]anthracene sulfate	ME104595	0.93	1.52	0.55
CITRAMALATE	ME104846	0.97	1.52	0.51
Scytalone_3	ME105721	0.98	1.50	0.52
HC Blue No.1	ME105149	0.89	1.60	0.52
Mukaadial	ME105362	0.94	1.59	0.47
Dibenzothiophene_2	ME104961	0.77	1.59	0.65
N(alpha)-Benzyloxycarbonyl-L-leucine_2	ME105381	0.69	1.61	0.70
CB3717	ME104802	0.93	1.45	0.64
12-Hydroxydodecanoic acid_2	ME104211	0.87	1.55	0.64
Archangelicin	ME104690	0.87	1.50	0.63
Tabtoxin	ME105769	0.91	1.49	0.61
(+)-Norephedrine_1	ME104134	0.83	1.44	0.74
2-Ethylhexyl phthalate_4	ME104291	0.80	1.46	0.74
Ephedrine	ME105037	0.78	1.46	0.76
8-Amino-7-oxononanoate_2	ME104603	0.78	1.52	0.70
2,5-Dioxopentanoate_2	ME104260	0.83	1.48	0.68
Boc-Asn_1	ME104755	0.84	1.48	0.68
Austrobailignan 1	ME104704	0.63	1.83	0.94
Isouron	ME105225	0.62	1.48	0.97
Corticosterone_2	ME104866	0.58	1.53	0.89
S-Allyl-L-cysteine_1	ME105713	0.55	1.53	0.92
Asulam	ME104701	0.56	1.60	0.81
N-D-Glucosylarylamine_1	ME105446	0.63	1.52	0.85
L-2,3-Dihydrodipicolinate	ME105236	0.65	1.58	0.77
Terbutaline_1	ME105779	0.65	1.55	0.80
Butoctamide hydrogen succinate_2	ME104780	0.71	1.52	0.77
N6-Acetyl-N6-hydroxy-L-lysine	ME105400	0.67	1.51	0.80
Tropine_1	ME105838	1.13	1.48	0.39
Forchlorfenuron_2	ME105081	1.25	1.54	0.23
Allidochlor_2	ME104641	1.24	1.49	0.27
N-Caffeoylputrescine	ME105438	1.26	1.48	0.27
DAMGO	ME104919	1.03	1.75	0.31
Retronecine_3	ME105691	1.04	1.64	0.32
Isopentenyl diphosphate_3	ME105219	0.87	1.70	0.43
m-Chlorophenylpiperazine	ME105317	0.89	1.71	0.40
N-Acetylornithine_1	ME105429	0.88	1.72	0.40
(15S)-15-Hydroxy-5,8,11-cis-13-trans-eicosatetraenoate	ME104137	0.86	1.89	0.30
N-Hydroxy-4-aminobiphenyl	ME105468	0.81	1.83	0.35
S-Succinyldihydrolipoamide	ME105743	0.03	4.90	0.02
Zinnimidine_3	ME105898	0.02	3.93	0.03
Biochanin A	ME104746	0.04	3.52	0.25
D-Urobilinogen_2	ME105031	0.01	3.46	0.02
Metoprolol	ME105349	0.00	1.83	0.00
Meperidine	ME105325	0.20	2.99	0.03
Acyclovir	ME104629	0.00	2.75	0.00
Amabiline_2	ME104665	0.00	3.00	0.00
Codonopsine	ME104857	0.02	2.98	0.00
Annuloline	ME104678	0.06	2.91	0.03
Tussilagine_2	ME105846	0.02	2.93	0.05
Tussilagine_3	ME105847	0.07	2.84	0.09
Digitalose	ME104981	0.02	2.90	0.09
Pimelate_6	ME105620	0.01	2.85	0.08
Nitrovin	ME105487	0.33	2.24	0.07
D-Urobilin_2	ME105029	0.03	2.37	0.12
NBMPR	ME105437	0.15	2.31	0.09
DMPP	ME105013	0.21	2.38	0.41
Acanthicifoline	ME104616	0.18	2.36	0.64
Dihydro-O-methylsterigmatocystin	ME104993	0.09	2.43	0.51
D-Urobilin_1	ME105028	0.04	2.32	0.58
Nupharamine	ME105520	0.40	2.63	0.04
Bakankoside	ME104709	0.35	2.61	0.27
Methylripariochromene A	ME105346	0.32	2.47	0.21
4-(beta-Acetylaminoethyl)imidazole_2	ME104425	0.21	2.53	0.26
4-Amino-5-hydroxymethyl-2-methylpyrimidine_3	ME104445	0.25	2.51	0.24
Isoflavone	ME105214	0.27	2.50	0.28
5-Hydroxyindolepyruvate	ME104544	0.19	2.72	0.31
3-Hydroxyhexobarbital_2	ME104388	0.24	2.59	0.40
Tebuconazole_3	ME105777	0.14	2.61	0.48

Factors:

F1	Treatment :Baseline urine
F2	Treatment :Urine after drinking apple juice
F3	Treatment :Urine after drinking cranberry juice

Data matrix