Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST004204)

Reversed phase POSITIVE ION MODE (Analysis AN006990)

Metabolite	Structure	F1	F2	F3
5-cyano-3,4-dimethylthiophene-2-carboxamide	ME1135156	0.01	0.01	4.98
Adenosine 3^5^-cyclic monophosphate	ME1135127	0.02	0.02	4.90
Pyridoxamine	ME1135612	0.07	0.07	4.72
Bafilomycin B1	ME1135157	0.04	0.08	4.72
Estrone	ME1135605	0.05	0.08	4.73
Gamma-Glu-Leu	ME1135604	0.06	0.07	4.73
RNK	ME1135210	0.08	0.08	4.68
4-Hydroxypropranolol	ME1135207	0.06	0.08	4.69
Tacrolimus	ME1135143	0.06	0.08	4.70
YLH	ME1135562	0.03	0.05	4.83
Guanosine monophosphate	ME1135202	0.05	0.05	4.79
TKK	ME1135183	0.07	0.05	4.77
Mirtazapine-d3	ME1135176	0.16	0.11	4.50
N8-Acetylspermidine	ME1135101	0.11	0.13	4.52
Guanosine 3^,5^-cyclic monophosphate	ME1135452	0.05	0.12	4.60
HET0016	ME1135147	0.10	0.10	4.61
MJN110	ME1135178	0.11	0.11	4.57
6-(Methylthio)purine	ME1135231	0.07	0.20	4.39
Cytidine-5^-monophosphate	ME1135657	0.15	0.15	4.42
DLK	ME1135200	0.18	0.16	4.34
NKK	ME1135316	0.16	0.16	4.37
L-Ornithine	ME1135643	0.14	0.18	4.34
MMK	ME1135300	0.15	0.17	4.35
DL-Arginine	ME1135130	0.04	0.28	4.20
TLK	ME1135293	0.18	0.18	4.27
KPH	ME1135299	0.11	0.22	4.25
Milbemycin A4 oxime	ME1135180	0.14	0.23	4.19
(5-L-Glutamyl)-L-Amino Acid	ME1135636	0.15	0.27	4.08
6 β-Hydroxycortisol	ME1135225	0.15	0.26	4.11
WLK	ME1135254	0.22	0.22	4.12
APK	ME1135328	0.21	0.21	4.16
EQH	ME1135309	0.21	0.21	4.16
7-methyl-3-nitroimidazo[1,2-a]pyridine	ME1135249	0.19	0.21	4.19
QLH	ME1135381	0.20	0.21	4.18
Pipecolic acid	ME1135125	0.05	0.37	3.93
EKK	ME1135320	0.27	0.22	4.05
SKK	ME1135289	0.25	0.22	4.07
O-7460	ME1135203	0.28	0.25	3.97
3-hydroxy-2-(3-nitro-4-piperidinobenzyl)propanenitrile	ME1135341	0.23	0.28	3.95
Cytidine 5^-Monophosphate-N-Acetylneuraminic Acid	ME1135651	0.26	0.26	3.95
L-Histidine	ME1135129	0.25	0.26	3.97
L-Saccharopine	ME1135140	0.24	0.27	3.97
RLK	ME1135296	0.24	0.25	4.02
Tauroursodeoxycholic acid	ME1135609	0.26	0.24	4.02
HLK	ME1135313	0.19	0.28	4.01
Prostaglandin F2α-1-glyceryl ester	ME1135218	0.22	0.26	4.00
THJ2201 N-pentanoic acid metabolite	ME1135302	0.21	0.26	4.02
ELK	ME1135412	0.31	0.32	3.73
L-Cysteine-glutathione gisulfide	ME1135652	0.31	0.32	3.73
L-cysteine	ME1135622	0.25	0.33	3.78
2-[3-(trifluoromethyl)-1H-pyrazol-1-yl]-4H-chromen-4-one	ME1135284	0.28	0.32	3.76
3,3-dimethyl-5-oxo-5-[(3-phenyl-1H-pyrazol-5-yl)amino]pentanoic acid	ME1135362	0.27	0.32	3.78
Guanine	ME1135124	0.36	0.28	3.79
Dutasteride	ME1135205	0.26	0.30	3.84
RLH	ME1135206	0.32	0.28	3.83
KNK	ME1135314	0.30	0.30	3.82
Phenyl[(3S)-3-(5-propyl-1,3,4-oxadiazol-2-yl)-1-pyrrolidinyl]methanone	ME1135356	0.29	0.29	3.83
4-{4-[(4-chlorophenyl)thio]-3-nitrophenyl}-2-methyl-1,3-thiazole	ME1135191	0.24	0.29	3.92
Cys-Gly	ME1135634	0.27	0.27	3.91
L-Carnitine	ME1135650	0.28	0.27	3.92
Virginiamycin	ME1135373	0.28	0.28	3.87
TNK	ME1135269	0.26	0.29	3.89
YNK	ME1135307	0.25	0.29	3.89
D-Glucosamine	ME1135135	0.18	0.33	3.88
Minocycline	ME1135606	0.21	0.33	3.83
TMK	ME1135162	0.06	0.66	3.17
N-α-L-Acetyl-arginine	ME1135274	0.10	0.70	2.99
PQH	ME1135272	0.19	0.65	3.02
Gly-Tyr	ME1135623	0.56	0.37	3.27
DL-Lysine	ME1135089	0.30	0.47	3.36
YLK	ME1135264	0.48	0.42	3.25
D-Ala-D-Ala	ME1135262	0.42	0.44	3.26
NNK	ME1135338	0.40	0.43	3.32
RQH	ME1135270	0.41	0.42	3.32
YKK	ME1135215	0.40	0.44	3.30
L-Cystine	ME1135113	0.41	0.43	3.29
D-Xylonic Acid	ME1135350	0.42	0.43	3.30
HNK	ME1135403	0.43	0.43	3.29
Kanosamine	ME1135371	0.27	0.56	3.14
3-(3,4-dihydroxyphenyl)propanoic acid	ME1135155	0.25	0.55	3.19
Biopterin	ME1135451	0.29	0.53	3.20
D-(-)-Glutamine	ME1135136	0.36	0.51	3.15
Lidocaine N-oxide	ME1135333	0.33	0.52	3.16
Enalaprilat	ME1135377	0.38	0.48	3.22
YPH	ME1135364	0.35	0.50	3.20
N1-[2-oxo-6-(1H-pyrrol-1-yl)-2H-chromen-3-yl]acetamide	ME1135308	0.32	0.56	3.08
Phenytoin	ME1135399	0.43	0.51	3.06
