Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST002758)

(Analysis AN004475)

Metabolite	Structure	F1	F2	F3	F4	F5	F6	F7	F8	F9	F10
L-(-)-Methionine	ME708908	0.28	0.02	0.01	0.02	2.07	0.04	0.07	0.02	0.01	8.84
2^-Deoxycytidine	ME708924	0.07	0.02	0.64	0.15	3.00	0.10	0.04	0.04	0.01	6.90
Leu-pro	ME709306	0.21	0.22	0.19	0.22	2.12	0.28	0.22	0.23	0.07	7.29
Diethylene glycol	ME708989	0.11	0.12	0.11	0.11	0.11	0.10	0.13	0.12	0.18	10.68
Tetramethylurea	ME709005	0.09	0.16	0.07	0.11	0.06	0.13	0.13	0.19	0.02	10.83
PEG n13	ME709295	0.37	0.37	0.31	0.42	0.23	1.02	0.51	0.36	0.08	7.43
PEG n7	ME708973	0.33	0.44	0.27	0.32	0.29	1.28	0.37	0.39	0.11	7.28
1-[5-Nitro-2-(1-pyrrolidinyl)benzyl]-1H-imidazole	ME709405	0.12	0.24	0.31	0.23	0.24	0.20	0.20	0.37	0.25	9.35
Dipropylene glycol dimethyl ether	ME708900	0.20	0.24	0.24	0.23	0.23	0.23	0.26	0.25	0.31	9.35
Panthenyl ethyl ether	ME709143	0.21	0.29	0.26	0.27	0.25	0.62	0.29	0.29	0.28	8.62
PEG n10	ME709040	0.25	0.25	0.21	0.24	0.19	0.93	0.31	0.25	0.05	8.65
PEG n11	ME709116	0.27	0.26	0.24	0.27	0.18	0.97	0.35	0.27	0.06	8.42
PEG n12	ME709169	0.29	0.29	0.25	0.31	0.19	0.92	0.41	0.29	0.06	8.24
Hydrochlorothiazide	ME708918	0.03	0.05	0.04	0.04	8.18	0.04	0.04	0.05	0.03	1.37
1-Methylimidazoleacetic acid	ME709107	0.13	5.78	0.36	0.62	0.42	0.28	0.68	1.26	0.04	0.06
1,3-di-o-Tolylguanidine	ME709290	0.16	7.65	0.16	0.16	0.21	0.33	0.17	0.19	0.17	0.54
aromadendrin	ME709096	0.10	9.02	0.04	0.06	0.09	0.13	0.05	0.05	0.04	0.06
hexahydro-2-oxo-1h-thieno(3,4-d)imidazole-4-pentanoic acid	ME709064	0.14	0.07	0.09	0.13	0.15	7.28	0.14	0.81	0.15	0.84
pro-asn	ME709272	0.65	0.21	0.22	0.16	0.60	5.95	0.16	1.51	0.03	0.16
NP-003399	ME709157	0.10	0.12	0.10	7.28	0.13	0.18	0.11	0.10	0.10	1.75
NP-003672	ME709035	0.11	0.10	0.06	7.70	0.07	0.12	0.05	0.05	0.04	1.61
1,4a-Dimethyl-6-methylene-5-[2-(2-oxo-2,5-dihydro-3-furanyl)ethyl]decahydro-1-naphthalenecarboxylic acid	ME709207	0.22	0.25	0.25	6.77	0.32	0.35	0.52	0.32	0.11	0.62
MFCD00065806	ME709197	0.14	0.15	0.13	7.09	0.19	0.35	0.28	0.30	0.11	1.10
(+)-podocarpic acid	ME709270	0.05	0.23	0.22	6.92	0.21	0.33	0.41	0.27	0.15	1.04
Alvameline	ME709087	0.29	0.18	0.46	5.17	0.79	1.38	0.31	0.45	0.39	0.32
testololactone	ME709328	0.29	0.28	0.24	6.37	0.25	0.46	0.25	0.26	0.25	1.24
17-(Hydroxymethyl)-12-methyl-8-oxapentacyclo[14.2.1.0~1,13~.0~4,12~.0~5,9~]nonadeca-5(9),6,10-trien-17-ol	ME709115	0.16	0.23	0.15	6.33	0.35	0.49	0.37	0.38	0.05	1.36
ostruthin	ME709300	0.21	0.28	0.18	6.08	0.35	0.47	0.50	0.44	0.15	1.22
Ethinylestradiol	ME709090	0.15	0.20	0.14	5.71	0.41	0.37	0.92	0.62	0.05	1.29
Shogaol	ME709095	0.22	0.30	0.24	5.78	0.29	0.27	0.62	0.66	0.07	1.47