DL-Citrulline	ME1135665	0.38	0.55	3.04
L-Alanyl-L-Lysine	ME1135677	0.41	0.54	3.02
N-acetyl-D-glucosamine	ME1135672	0.40	0.53	3.04
Υ-L-Glutamyl-L-glutamic acid	ME1135212	0.47	0.46	3.15
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(propan-2-yloxy)oxane-3,4,5-triol	ME1135245	0.53	0.46	3.07
LQH	ME1135374	0.47	0.50	3.04
Thr-Leu	ME1135631	0.49	0.49	3.05
Glu-Val-Phe	ME1135281	0.54	0.30	3.47
HKK	ME1135361	0.41	0.32	3.59
1-(3-phenylpropanoyl)-4-piperidinecarboxylic acid	ME1135366	0.33	0.36	3.59
Deoxycorticosterone 21-glucoside	ME1135280	0.33	0.34	3.66
10-Nitrolinoleate	ME1135500	0.30	0.35	3.66
SMK	ME1135358	0.30	0.35	3.68
L-Glutathione (reduced)	ME1135137	0.17	0.45	3.57
Pilocarpine	ME1135209	0.24	0.43	3.53
Milbemycin A3 oxime	ME1135252	0.38	0.42	3.38
2-Benzyl-5-[(3S)-1-isopropyl-3-pyrrolidinyl]-1,3,4-oxadiazole	ME1135391	0.38	0.40	3.42
Lobeline	ME1135437	0.36	0.41	3.42
1,2-di(3,4-dimethoxyphenyl)diaz-1-ene	ME1135422	0.38	0.39	3.46
Folic acid	ME1135661	0.39	0.37	3.49
PLH	ME1135263	0.39	0.37	3.49
2-(2-amino-3-methylbutanamido)-3-phenylpropanoic acid	ME1135305	0.41	0.35	3.53
SLK	ME1135226	0.37	0.37	3.53
Meperidine-d5	ME1135247	0.28	0.44	3.46
Angiotensin IV	ME1135370	0.34	0.39	3.50
S-(Methyl)Glutathione	ME1135627	0.32	0.41	3.49
Phe-Phe	ME1135187	0.33	0.42	3.45
Resiniferatoxin	ME1135238	0.34	0.40	3.47
FNK	ME1135447	0.91	0.55	2.31
Indole-3-acetic acid	ME1135119	0.84	0.61	2.27
EMK	ME1135336	0.81	0.55	2.45
5-Methyl-2^-deoxycytidine	ME1135529	0.70	0.61	2.44
Diflorasone	ME1135255	0.70	0.62	2.42
8-Isoprostaglandin F1β	ME1135251	0.44	0.80	2.28
Deoxycytidine	ME1135549	0.65	0.67	2.36
1-[(3,5-dimethylisoxazol-4-yl)sulfonyl]piperidine	ME1135415	0.65	0.69	2.30
N-METHYL (-)EPHEDRINE	ME1135667	0.65	0.69	2.29
8,8-dimethyl-2-phenyl-4H,8H-pyrano[2,3-h]chromen-4-one	ME1135420	0.64	0.69	2.32
AKB48 N-(4-fluorobenzyl) analog	ME1135429	0.63	0.69	2.33
L-Norleucine	ME1135088	0.56	0.73	2.31
PPK	ME1135216	0.56	0.68	2.43
Physostigmine	ME1135380	0.56	0.71	2.36
WLH	ME1135351	0.56	0.70	2.39
4-oxo-4-[(1-phenylethyl)amino]but-2-enoic acid	ME1135439	0.72	0.66	2.28
ANK	ME1135277	0.76	0.65	2.26
Lysope 14:0	ME1135421	0.58	0.78	2.16
Valine	ME1135151	0.59	0.75	2.21
J147	ME1135494	0.71	0.70	2.17
7-Methylguanine	ME1135432	0.69	0.72	2.15
Bilirubin	ME1135398	0.70	0.72	2.15
1-Methylhistidine	ME1135577	0.69	0.71	2.17
UMP	ME1135688	0.68	0.72	2.18
Benzamide	ME1135510	0.68	0.69	2.26
N-Acetyl-L-histidine	ME1135632	0.63	0.73	2.22
TLH	ME1135325	0.66	0.71	2.23
11-Ketoetiocholanolone	ME1135694	0.78	0.40	2.90
Asp-Glu	ME1135639	0.74	0.40	2.95
ALK	ME1135520	0.45	0.73	2.45
Bz-RS-ISer(3-Ph)-Ome	ME1135464	0.50	0.69	2.50
LLK	ME1135327	0.62	0.63	2.50
Pyridoxal	ME1135100	0.65	0.60	2.53
2-Amino-1,3,4-octadecanetriol	ME1135144	0.54	0.64	2.58
1-Methyladenosine	ME1135678	0.60	0.61	2.59
Acetyl-N-formyl-5-methoxykynurenamine	ME1135194	0.62	0.59	2.61
Glutamic acid	ME1135172	0.27	0.65	2.91
MAM2201 N-(5-chloropentyl) analog	ME1135283	0.24	0.69	2.82
N1-(1-benzyl-4-piperidyl)-4-chlorobenzene-1-sulfonamide	ME1135384	0.31	0.70	2.71
3^-Adenosine monophosphate (3^-AMP)	ME1135106	0.39	0.64	2.76
Threonine	ME1135122	0.37	0.62	2.85
WKK	ME1135504	0.37	0.63	2.83
Valproic acid	ME1135660	0.70	0.50	2.73
L-Asparagine	ME1135625	0.49	0.55	2.89
Epigallocatechin	ME1135499	0.52	0.54	2.88
Oxymorphone	ME1135227	0.53	0.52	2.90
7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-decahydronaphthalen-1-ol	ME1135295	0.48	0.57	2.83
2-Aminobenzenesulfonamide	ME1135563	0.54	0.54	2.84
Epinephrine bitartrate	ME1135670	0.53	0.54	2.86
Muramic acid	ME1135109	0.53	0.56	2.81
EMH	ME1135416	0.54	0.55	2.82
ENK	ME1135413	0.54	0.55	2.82
L-Dihydroorotic Acid	ME1135692	0.56	0.54	2.81
KQH	ME1135441	0.56	0.55	2.79
N-(9-oxodecyl)acetamide	ME1135566	0.55	0.55	2.79
LysoPC 10:0	ME1135673	0.47	0.63	2.68
Creatine	ME1135523	0.57	0.56	2.74
Lysops 22:5	ME1135619	0.53	0.60	2.69
UR-144 N-(5-hydroxypentyl) β-D-glucuronide	ME1135359	0.54	0.60	2.67
2,4-Dimethylbenzaldehyde	ME1135159	0.51	0.58	2.76
3-{[(3S)-3-(1,3-Benzothiazol-2-yl)-1-pyrrolidinyl]methyl}benzonitrile	ME1135471	0.52	0.59	2.73
3-Hydroxylidocaine	ME1135322	0.51	0.60	2.73
Flavin Adenine Dinucleotide	ME1135691	2.16	0.52	0.74
Oleoyl-L-alpha-lysophosphatidic acid	ME1135260	2.44	0.34	0.84
IMK	ME1135237	1.97	0.87	0.06
1-Methylguanosine	ME1135640	2.11	0.78	0.09
5-oxo-1-[4-(trifluoromethyl)benzyl]pyrrolidine-3-carboxylic acid	ME1135334	2.13	0.77	0.10
Desoxycortone	ME1135524	2.13	0.66	0.40
3-hydroxy-2-[5-nitro-2-(1-pyrrolidinyl)benzyl]propanenitrile	ME1135204	2.06	0.72	0.32
Asp-Phe methyl ester	ME1135600	2.05	0.72	0.33
4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoic acid	ME1135581	1.89	0.80	0.34
DNK	ME1135376	1.91	0.84	0.22
3-hydroxy-6-methoxy-2-phenyl-4H-chromen-4-one	ME1135479	1.92	0.74	0.47
bicyclo[2.2.2]oct-2-en-1-yl 4-methylbenzene-1-sulfonate	ME1135555	1.75	0.86	0.37
UDP	ME1135585	1.78	0.82	0.46
7-(2-aminophenyl)heptanoic acid	ME1135232	2.86	0.35	0.27
Dibutyl sebacate	ME1135408	2.89	0.34	0.24
5,8-dihydroxy-10-methyl-5,8,9,10-tetrahydro-2H-oxecin-2-one	ME1135392	2.70	0.42	0.27
Progesterone	ME1135279	2.79	0.40	0.23
Quinine	ME1135242	2.62	0.52	0.13
SPK	ME1135512	2.58	0.55	0.11
2-Methylpentanedioic acid	ME1135610	2.39	0.65	0.07
Ethylmalonate	ME1135592	2.44	0.63	0.06
Pyridoxamine 5-phosphate	ME1135527	2.46	0.61	0.10
Lenalidomide	ME1135419	2.24	0.69	0.17
1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one	ME1135246	2.31	0.69	0.08
N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide	ME1135532	2.34	0.67	0.10
Epinephrine	ME1135241	1.67	1.01	0.08
N4-Acetylcytidine	ME1135607	1.71	0.99	0.07
Norharman	ME1135160	1.67	1.03	0.03
Oxethazaine	ME1135179	1.65	1.04	0.02
Choline Glycerophosphate	ME1135323	1.64	1.03	0.08
2-Hydroxybenzothiazole	ME1135168	1.63	1.04	0.06
Solanidine	ME1135230	1.63	1.05	0.04
2-(1H-benzimidazol-2-yl)-N-[4-(benzyloxy)phenyl]benzamide	ME1135348	1.68	0.97	0.18
Proline	ME1135093	1.70	0.95	0.21
(3R)-8-hydroxy-3-(4-hydroxyphenyl)-3,4-dihydro-1H-2-benzopyran-1-one	ME1135559	1.62	0.99	0.19
2-[(3S)-1-(2-Chlorobenzyl)-3-pyrrolidinyl]-5-methyl-1,3,4-oxadiazole	ME1135153	1.66	1.00	0.12
Taurochenodeoxycholic Acid (sodium salt)	ME1135521	1.65	0.99	0.15
3-amino-2-phenyl-2H-pyrazolo[4,3-c]pyridine-4,6-diol	ME1135148	1.77	0.97	0.04
LMK	ME1135292	1.77	0.97	0.07
Pantothenic acid	ME1135120	1.76	0.97	0.08
2-(Formylamino)Benzoic Acid	ME1135637	1.79	0.94	0.11
D-(+)-Proline	ME1135092	1.78	0.94	0.13
4-Methylumbelliferyl glucuronide	ME1135258	1.86	0.91	0.09
Shikonin	ME1135522	1.82	0.93	0.09
2-[(butylamino)(imino)methyl]-1-oxohydrazinium-1-olate	ME1135590	1.73	0.90	0.27
Gelsemine	ME1135423	1.82	0.88	0.22
6,7,8-trimethoxy-2H-chromen-2-one	ME1135344	1.78	0.91	0.19
Glycylproline	ME1135214	1.82	0.90	0.16
DL-5-Methoxytryptophan	ME1135324	1.52	1.03	0.23
Methionine sulfoxide	ME1135138	1.48	1.05	0.22
gamma-Glutamylmethionine	ME1135596	1.48	1.03	0.28
MAG (18:3)	ME1135649	1.43	1.06	0.27
1-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]ethan-1-one	ME1135484	1.40	1.04	0.38
Phe-Pro	ME1135597	1.42	1.03	0.35
IRH	ME1135317	1.54	0.99	0.32
Glu-Glu	ME1135659	1.54	0.98	0.33
mesityl(piperidin-4-yl)methanone hydrochloride	ME1135337	1.55	0.98	0.33
2-{[(4,5-dimethoxy-2-nitrophenethyl)imino]methyl}phenol	ME1135436	1.46	0.99	0.42
2-[(3S)-1-(2-Thienylmethyl)-3-pyrrolidinyl]-1,3-benzothiazole	ME1135410	1.51	0.97	0.39
2-Phenylacetamide	ME1135228	1.49	0.99	0.37
N,N-Dimethyldecylamine N-oxide	ME1135220	1.63	0.95	0.30
Adenosine	ME1135139	1.63	0.92	0.39
N-Octyl-2-pyrrolidone	ME1135253	1.59	0.93	0.41
Valylproline	ME1135185	1.61	0.88	0.51
2-Aminoacetophenone	ME1135287	1.55	0.92	0.48
indoline-2-carboxylic acid	ME1135290	1.56	0.92	0.47
Methyl cinnamate	ME1135347	1.28	1.17	0.18