NP-014175	ME709203	0.27	0.40	0.25	5.34	0.35	1.35	0.32	0.35	0.21	0.99
2-Hydroxy-4,5^,8a^-trimethyl-1^-oxo-4-vinyloctahydro-1^H-spiro[cyclopentane-1,2^-naphthalene]-5^-carboxylic acid	ME709257	0.40	0.52	0.40	5.02	0.40	0.66	0.46	0.46	0.21	1.41
NP-006862	ME709256	0.25	0.32	0.32	5.03	0.59	0.73	0.68	0.64	0.13	1.16
1,4a-dimethyl-9-oxo-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylic acid	ME708978	0.14	0.61	0.13	5.56	0.28	0.96	0.21	0.56	0.03	1.42
(1R,4aS)-7-(2-Hydroxypropan-2-yl)-1,4a-dimethyl-9-oxo-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid	ME709366	0.29	0.43	0.30	5.45	0.36	0.66	0.40	0.41	0.24	1.40
3,4-Didehydroretinoic acid	ME709255	0.26	0.43	0.25	5.56	0.35	0.63	0.45	0.58	0.23	1.15
DL-Homoserine	ME708974	0.20	0.66	0.30	2.21	1.37	2.20	1.74	0.71	0.05	0.23
UV9702000	ME708969	0.29	0.48	0.25	4.39	0.53	0.51	2.24	0.31	0.41	0.35
7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylic acid	ME708934	0.44	0.63	0.39	2.94	0.64	0.80	1.36	1.42	0.00	1.21
7-hydroxy-1,4a-dimethyl-9-oxo-7-(propan-2-yl)-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthrene-1-carboxylic acid	ME708933	0.44	0.63	0.39	2.98	0.64	0.80	1.35	1.41	0.00	1.20
2-MeO-E1	ME709153	0.27	0.47	0.24	4.25	0.75	0.89	0.78	0.86	0.06	1.30
3,6,9-Trimethyl-2,7-dioxo-2,3,3a,4,5,7,9a,9b-octahydroazuleno[4,5-b]furan-4-yl acetate	ME709394	0.73	0.78	0.48	3.85	0.59	1.05	0.54	0.59	0.32	0.90
Gingerdione	ME709358	0.61	0.72	0.60	3.84	0.64	1.20	0.53	0.53	0.43	0.73
Uric acid	ME709010	4.27	0.35	0.23	0.36	0.70	0.78	0.24	0.41	0.01	2.82
3,4-dehydrothiomorpholine-3-carboxylic acid	ME709057	0.62	0.84	0.58	0.28	4.61	1.38	0.52	0.69	0.00	0.10
Hippuric acid	ME708932	0.58	0.09	3.84	0.69	1.08	0.12	2.30	0.12	0.00	0.97
Triethylamine	ME708982	0.13	0.56	0.99	0.45	0.58	0.16	2.19	4.46	0.03	0.08
Valproic acid	ME709168	0.43	0.23	0.38	0.22	0.47	0.73	1.00	5.26	0.19	0.92
11-Aminoundecanoic acid	ME709164	0.74	1.00	0.94	0.96	0.41	0.39	0.53	3.78	0.03	1.04
PPG n6	ME709210	0.72	0.93	0.52	0.52	0.39	1.13	0.45	4.36	0.18	0.53
1-Isopropenyl-3-isopropylbenzene	ME709326	0.45	0.75	0.43	0.59	0.43	0.54	0.71	0.72	0.08	6.14
2-(Diethylamino)ethanol	ME709303	0.49	0.66	1.09	0.83	0.71	0.56	0.59	0.69	0.03	4.94
Ethyl caproate	ME709340	0.56	0.67	0.67	0.63	0.63	0.63	0.66	0.68	0.73	4.86
Cytosine	ME708914	1.94	1.34	0.42	0.44	0.60	0.37	1.50	0.69	0.00	2.89
Uracil	ME709219	1.55	1.09	0.86	0.51	1.46	0.49	1.59	0.10	0.06	2.39
(4E)-2-Amino-3-oxo-4-nonenoic acid	ME709302	0.74	1.29	0.50	0.33	1.77	0.97	0.79	0.65	0.03	3.19
Tranexamic acid	ME709355	1.82	0.69	0.68	0.46	0.52	0.63	0.63	0.64	0.68	3.75
Hexanal	ME709241	0.78	0.74	0.88	0.74	0.77	0.68	0.70	0.69	0.91	3.62