1-{2-[(4-fluorophenyl)sulfonyl]ethyl}-4-(2-pyridinyl)piperazine	ME1135303	1.27	1.18	0.15
5-amino-2-(dimethylamino)benzoic acid	ME1135181	1.25	1.19	0.15
2-[(3S)-1-(3-Methoxybenzyl)-3-pyrrolidinyl]-1,3-benzothiazole	ME1135355	1.25	1.21	0.12
Kinetin	ME1135158	1.27	1.19	0.12
4-methoxy-6-(prop-2-en-1-yl)-2H-1,3-benzodioxole	ME1135467	1.34	1.14	0.16
alpha-Benzylsuccinic acid	ME1135663	1.36	1.16	0.11
DL-3,4-Dihydroxyphenyl glycol	ME1135548	1.28	1.11	0.32
Urocanic acid	ME1135298	1.29	1.11	0.31
KMH	ME1135369	1.23	1.14	0.31
MPH	ME1135256	1.22	1.15	0.30
IPH	ME1135458	1.27	1.15	0.23
(4-benzoylpiperidino)[4-(tert-butyl)phenyl]methanone	ME1135507	1.25	1.15	0.27
N-(5-acetamidopentyl)acetamide	ME1135493	1.28	1.14	0.27
6-Deoxy-D-glucose	ME1135389	1.30	1.14	0.23
Sodium [dodecanoyl(methyl)amino]acetate	ME1135114	1.31	1.13	0.24
2-mercapto-5-methyl-6-propylpyrimidin-4-ol	ME1135418	1.32	1.13	0.23
4-(anilinomethylidene)-3-methyl-4,5-dihydroisoxazol-5-one	ME1135329	1.32	1.13	0.23
(1E)-5-hydroxy-1,7-diphenylhept-1-en-3-one	ME1135530	1.37	1.12	0.19
1-[1,1^-biphenyl]-4-yl-3-piperidinopropan-1-ol	ME1135340	1.35	1.12	0.22
3-Methoxy prostaglandin F1α	ME1135469	1.35	1.12	0.22
(4-nitrophenyl)(2,3,4,5,6-pentamethylphenyl)methanone	ME1135332	1.36	1.07	0.33
7-(1H-pyrrol-1-yl)-5H-chromeno[2,3-b]pyridin-5-one	ME1135395	1.38	1.08	0.27
2,4-dihydroxyheptadec-16-en-1-yl acetate	ME1135453	1.37	1.09	0.27
trans-Cinnamaldehyde	ME1135342	1.37	1.09	0.27
1-Phenyl-3-methyl-5-pyrazolone	ME1135104	1.43	1.12	0.10
5-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazole	ME1135267	1.42	1.13	0.09
D-Homocysteine	ME1135393	1.38	1.17	0.03
α-Aspartylphenylalanine	ME1135121	1.43	1.15	0.02
p-Hydroxybenzaldehyde	ME1135208	1.51	1.07	0.12
Taurodeoxycholic Acid (sodium salt)	ME1135278	1.51	1.07	0.13
8-Hydroxyquinoline	ME1135098	1.49	1.07	0.15
EPK	ME1135330	1.51	1.06	0.16
Octopamine	ME1135617	1.59	1.02	0.15
3-(3,4,5-trimethoxyphenyl)propanoic acid	ME1135442	1.55	1.04	0.16
4-(cyclohexylmethyl)-6-(2-thienyl)-2,3-dihydropyridazin-3-one hydrate	ME1135343	1.54	1.04	0.16
gamma-Glutamylleucine	ME1135591	1.49	1.12	0.02
Vitexin	ME1135282	1.54	1.08	0.07
Indirubin	ME1135487	1.47	0.79	0.94
7-(1-pyrrolidinyl)pyrimido[4,5-d]pyrimidin-4-amine	ME1135224	1.43	0.88	0.74
Gly-Tyr-Ala	ME1135608	1.44	0.87	0.75
gamma-Glutamyltyrosine	ME1135615	1.40	0.87	0.82
Leucylproline	ME1135598	1.41	0.84	0.87
13-HPODE	ME1135390	1.26	1.01	0.62
QKK	ME1135583	1.23	0.99	0.71
3-(2-methylpropyl)-octahydropyrrolo[1,2-a]pyrazine-1,4-dione	ME1135584	1.22	1.01	0.69
3-(3-pyridinyl)propanoic acid	ME1135175	1.20	1.02	0.68
5-Hydroxyindole-2-carboxylic acid	ME1135553	1.28	0.97	0.72
Isorhapontigenin	ME1135184	1.30	0.98	0.67
2-Phenylglycine	ME1135616	1.47	0.90	0.63
All trans-Retinal	ME1135571	1.36	0.96	0.62
DY131	ME1135664	1.39	0.95	0.61
1,7-bis(4-hydroxyphenyl)heptan-3-one	ME1135547	1.42	0.97	0.52
4-Hydroxybenzaldehyde	ME1135132	1.39	0.97	0.56
1-(4-chlorophenyl)-2-phenylethan-1-one	ME1135586	1.18	1.21	0.21
Limonin	ME1135406	1.12	1.23	0.23
ω-Hydroxynorfentanyl	ME1135357	1.12	1.24	0.21
2-Naphthol	ME1135502	1.10	1.26	0.18
1,5-dimethyl-N-(4-morpholinobenzyl)-1H-pyrazole-3-carboxamide	ME1135294	1.13	1.25	0.16
(1R,2R)-trans-N-Boc-1,2-cyclohexanediamine	ME1135275	1.12	1.25	0.17
Tetrahydrocorticosterone	ME1135683	1.03	1.28	0.22
Sebacic acid	ME1135680	1.02	1.26	0.28
H-Gly-Pro-OH	ME1135645	1.07	1.22	0.32
DL-Tryptophan	ME1135117	1.06	1.24	0.28
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(2-phenylethoxy)oxane-3,4,5-triol	ME1135431	1.04	1.24	0.31
3-[4-methyl-1-(2-methylpropanoyl)-3-oxocyclohexyl]butanoic acid	ME1135478	1.04	1.24	0.31
(1E,4E)-1,5-bis(4-methoxyphenyl)penta-1,4-dien-3-one	ME1135450	1.14	1.20	0.27
5-(6-hydroxy-6-methyloctyl)-2,5-dihydrofuran-2-one	ME1135201	1.10	1.22	0.29
Indole-3-acrylic acid	ME1135142	1.08	1.23	0.26