(1S)-1-Carboxy-2-(1H-imidazol-4-yl)-N,N,N-trimethylethanaminium	ME709123	0.74	0.76	0.44	0.89	0.65	1.18	0.51	1.11	0.31	3.83
6-Methylquinoline	ME708893	0.71	1.09	0.72	0.83	0.57	0.75	1.05	1.18	0.00	3.37
Carbazole	ME709042	0.61	1.06	0.69	0.79	0.49	0.79	1.01	1.18	0.01	3.73
XT2570000	ME709260	0.71	1.02	0.75	0.80	0.56	0.67	0.99	1.08	0.02	3.76
Ichthyotherol	ME709067	1.10	1.99	0.12	0.11	1.12	2.78	0.11	0.10	0.14	2.58
Ketamine	ME708993	0.41	0.15	1.08	1.10	0.16	2.93	0.95	1.16	0.00	2.09
(5S)-5-hydroxy-1,7-diphenylheptan-3-one	ME709029	0.52	0.63	0.49	0.44	0.43	3.13	0.46	0.56	0.10	3.59
PEG n6	ME708951	0.48	0.59	0.45	0.41	0.43	3.33	0.42	0.56	0.17	3.50
CYCLO(-SER-TYR)	ME709000	0.84	0.36	0.76	0.25	1.74	0.71	3.19	0.89	0.02	1.06
Phenylacetylglycine	ME708994	1.33	0.34	1.16	0.28	1.25	0.29	3.53	0.65	0.01	0.95
(+)-Allopumiliotoxin 267A	ME709401	0.46	0.76	1.04	0.46	0.46	0.36	4.17	1.55	0.13	0.31
5-Methyl-2-octyl-3(2H)-furanone	ME708917	0.49	0.46	0.86	0.76	0.43	0.82	3.54	1.23	0.27	1.01
Cyprodenate	ME708913	0.50	0.46	0.88	0.77	0.45	0.80	3.50	1.22	0.27	1.01
N-Desmethyltramadol	ME709002	0.72	0.78	0.87	0.75	0.73	0.79	2.76	1.00	0.32	1.19
N-Undecanoylglycine	ME708940	0.58	0.70	0.89	0.80	0.55	0.90	3.03	1.29	0.11	0.97
8-Azabicyclo[3.2.1]octane-1,2,7-triol	ME709195	0.26	0.31	0.25	0.25	0.20	0.10	4.28	3.18	0.09	0.87
Clomazone	ME709054	0.08	0.13	0.19	0.21	0.63	0.46	3.58	3.52	0.01	0.98
MFCD00070502	ME709024	0.87	0.90	0.13	0.29	0.91	0.55	2.20	2.17	0.07	1.91
(1S,4S,5R,9R,13S)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0Âa,Âaâ°.0â´,âa]hexadec-10-ene-5-carboxylic acid	ME709299	0.16	0.31	0.37	1.19	0.61	0.86	2.53	2.74	0.05	0.97
d-Valerolactam	ME709089	0.33	0.51	0.39	0.39	0.37	0.46	2.50	3.34	0.29	1.34
val-phe	ME709228	0.31	0.56	0.40	0.48	0.44	0.48	2.31	3.70	0.05	1.11
Succinimide	ME709075	2.73	0.19	0.59	0.67	0.27	1.06	0.63	1.80	0.91	1.16
Taurocholic acid	ME709180	0.62	2.83	0.21	0.26	2.27	0.72	0.35	1.24	0.05	1.31
17a-Methyl-androstan-3-hydroxyimine-17ß-ol	ME709234	0.78	2.16	2.07	0.37	0.56	0.13	0.92	2.19	0.04	0.48
Glycyl-4-hydroxyproline	ME709240	0.44	3.26	0.39	1.66	0.54	0.52	0.26	1.64	0.15	0.94
Adenosine	ME708907	0.68	3.28	0.19	1.71	1.16	0.42	0.50	1.33	0.06	0.34
Hypoxanthine	ME709081	0.92	3.50	0.27	1.51	0.80	0.23	0.78	1.16	0.13	0.41
N-Formyl-L-glutamic acid	ME709051	0.78	2.93	0.51	1.09	1.11	0.28	1.01	0.79	0.67	0.71
Asarone	ME709361	0.46	2.65	0.51	1.09	0.72	1.48	1.03	0.74	0.33	0.81
Inosine	ME708965	0.83	2.56	0.44	0.93	1.16	0.85	0.98	1.28	0.03	0.68
Desthiobiotin	ME709214	0.78	2.53	0.87	1.63	0.86	0.93	0.64	1.01	0.09	0.35
N,N^-Dicyclohexylurea	ME709099	0.94	2.57	0.90	1.02	1.08	1.12	0.96	0.90	0.02	0.11
Pinocembrin	ME709392	0.42	2.08	0.24	3.55	0.82	0.90	0.31	0.66	0.25	0.52
2-(2-Hydroxy-2-propanyl)-4-methoxy-7-methyl-2,3,6,7-tetrahydro-9H-furo[3,2-h]isochromen-9-one	ME709397	0.42	1.79	0.83	1.89	0.73	1.27	0.57	1.18	0.05	1.11
4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoic acid	ME709381	0.16	2.35	0.32	2.46	0.15	1.54	0.25	1.11	0.07	1.49
4-Deoxy-5-C-(3,5-di-sec-butyl-1-cyclopenten-1-yl)pentonic acid	ME709353	0.54	2.11	0.52	2.41	0.49	1.24	0.45	0.85	0.07	1.18
Dibutyl phthalate	ME708927	0.41	2.05	0.53	2.66	0.41	1.25	0.30	1.15	0.02	1.04
11-Nor-9-carboxy-thc	ME709382	0.29	0.51	1.91	1.76	0.36	0.42	1.73	1.80	0.10	0.94
Prolylleucine	ME709183	0.29	1.21	2.51	1.41	1.21	0.65	1.56	0.64	0.03	0.12
3-Oxocholic acid	ME709235	0.30	0.44	2.69	2.24	1.42	0.93	0.33	0.42	0.06	0.96
4-{[5-(6-Hydroxy-5,5,8a-trimethyl-2-methylenedecahydro-1-naphthalenyl)-3-methylpentyl]oxy}-4-oxobutanoic acid	ME709070	0.42	0.85	1.70	1.53	1.83	0.96	0.64	0.78	0.03	1.09
Cervonoyl ethanolamide	ME709103	0.42	0.83	1.74	1.54	1.82	0.95	0.64	0.78	0.02	1.09
3b-Hydroxy-5-cholenoic acid	ME708981	0.32	0.62	2.13	1.84	1.95	1.16	0.30	0.41	0.01	1.07
Docosahexaenoic acid ethyl ester	ME709007	0.27	0.66	2.25	1.77	1.88	1.05	0.45	0.65	0.01	0.77
3beta,21-Dihydroxy-4,4,14-trimethyl-5alpha-pregn-8-en-20-one	ME709020	0.49	0.85	1.88	1.76	0.70	0.81	0.89	0.97	0.02	1.53
Thiorphan	ME709393	0.57	0.57	2.35	1.47	1.28	0.84	1.31	0.32	0.05	1.06
D-Lactose monohydrate	ME708992	0.56	0.74	0.59	0.67	2.81	1.18	1.15	1.03	0.01	1.08
Testosterone	ME709363	0.43	0.46	0.43	0.43	1.95	1.82	1.81	1.37	0.07	1.07
3-[(1S)-2-Cyclohexen-1-yl]-L-alanine	ME709372	1.63	2.72	0.16	0.16	1.59	1.89	0.24	0.26	0.05	1.14
3-Allylcyclohexene	ME709309	1.71	2.34	0.25	0.32	1.47	1.85	0.32	0.31	0.18	1.11
(2R,3S)-3-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid	ME709352	1.70	2.01	0.29	0.29	1.71	1.94	0.30	0.29	0.23	1.10
4-Hydroxynonenal	ME709250	1.79	2.01	0.28	0.28	1.88	1.89	0.27	0.28	0.21	0.94
Ethyl 2,4-dioxohexanoate	ME709378	1.72	2.00	0.31	0.32	1.81	1.86	0.30	0.30	0.21	1.02
6-[(1E)-3-Hydroxy-1-buten-1-yl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-3-one	ME709345	1.74	1.84	0.31	0.28	1.76	1.85	0.33	0.35	0.42	0.99
Traumatin	ME709006	1.61	1.85	0.38	0.38	1.67	1.87	0.36	0.38	0.30	1.08
5-Butyloxazole	ME709316	1.70	2.04	0.31	0.32	1.58	1.71	0.31	0.31	0.25	1.38
Hexylresorcinol	ME709059	1.86	1.80	0.40	0.41	1.69	1.61	0.36	0.37	0.18	1.18
NP-005146	ME709317	1.60	1.75	0.49	0.44	1.72	1.63	0.41	0.42	0.25	1.17
3-(5-Hydroxy-2,2-dimethyl-2H-chromen-6-yl)-1-phenyl-1-propanone	ME709387	1.87	1.97	0.14	0.15	1.77	2.44	0.13	0.18	0.06	1.13
Brassylic acid	ME709335	1.63	1.89	0.24	0.30	1.81	2.25	0.25	0.28	0.14	1.03
Mitraphylline	ME709253	1.74	1.92	0.20	0.20	1.88	2.33	0.22	0.23	0.07	1.05