P-Aminohippuric Acid	ME1135686	1.09	1.23	0.27
1-(2-chlorophenyl)-4-(2,4-dinitrophenyl)piperazine	ME1135335	1.04	1.31	0.11
N-Desmethyltramadol	ME1135378	1.07	1.29	0.13
Trioxsalen	ME1135188	1.25	1.24	0.01
3^-Dephospho-CoA	ME1135603	1.17	1.27	0.05
5^-S-Methyl-5^-thioadenosine	ME1135116	1.19	1.26	0.04
Undecanedioic acid	ME1135644	1.21	1.23	0.10
Methionine	ME1135599	1.15	1.26	0.12
Nicotinamide adenine dinucleotide (NAD+)	ME1135108	1.15	1.25	0.13
5-Methyl-dl-tryptophan	ME1135633	0.95	1.29	0.30
N-[1-methyl-1-oxo-1-(2-thienyl)-lambda~6~-sulfanylidene]-N^-phenylurea	ME1135407	0.93	1.29	0.31
2^-Deoxyadenosine	ME1135112	0.94	1.31	0.25
N-P-Coumaroyl Spermidine	ME1135668	0.94	1.30	0.27
4,5-diphenyl-1,3-oxazole-2-thiol	ME1135497	0.91	1.36	0.16
Pyroglutamic acid	ME1135534	0.92	1.37	0.11
3-[4-(tert-butyl)anilino]-2-(3-thienylcarbonyl)acrylonitrile	ME1135372	0.88	1.35	0.22
Riboflavin	ME1135128	0.92	1.34	0.20
4^-propyl[1,1^-biphenyl]-4-carboxamide	ME1135457	0.95	1.33	0.17
5^-Deoxy-5^-(Methylthio)Adenosine	ME1135564	0.96	1.32	0.20
1,2-dihydroxyheptadec-16-yn-4-yl acetate	ME1135286	0.81	1.30	0.45
17alpha-Ethinyl estradiol	ME1135526	0.89	1.29	0.38
Bicyclo prostaglandin E2	ME1135572	0.88	1.29	0.38
Adenosine 5^-Diphosphate	ME1135669	0.89	1.27	0.43
cis-7-Hexadecenoic Acid	ME1135558	0.86	1.28	0.43
Linolelaidic Acid (C18:2N6T)	ME1135480	0.86	1.28	0.42
8-Aminooctanoic acid	ME1135545	0.78	1.39	0.26
L-Leucyl-L-Alanine	ME1135593	0.75	1.40	0.27
3-hydroxyquinuclidine-3-carbonitrile hydrochloride	ME1135426	0.72	1.42	0.26
Cyclic ADP-ribose	ME1135141	0.68	1.44	0.25
7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-2H-chromen-2-one	ME1135525	0.71	1.38	0.38
SPB 16:1;2O	ME1135166	0.71	1.38	0.39
Cafestol	ME1135396	0.85	1.35	0.28
3-amino-4-(propylamino)cyclobut-3-ene-1,2-dione	ME1135236	0.81	1.35	0.32
N-Acetyl-L-carnosine	ME1135656	0.82	1.35	0.29
Docosanamide	ME1135482	0.77	1.34	0.40
6-Methylquinoline	ME1135531	0.80	1.34	0.35
Leu-Pro	ME1135679	0.79	1.35	0.35
13(S)-HOTrE	ME1135666	0.93	1.16	0.67
LNH	ME1135438	0.88	1.18	0.67
4-(Diethylamino)benzaldehyde	ME1135199	0.81	1.17	0.80
KKK	ME1135536	0.82	1.16	0.80
Benzamidine	ME1135448	0.85	1.17	0.74
Cuminaldehyde	ME1135164	0.88	1.15	0.75
THJ2201 N-(5-hydroxypentyl) metabolite	ME1135318	0.85	1.25	0.54
N(6)-OH-Me-Adenosine	ME1135291	0.82	1.24	0.59
19-Nortestosterone	ME1135541	0.85	1.22	0.61
2-(14,15-Epoxyeicosatrienoyl) glycerol	ME1135449	0.87	1.22	0.58
DGDG 15:0_15:0	ME1135456	0.97	1.18	0.56
L-Aspartic acid	ME1135131	0.98	1.16	0.61
2-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepin-4-one	ME1135306	0.95	1.22	0.49
L-Phenylalanine	ME1135103	1.00	1.19	0.49
N,N-Diethyldodecanamide	ME1135537	1.11	1.11	0.56
S-Lactoyglutathione	ME1135695	1.12	1.10	0.58
Aflatoxin B1	ME1135470	1.11	1.12	0.53
DGMG (18:2)	ME1135587	1.08	1.13	0.53
Indole-3-lactic acid	ME1135134	1.06	1.14	0.54
6,7-dihydro-5H-dibenzo[d,f][1,3]diazepin-6-one	ME1135171	1.06	1.11	0.63
DPK	ME1135273	1.10	1.09	0.62
Palmitoleic Acid	ME1135501	1.09	1.10	0.62
S-(5-Adenosy)-L-Homocysteine	ME1135544	1.12	1.07	0.66
Carnosine	ME1135682	1.15	1.06	0.64
Methyl dihydrojasmonate	ME1135417	1.13	1.08	0.62
Gly-Phe	ME1135684	0.99	1.12	0.69
ethyl 2-cyano-3-[(2-oxoazepan-3-yl)amino]acrylate	ME1135546	1.06	1.08	0.70
3-(3,4-dimethylphenyl)-3,4-dihydro-1,2,3-benzotriazin-4-one	ME1135401	1.06	1.09	0.69
3-N-Methyl-L-histidine	ME1135516	1.07	1.08	0.69
JWH 412 N-(5-hydroxypentyl) metabolite	ME1135463	1.24	1.08	0.47
Oleamide	ME1135505	1.26	1.05	0.51
Adenine	ME1135090	1.35	1.02	0.48
Safrole	ME1135492	1.28	1.07	0.43
3-hydroxy-1,5-diphenylpentan-1-one	ME1135427	1.33	1.04	0.45
Indole	ME1135265	1.32	1.06	0.43
Sodium cholate	ME1135681	1.19	1.15	0.35
CYM-5520	ME1135454	1.19	1.14	0.38
Nicotinamide N-oxide	ME1135560	1.21	1.13	0.37
5-Hydroxymethyluracil	ME1135528	1.16	1.14	0.40