butoctamide	ME709113	1.91	2.18	0.08	0.07	2.06	2.27	0.08	0.09	0.03	1.05
cis-acetylacrylic acid	ME709198	1.90	2.07	0.18	0.19	1.95	1.97	0.18	0.27	0.11	1.03
MFCD15144952	ME709122	1.86	2.09	0.18	0.18	1.96	2.01	0.17	0.23	0.10	1.04
Glycidyl methacrylate	ME709161	1.04	2.66	0.31	0.31	2.01	1.93	0.33	0.30	0.11	0.78
(2Z)-2-(3-Hydroxybenzylidene)heptanal	ME709227	1.30	2.43	0.21	0.22	2.13	1.61	0.20	0.19	0.19	1.47
4-Hydroxy-3,4a,5-trimethyl-4a,5,6,7,8,8a,9,9a-octahydronaphtho[2,3-b]furan-2(4H)-one	ME709337	1.28	2.54	0.12	0.16	2.26	1.62	0.14	0.15	0.11	1.55
(4S,5R,8S,9R,12R,13R)-1,5,9-Trimethyl-11,14,15-trioxatetracyclo[10.2.1.0~4,13~.0~8,13~]pentadecan-10-ol	ME709350	1.36	2.05	0.22	0.22	1.38	1.72	0.23	0.22	0.18	2.57
7-Oxoheptanoic acid	ME709344	1.17	2.01	0.38	0.50	1.38	1.80	0.39	0.54	0.16	1.62
NP-002855	ME709276	1.52	1.64	0.40	0.43	1.58	1.48	0.42	0.38	0.24	1.94
4-Vinylcyclohexene	ME709364	1.54	1.95	0.40	0.36	1.60	1.26	0.45	0.37	0.46	1.64
N-Methylcaprolactam	ME709249	1.48	1.72	0.45	0.45	1.46	1.80	0.41	0.42	0.30	1.45
4-Vinylcatechol	ME709136	1.62	1.74	0.47	0.45	1.49	1.57	0.45	0.44	0.32	1.39
Sulcatol	ME709021	1.56	1.80	0.44	0.40	1.43	1.56	0.42	0.41	0.33	1.63
3-Methylbutanoic acid	ME709294	1.07	1.39	0.71	0.69	0.99	1.17	0.70	0.71	0.69	2.01
2-Propylfuran	ME709225	1.16	1.62	0.39	0.56	1.35	1.57	0.42	0.71	0.22	2.07
2-Propionyl-1,4,5,6-tetrahydropyridine	ME709243	1.28	1.91	0.47	0.48	1.10	1.42	0.46	0.47	0.43	2.08
3-Hydroxytridecanoic acid	ME709175	1.14	1.61	0.57	0.55	1.19	1.33	0.55	0.58	0.52	2.10
Ethyl palmitoleate	ME709112	1.66	1.65	0.17	0.88	1.09	1.73	0.17	1.19	0.04	1.28
2-Methoxy-7,7,8b-trimethyloctahydrocyclopropa[4,5]indeno[5,6-c]furan-4a,5(4H)-diol	ME709341	1.10	1.79	0.56	0.62	1.32	2.13	0.53	0.61	0.25	0.92
Palmitoleic acid	ME709346	1.24	1.70	0.41	0.61	1.19	1.95	0.64	0.89	0.24	0.98
(2E)-2-Tetradecenal	ME709339	0.70	1.87	0.71	0.91	1.13	1.97	0.63	1.00	0.23	0.64
1-[5-(4-Hydroxy-2-butanyl)-2-methyltetrahydro-2-furanyl]-4-methyl-2-pentanone	ME709215	0.91	1.69	0.66	0.85	1.28	2.03	0.60	0.85	0.20	0.71
cystophorene	ME709282	0.92	1.55	0.69	0.98	1.37	1.92	0.62	0.92	0.13	0.67
undecenal	ME709193	0.93	1.54	0.69	0.95	1.38	1.97	0.61	0.90	0.12	0.67
3-oxolauric acid	ME709208	0.97	1.80	0.63	0.85	1.52	1.78	0.52	0.85	0.13	0.72
(2E)-2-Heptenoic acid	ME709357	1.14	1.72	0.64	0.85	1.43	1.77	0.63	0.71	0.21	0.68
9-Oxononanoic acid	ME709245	1.11	1.68	0.60	0.79	1.47	1.77	0.66	0.84	0.12	0.72
7-Octene-3,5-diyn-1-ol	ME709205	1.34	1.33	0.75	0.77	1.33	1.55	0.73	0.74	0.30	1.02
Styrene	ME709232	1.31	1.30	0.80	0.80	1.28	1.54	0.79	0.77	0.19	1.08
2-deoxyglucose	ME709343	1.32	1.43	0.80	0.80	1.37	1.37	0.79	0.78	0.16	1.03
Salidroside	ME709362	1.19	1.45	0.76	0.75	1.41	1.50	0.76	0.80	0.11	1.11
Bis(methylbenzylidene)sorbitol	ME708912	1.15	1.40	0.78	0.78	1.35	1.58	0.77	0.76	0.21	1.08
1,7-Dihydroxy-12-methyl-13-vinyl-2,10-dioxatetracyclo[5.4.1.1~8,11~.0~4,12~]tridecan-9-one	ME709159	1.22	1.43	0.79	0.77	1.35	1.50	0.79	0.76	0.18	1.06
2-Phenylethyl D-glucopyranoside	ME709069	1.23	1.45	0.76	0.75	1.36	1.53	0.77	0.76	0.18	1.08
2-(3-Phenylpropyl)tetrahydrofuran	ME709371	1.35	1.51	0.58	0.61	1.23	1.75	0.59	0.59	0.49	1.25
UNII:596C064IG4	ME709262	1.55	1.26	0.61	0.75	1.36	1.80	0.47	0.57	0.53	1.01
2,4,6-Octatriyn-1-ol	ME709308	1.49	1.55	0.54	0.56	1.61	1.51	0.51	0.50	0.48	1.17
(4S)-4-Hydroxy-4-methyltetrahydro-2H-pyran-2-one	ME709086	1.44	1.73	0.49	0.59	1.61	1.79	0.50	0.58	0.16	0.91
Sorbic acid	ME709149	1.48	1.49	0.52	0.61	1.64	1.80	0.53	0.61	0.19	0.97
{3-[(3,3-Dimethyl-2-oxiranyl)methyl]-4,6-dihydroxy-2-methoxyphenyl}acetic acid	ME709385	1.51	1.61	0.47	0.45	1.57	1.88	0.48	0.49	0.20	1.21
NP-020214	ME709063	1.47	1.80	0.46	0.49	1.52	1.81	0.43	0.51	0.32	1.08
(2R,5R,6R)-3-[(1E,3E)-hepta-1,3-dien-1-yl]-5,6-dihydroxy-2-(hydroxymethyl)cyclohexan-1-one	ME709121	1.35	1.62	0.64	0.62	1.43	1.60	0.62	0.62	0.26	1.10
4-(1,3-Benzodioxol-5-ylmethyl)-3-(3,4,5-trimethoxybenzyl)tetrahydro-2-furanol	ME709222	1.28	1.75	0.55	0.61	1.65	1.62	0.54	0.55	0.08	1.22
Monoethyl phthalate	ME709369	2.87	0.90	1.15	0.78	0.52	0.78	0.75	0.82	0.28	0.99
2-[(3,3-Dimethyl-2-oxiranyl)methyl]-4-(3-methyl-2-buten-1-yl)-1,3,5-benzenetriol	ME709399	2.22	1.39	1.08	0.60	0.85	1.31	0.64	0.71	0.26	0.74
3,6-dibenzyl-1,2-dihydro-1,2,4,5-tetraazine	ME709307	2.08	1.59	1.09	0.38	1.08	1.39	0.39	0.67	0.11	1.07
Pregabalin	ME709073	1.98	1.25	0.90	0.56	0.93	0.65	0.99	1.32	0.02	1.25
Dimethyl octanediimidate	ME709379	2.31	1.61	0.85	0.53	0.73	0.82	1.35	0.66	0.06	0.87
NP-008993	ME709128	2.11	1.45	0.74	0.21	1.15	0.99	1.43	0.67	0.02	1.03
3,8,9-trihydroxy-10-propyl-3,4,5,8,9,10-hexahydro-2H-oxecin-2-one	ME709109	1.04	1.36	2.37	1.09	1.15	0.47	0.51	0.88	0.24	0.68
Triisopropanolamine	ME708979	1.53	1.02	1.67	0.40	1.58	0.75	1.35	0.46	0.03	1.03
Bz-Arg-OEt	ME709312	1.47	1.00	2.45	0.69	1.44	0.45	0.70	0.64	0.03	0.93
3-Hydroxytetradecanedioic acid	ME709324	1.54	1.10	1.82	0.59	1.31	0.73	1.03	0.63	0.03	1.05
(2Z)-3,7-Dimethyl-2,6-octadien-1-yl 3-oxobutanoate	ME709323	1.38	1.08	2.10	0.60	1.42	0.81	0.90	0.46	0.12	0.94
4-[(2-Isopropyl-5-methylcyclohexyl)oxy]-4-oxobutanoic acid	ME709244	1.38	1.04	2.17	0.60	1.44	0.79	0.91	0.44	0.10	0.92
Oxepanone	ME709196	1.41	1.09	1.20	0.74	1.22	0.92	1.02	0.64	0.10	1.60
Dibenzylamine	ME709045	1.53	1.06	1.50	0.59	0.86	0.86	1.34	0.60	0.27	1.31