QNK	ME1135352	1.21	1.12	0.41
9-Aminoacridine	ME1135542	1.19	1.12	0.41
Bisphenol M	ME1135514	1.18	1.13	0.42
Dihydrothymine	ME1135375	1.23	1.10	0.42
N-(1,3-benzodioxol-5-yl)-7-chloroquinolin-4-amine	ME1135465	1.17	1.11	0.48
4-acetyl-4-(ethoxycarbonyl)heptanedioic acid	ME1135543	1.17	1.12	0.45
Thymine	ME1135477	1.18	1.11	0.45
N1-{4-[2-cyano-2-(4-nitrophenyl)vinyl]phenyl}acetamide	ME1135386	1.20	1.10	0.45
Obscurolide A1	ME1135319	1.20	1.11	0.44
3-phenyl-5-[3-(trifluoromethyl)-1H-pyrazol-1-yl]-1,2,4-thiadiazole	ME1135475	1.13	1.15	0.44
13-Hpotre(R)	ME1135662	1.15	1.14	0.43
(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoic acid	ME1135552	1.15	1.13	0.45
2,5-bis(4-hydroxy-3-methoxyphenyl)-3,4-dimethyloxolan-3-ol	ME1135568	1.09	1.14	0.49
Monolaurin	ME1135297	1.11	1.16	0.44
N-(2-hydroxyethyl)-N^-(4-methylphenyl)thiourea	ME1135466	1.11	1.15	0.45
Oleoyl ethylamide	ME1135508	1.10	1.15	0.46
2-(4-methylphenyl)-5-(3,4,5-trimethoxyphenyl)-2H-1,2,3,4-tetraazole	ME1135519	1.09	1.16	0.45
Aflatoxin G1	ME1135331	1.09	1.16	0.45
Noroxycodone-d3	ME1135257	1.11	1.19	0.36
Tyramine	ME1135414	1.11	1.19	0.35
1,4-dihydroxyheptadec-16-en-2-yl acetate	ME1135551	1.14	1.16	0.39
(3S,9aS)-3-benzyl-octahydro-1H-pyrido[1,2-a]pyrazin-1-one	ME1135503	1.12	1.17	0.38
Morphine D3	ME1135365	1.13	1.17	0.38
3-[(4-hydroxyphenyl)methyl]-octahydropyrrolo[1,2-a]pyrazine-1,4-dione	ME1135177	1.10	1.17	0.41
Cinchophen	ME1135473	1.07	1.19	0.40
Adrenosterone	ME1135570	1.07	1.18	0.42
Methylimidazoleacetic acid	ME1135472	1.08	1.18	0.41
5-Methylcytosine	ME1135693	1.04	1.19	0.43
2-Hydroxypropazine	ME1135271	1.03	1.20	0.42
Pyridostigmine	ME1135345	1.02	1.20	0.43
3-(propan-2-yl)-octahydropyrrolo[1,2-a]pyrazine-1,4-dione	ME1135161	1.02	1.22	0.39
(5E)-7-methylidene-10-oxo-4-(propan-2-yl)undec-5-enoic acid	ME1135425	1.05	1.21	0.37
Spermidine	ME1135211	0.01	1.64	0.61
D-Sphingosine	ME1135110	0.30	1.47	0.68
5-methoxy-2-phenyl-4H-chromen-4-one	ME1135455	0.25	1.51	0.63
Mag (18:1)	ME1135481	0.21	1.50	0.70
5-(2,5-dihydroxyhexyl)oxolan-2-one	ME1135288	0.06	1.53	0.83
Oleanolic acid	ME1135424	0.23	1.43	0.87
(6E)-7-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)hept-6-en-1-one	ME1135221	0.42	1.30	0.97
N-Tetradecanamide	ME1135197	0.42	1.33	0.90
3-Indoleacrylic acid	ME1135671	0.65	1.19	0.96
23-Nordeoxycholic acid	ME1135533	0.63	1.24	0.85
1-Palmitoylglycerol	ME1135146	0.57	1.28	0.83
1-Stearoylglycerol	ME1135087	0.57	1.30	0.78
Tryptophanol	ME1135430	0.45	1.46	0.49
DL-Panthenol	ME1135428	0.43	1.46	0.52
Isopropyl myristate	ME1135495	0.45	1.45	0.54
Octadecanamine	ME1135167	0.35	1.52	0.48
D-Pantethine	ME1135641	0.42	1.49	0.47
Estradiol Benzoate	ME1135565	0.41	1.51	0.42
N-butyl-N^-[5-(tert-butyl)-1,3,4-thiadiazol-2-yl]urea	ME1135388	0.39	1.51	0.44
SPB 17:1;2O	ME1135367	0.19	1.64	0.37
3-(1H-benzo[d]imidazol-2-yl)-6-ethyl-7-hydroxy-4H-chromen-4-one	ME1135483	0.27	1.55	0.51
DL-2-(acetylamino)-3-phenylpropanoic acid	ME1135096	0.29	1.54	0.50
N-[2-chloro-6-(trifluoromethoxy)phenyl]-2,2-dimethylpropanamide	ME1135354	0.25	1.60	0.40
LPC 18:1-SN1	ME1135554	0.28	1.57	0.44
Rutarin	ME1135239	0.27	1.57	0.44
Quinoline	ME1135154	0.57	1.46	0.34
Asaraldehyde	ME1135653	0.63	1.46	0.25
(±)8-HEPE	ME1135459	0.63	1.44	0.32
EPH	ME1135567	0.64	1.44	0.31
INH	ME1135582	0.60	1.40	0.46
6-benzyl-4-oxo-1,4-dihydropyridine-3-carboxamide	ME1135444	0.57	1.42	0.43
Prostaglandin E1	ME1135539	0.58	1.43	0.41
LPC 16:0-SN1	ME1135511	0.64	1.35	0.53
Methyl palmitate	ME1135169	0.68	1.36	0.47
2,3-dihydroxypropyl 12-methyltridecanoate	ME1135213	0.73	1.29	0.59
12-Oxo phytodienoic acid	ME1135646	0.67	1.29	0.67
1-allyl-4,5-diphenyl-2-(2-thienyl)-1H-imidazole	ME1135402	0.69	1.28	0.67
2-deoxyglucose-6-phosphate	ME1135689	0.66	1.31	0.63
Skatole	ME1135312	0.68	1.31	0.60
2-acetamido-3-(4-methoxyphenyl)propanoic acid	ME1135486	0.39	1.40	0.76