N,N^-Diphenylguanidine	ME709135	1.73	1.17	1.88	0.42	0.98	0.97	1.17	0.49	0.01	0.98
MFCD08277025	ME709349	0.87	2.21	0.84	0.57	0.54	0.40	1.16	2.18	0.03	1.02
Capryloylglycine	ME709359	1.07	1.62	0.68	0.55	0.34	0.63	1.04	2.77	0.10	1.02
Etodolac	ME709322	0.82	1.73	0.79	0.64	0.63	0.56	1.10	2.48	0.06	1.00
2-[(Carboxymethyl)amino]-7-octenoic acid	ME709315	1.71	1.25	1.42	0.55	0.39	0.75	0.96	1.96	0.09	0.66
Pumiliotoxin 251D	ME709140	1.20	1.47	0.94	0.48	0.50	0.59	1.42	2.14	0.01	1.07
L-decyline	ME709286	1.53	1.40	0.87	0.45	0.63	0.63	1.19	2.07	0.03	1.01
Linoleamide	ME708941	1.53	1.44	1.05	0.66	0.43	0.60	1.01	2.01	0.01	1.09
octadec-9-ynoic acid	ME708939	1.53	1.44	1.05	0.66	0.43	0.60	1.02	2.00	0.01	1.09
(2S,8R)-2-Amino-8-hydroxydecanoic acid	ME709370	1.02	1.21	1.59	0.89	0.50	0.47	0.90	2.28	0.04	0.88
Imagabalin	ME709065	1.18	0.97	1.24	1.01	0.46	0.47	0.65	2.83	0.03	0.95
Ethyl N-[(2-isopropyl-5-methylcyclohexyl)carbonyl]glycinate	ME709248	0.49	1.51	0.60	1.32	0.38	1.16	0.89	2.38	0.04	1.05
2S-Amino-tridecanoic acid	ME709396	0.61	1.39	0.96	1.21	0.40	0.76	0.62	2.67	0.11	1.10
(2E,6Z)-Nona-2,6-dienal	ME709141	0.59	1.10	0.88	1.33	0.43	0.69	0.68	2.83	0.10	1.23
(2Z)-2-Nonenoic acid	ME709047	0.63	1.18	0.85	1.27	0.52	0.79	0.67	2.73	0.08	1.13
3-Hydroxynonanoic acid	ME709265	0.58	1.19	0.85	1.26	0.49	0.77	0.66	2.88	0.07	1.09
2-Aminonicotinic acid	ME709151	0.56	1.32	1.48	0.54	0.99	0.91	0.52	2.53	0.41	0.53
Ethyl 5-oxotetrahydro-2-furancarboxylate	ME709233	0.39	1.10	0.72	0.92	0.84	1.16	0.92	3.11	0.16	0.39
l-Histidinal	ME708906	1.31	0.86	0.36	1.47	0.83	1.31	1.01	0.86	0.83	1.16
NJ5000000	ME709132	0.70	0.64	0.88	1.99	0.86	1.49	0.92	0.62	0.73	1.14
2^-Deoxycytosine	ME708961	0.84	0.94	0.93	2.01	0.78	0.92	1.26	0.83	0.77	0.58
2-Dimethylamino-5,6-dimethyl-4-hydroxypyrimidine	ME708997	1.23	0.89	0.73	1.88	0.80	0.98	0.93	0.50	1.18	0.90
9-hydroxy-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylic acid	ME709176	0.88	1.13	0.38	1.94	1.12	1.15	1.00	0.93	0.10	1.23
Tyramine	ME709319	0.52	0.83	0.67	2.05	1.35	1.08	0.83	1.72	0.08	0.61
ENU	ME709156	0.63	1.41	0.43	0.87	0.72	2.01	0.85	1.87	0.01	1.00
(6S)-2,6-Anhydro-6-[(1S)-2-isopropyl-5-methylcyclohexyl]-L-gulonic acid	ME709384	0.65	1.69	0.79	0.77	0.55	1.31	0.74	2.32	0.14	0.84
PPG n5	ME709213	0.66	1.26	0.99	0.89	0.75	1.17	0.85	2.34	0.25	0.61
4-Oxocyclohexanecarboxylic acid	ME709332	0.41	1.98	0.77	1.06	1.03	1.18	0.70	2.06	0.13	0.38
(1S,3R,4S)-3,4-Dihydroxycyclohexanecarboxylic acid	ME709138	0.39	1.49	0.84	1.10	1.05	1.59	0.76	2.00	0.08	0.40
Orcinol	ME709237	0.35	1.44	0.84	1.07	1.04	1.46	0.75	2.28	0.15	0.31
2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol	ME709134	0.57	1.24	0.94	1.01	1.18	1.74	0.88	1.40	0.29	0.52