2-Amino-1,3-octadecanediol	ME1135149	0.48	1.36	0.72
Muscone	ME1135193	0.56	1.33	0.70
NPK	ME1135489	0.59	1.34	0.64
Betaine	ME1135091	0.47	1.41	0.62
Triacanthine	ME1135192	0.47	1.42	0.59
L-Argininosuccinate	ME1135339	0.56	1.37	0.60
Ethyl oleate	ME1135460	0.51	1.40	0.60
1-(1,8-dihydroxy-3,6-dimethyl-2-naphthyl)ethan-1-one	ME1135243	0.53	1.38	0.63
N-Methyldioctylamine	ME1135434	0.52	1.38	0.62
Phenylpropiolic acid	ME1135385	0.78	1.41	0.20
Boldione	ME1135557	0.76	1.43	0.16
N-cyclooctylurea	ME1135222	0.77	1.43	0.16
6-Pentyl-2H-pyran-2-one	ME1135261	0.76	1.46	0.09
L-(-)-alpha-Amino-epsilon-Caprolactam	ME1135244	0.76	1.46	0.08
Catharanthine	ME1135405	0.74	1.45	0.13
Isoleucine	ME1135126	0.73	1.46	0.13
RMH	ME1135485	0.70	1.52	0.02
5-Hydroxyindole	ME1135601	0.67	1.53	0.03
ERH	ME1135163	0.65	1.53	0.06
PMK	ME1135195	0.65	1.54	0.04
WNH	ME1135310	0.57	1.55	0.11
N6-Acetyl-L-lysine	ME1135105	0.63	1.52	0.11
2-Hydroxyphenylalanine	ME1135174	0.64	1.49	0.16
DL-m-Tyrosine	ME1135626	0.64	1.50	0.16
1-(3,4-dimethoxyphenyl)ethan-1-one oxime	ME1135182	0.47	1.63	0.04
Biotin	ME1135123	0.56	1.59	0.02
11β-Hydroxyandrosterone	ME1135223	0.39	1.58	0.27
Pyridoxal 5^-phosphate	ME1135107	0.34	1.58	0.34
(2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoic acid	ME1135311	0.49	1.57	0.14
Hydrocortisone	ME1135589	0.49	1.57	0.16
13,14-Dihydro prostaglandin E1	ME1135248	0.45	1.57	0.23
2-phenyl-2,4,6,7-tetrahydrothiino[4,3-c]pyrazol-3-ol	ME1135535	0.48	1.56	0.20
Betulin	ME1135468	0.47	1.54	0.26
Ginsenoside Rg3	ME1135491	0.50	1.52	0.28
Feruloyl Putrescine	ME1135635	0.58	1.49	0.25
L-Glutamate	ME1135620	0.54	1.50	0.27
Testosterone	ME1135198	0.19	1.73	0.14
2-Aminoadipic acid	ME1135118	0.19	1.75	0.08
GPK	ME1135409	0.20	1.74	0.10
ADP-ribose	ME1135315	0.29	1.73	0.01
Caffeine	ME1135099	0.25	1.74	0.03
L-Ergothioneine	ME1135115	0.34	1.69	0.04
Pleuromutilin	ME1135435	0.31	1.69	0.08
Vanillin	ME1135094	0.31	1.69	0.07
diethyl 2-{[(6-methyl-2-pyridyl)amino]methylidene}malonate	ME1135363	0.36	1.63	0.18
N,N^-di[4-(2,6-dimethylmorpholino)phenyl]thiourea	ME1135387	0.37	1.63	0.16
Sodium Dehydrocholate	ME1135578	0.26	1.69	0.14
2-hydroxy-6-[(8Z,11Z)-pentadeca-8,11,14-trien-1-yl]benzoic acid	ME1135474	0.27	1.69	0.13
5-(isopropylthio)-4-phenyl-4H-1,2,4-triazol-3-ol	ME1135540	0.27	1.69	0.13
Methanandamide	ME1135506	0.32	1.65	0.16
Nitrosonornicotine	ME1135186	0.31	1.67	0.12
2-Mercaptobenzothiazole	ME1135595	0.01	1.85	0.05
Inositol	ME1135346	0.07	1.82	0.04
Pantetheine	ME1135594	0.10	1.81	0.04
(S)-Nicotine	ME1135095	0.02	1.74	0.34
Thiamine	ME1135189	0.05	1.79	0.17
4-cyclopropyl-6-methoxy-1,3,5-triazin-2-amine	ME1135217	0.06	1.76	0.22
5-[(10Z)-14-(3,5-dihydroxyphenyl)tetradec-10-en-1-yl]benzene-1,3-diol	ME1135219	0.09	1.75	0.23
2-[5-(2-hydroxypropyl)oxolan-2-yl]propanoic acid	ME1135440	1.79	0.38	1.62
Deoxyinosine	ME1135573	1.76	0.49	1.35
HRH	ME1135383	1.68	0.58	1.22
2-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methoxybenzoic acid	ME1135515	1.25	0.80	1.19
RPH	ME1135301	1.38	0.75	1.16
Isoquinoline	ME1135150	1.17	0.76	1.42
VLH	ME1135326	1.25	0.67	1.54
(2E,4E)-N-[2-(4-hydroxyphenyl)ethyl]dodeca-2,4-dienamide	ME1135579	0.91	1.10	0.86
Diazepam-d8	ME1135445	0.83	1.13	0.87
TQH	ME1135490	0.83	1.10	0.95
N-Acetyl-DL-phenylalanine	ME1135611	0.96	1.01	1.04
Alanyltyrosine	ME1135687	0.93	1.03	1.01
N-Acetyl-L-leucine	ME1135624	0.94	1.02	1.02
2-Methoxybenzaldehyde	ME1135102	0.97	1.02	0.99
2-Phenylpropionic acid	ME1135642	0.97	1.03	0.95
2-Hydroxycinnamic acid	ME1135235	0.84	1.06	1.06
N1-cyclooctyl-4-hydroxy-1-piperidinecarbothioamide	ME1135518	0.82	1.08	1.04
(12Z)-9,10,11-trihydroxyoctadec-12-enoic acid	ME1135443	0.88	1.05	1.03
DRH	ME1135575	0.87	1.07	0.98
3-hydroxy-3-(2-pyridylmethyl)indolin-2-one	ME1135240	1.01	1.05	0.84
3-Methoxytyramine	ME1135658	1.02	1.04	0.86
1-(7-methoxy-2-oxo-2H-chromen-8-yl)-3-methyl-2-oxobutyl acetate	ME1135496	1.03	1.07	0.78
1-(6-methyl-3-pyridyl)ethan-1-one O1-ethyloxime hydrochloride	ME1135517	1.07	1.03	0.82
Dehydrocholic acid	ME1135588	1.08	1.05	0.77
Palmitic Acid	ME1135676	1.09	1.04	0.78
L-Kynurenine	ME1135638	1.21	0.94	0.87
N-Acetylhistamine	ME1135580	1.16	0.97	0.88
Vitamin B2	ME1135654	1.07	0.99	0.94
4-Methylvaleric Acid	ME1135629	1.07	0.96	1.00
5-Hydroxyindole-3-acetic acid	ME1135675	1.08	0.96	0.99
Acetophenone	ME1135097	1.04	0.98	0.99
Methyl 3-indolyacetate	ME1135618	1.05	0.97	1.01
Kojic acid	ME1135655	0.98	0.96	1.14
1-(piperidinomethyl)-2-naphthol	ME1135360	0.91	0.98	1.17
6-(3-hydroxybutan-2-yl)-5-(hydroxymethyl)-4-methoxy-2H-pyran-2-one	ME1135259	0.91	0.97	1.19
N-Formylkynurenine	ME1135621	1.10	0.83	1.33
9-Oxo-ODE	ME1135446	0.96	0.90	1.31
Phenylglyoxylic acid	ME1135628	1.04	0.88	1.27
P-Coumaroyl Agmatine	ME1135690	0.57	1.07	1.39
Cortisol	ME1135461	0.73	1.10	1.10
MNK	ME1135266	0.83	0.98	1.29
4-oxododecanedioic acid	ME1135234	0.72	1.06	1.20
1-benzyl-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione	ME1135462	0.74	1.04	1.23
octadec-9-ynoic acid	ME1135196	0.77	1.03	1.23
2^-O-Methyladenosine	ME1135111	1.02	0.80	1.51
AL 8810 Methyl ester	ME1135561	0.83	0.90	1.50
Styrene	ME1135173	0.87	0.90	1.45
(11E,15Z)-9,10,13-trihydroxyoctadeca-11,15-dienoic acid	ME1135498	0.87	0.91	1.42
Sanguinarine	ME1135304	0.88	0.91	1.42
ethyl 5-methoxy-2-methyl-1-phenyl-1H-indole-3-carboxylate	ME1135368	1.05	0.71	1.70
Anthranilic acid	ME1135152	0.89	0.84	1.57
3-[(4-chlorobenzyl)thio]-4-methyl-5-undecyl-4H-1,2,4-triazole	ME1135550	0.85	0.85	1.60
N-Phenylacetylglutamine	ME1135476	0.87	0.84	1.61
Quinoline-4-carboxylic acid	ME1135630	0.85	0.79	1.77
L-Glutamic acid	ME1135133	0.91	0.79	1.67
2-{2-oxo-2-[(2-oxo-3-azepanyl)amino]ethoxy}acetic acid	ME1135602	0.87	0.80	1.69
2-[(3S)-1-Isopropyl-3-pyrrolidinyl]-1H-benzimidazole-5-carbonitrile	ME1135394	0.86	0.81	1.69
2-Hydroxyhippuric acid	ME1135190	0.40	1.04	1.68
Stearamide	ME1135165	0.42	0.99	1.81
Acetylcarnitine	ME1135513	0.75	0.88	1.66
QPK	ME1135276	0.75	0.88	1.64
Veratramine	ME1135538	0.70	0.88	1.71
2-[1,1^-biphenyl]-4-yl-6-phenyl-1,3-benzoxazole	ME1135411	0.66	0.90	1.70
Prostaglandin E2-1-glyceryl ester	ME1135379	0.67	0.91	1.69
2-Aminobenzenesulfonic acid	ME1135268	0.50	1.02	1.61
2-({[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}methyl)phenol	ME1135321	0.54	0.96	1.71
3-(2-Naphthyl)-D-Alanine	ME1135647	0.57	0.96	1.67
6-(Dimethylamino)purine	ME1135488	0.60	0.95	1.66
Hexadecanamide	ME1135145	0.37	0.94	1.99
Choline	ME1135170	0.47	0.85	2.11
2,6-Dihydroxypurine	ME1135648	0.53	0.86	2.01
Norbuprenorphine	ME1135404	0.54	0.85	2.03
PMH	ME1135229	0.68	0.86	1.80
Nicotinuric Acid	ME1135433	0.70	0.82	1.89
Stanozolol	ME1135285	0.69	0.84	1.85
Acetylcysteine	ME1135613	0.55	0.89	1.90
Palmitoylethanolamide	ME1135576	0.58	0.90	1.83
Prolylleucine	ME1135614	0.60	0.90	1.80
2-Methoxyestradiol (2-MeOE2)	ME1135569	0.65	0.79	2.05
6-(7-methyloctyl)-1H,3H,4H,6H-furo[3,4-c]furan-1-one	ME1135400	0.65	0.83	1.93
L-Methionine Methyl Ester	ME1135556	0.67	0.80	1.98
1-Methylguanine	ME1135509	0.74	0.75	2.01
1-(2,4-dihydroxyphenyl)-2-(3,5-dimethoxyphenyl)propan-1-one	ME1135349	0.74	0.77	1.95
Clofencet-potassium	ME1135397	0.77	0.76	1.96
Cyclocytidine	ME1135685	0.83	0.75	1.91
2-(3,4-dimethoxyphenyl)-N-(4-morpholinophenyl)acetamide	ME1135353	0.75	0.80	1.87
N,N-dimethyl-5-nitro-6-[3-(trifluoromethyl)phenoxy]pyrimidin-4-amine	ME1135574	0.78	0.78	1.88
Dulcitol	ME1135233	0.04	1.14	1.91
Allantoin	ME1135674	0.13	1.24	1.51
(2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide	ME1135382	0.21	1.26	1.37
WNK	ME1135250	0.19	1.30	1.27

Factors:

F1	Treatment:co-culture \| Sample source:bacteria cell
F2	Treatment:monoculture \| Sample source:bacteria cell
F3	Treatment:NA \| Sample source:quality control

Data matrix