CMPF	ME709313	0.17	1.51	1.13	1.46	0.72	1.65	1.06	1.56	0.08	0.34
NP-019360	ME709389	0.37	1.05	0.73	1.61	0.82	1.92	0.74	1.90	0.17	0.41
PENICILLIC ACID	ME709402	0.33	0.97	0.79	1.66	0.77	1.92	0.83	1.75	0.39	0.34
MX5800000	ME709229	0.42	1.23	0.71	1.28	0.86	1.88	0.86	1.97	0.21	0.29
ON1225000	ME709368	0.52	1.24	0.75	1.31	1.01	1.59	0.80	1.83	0.19	0.50
2-Oxobutyric acid	ME708966	1.08	0.69	1.58	0.96	0.94	0.43	1.89	0.90	0.01	1.40
8-Hydroxyquinoline	ME709375	1.05	0.56	1.13	0.99	1.25	0.81	1.70	1.87	0.08	0.23
HIAA	ME708955	0.78	0.61	1.02	0.56	1.41	1.08	2.11	1.22	0.00	1.00
L-Kynurenine	ME708958	0.78	0.61	1.02	0.56	1.41	1.10	2.09	1.23	0.00	1.00
alpha-Ketoglutaric acid	ME709013	1.17	0.91	0.76	0.85	1.27	1.23	1.80	1.08	0.00	0.66
2,5-Furandicarboxylic acid	ME709023	1.11	0.88	0.88	0.64	1.38	0.98	1.95	1.16	0.01	0.76
5-Hydroxy-2-furoic acid	ME709071	1.19	0.88	0.93	0.62	1.41	0.91	1.96	1.11	0.01	0.75
Citric acid	ME708923	1.01	0.86	0.87	0.59	1.35	1.13	2.03	1.16	0.00	0.75
(E)-Aconitic Acid	ME709043	1.15	0.79	0.84	0.59	1.42	1.11	1.95	1.08	0.00	0.83
Ethylparaben	ME709407	0.97	1.92	0.88	0.77	0.94	0.98	1.33	0.95	0.36	0.70
(R)-4^^-methoxydalbergione	ME709374	0.55	2.05	1.30	0.97	0.80	0.72	1.25	1.17	0.15	0.82
N,N-Dihydroxy-L-tryptophan	ME709150	0.90	2.18	1.17	0.94	0.95	0.66	1.05	0.91	0.05	0.98
NP-000124	ME709293	1.01	1.95	1.17	1.04	0.84	0.70	0.86	1.08	0.11	1.06
Octodrine	ME709321	1.14	1.39	1.09	0.99	1.03	0.94	0.85	1.26	0.51	0.62
Adenine	ME709206	0.94	2.06	0.77	1.23	0.98	0.80	0.73	1.25	0.35	0.69
N-Benzylformamide	ME709347	1.06	1.97	0.69	1.35	0.87	0.87	0.93	1.32	0.22	0.45
3,4-Dimethyl-5-pentyl-2-furanpropanoic acid	ME709356	1.07	1.57	0.99	1.34	0.89	1.02	0.87	1.03	0.16	0.87
1-Pentofuranosyl-2,4(1H,3H)-pyrimidinedione	ME709060	0.72	1.72	0.78	1.24	0.82	1.22	0.99	1.41	0.02	0.86
6-Hydroxy-5-methyl-4,11-dioxoundecanoic acid	ME709078	0.75	1.84	0.75	1.20	0.66	1.13	0.93	1.59	0.05	0.88
1,2-dihydroxyheptadec-16-yn-4-yl acetate	ME709334	0.77	1.67	0.84	1.15	0.87	0.96	1.26	1.22	0.07	0.98
D-PANTOTHENIC ACID	ME708950	0.79	1.49	0.91	1.33	0.96	1.17	0.98	1.19	0.01	0.96
Nicotinamide	ME708926	0.89	1.65	0.71	1.28	0.97	1.00	1.01	1.34	0.03	0.90
5,8,12-Trihydroxy-2-oxododecanoic acid	ME709028	0.85	1.85	0.95	0.97	1.14	1.21	0.71	1.20	0.10	0.81
3-Ureidopropionic acid	ME709105	0.67	1.54	0.86	1.01	1.22	0.91	0.96	1.45	0.15	1.06
Traumatic Acid	ME709068	0.73	1.78	0.79	1.31	1.00	0.99	0.62	1.35	0.18	1.09
Hypoglycine A	ME709037	1.63	2.00	0.71	0.52	0.82	0.72	1.44	0.95	0.06	0.98
8-Azabicyclo[3.2.1]octane-1,2,4-triol	ME708975	1.34	2.00	0.75	0.50	0.88	0.65	1.64	1.00	0.02	1.02
SL7524000	ME709014	1.40	1.94	0.75	0.54	0.86	0.67	1.54	1.03	0.05	1.03
N-[(2S)-2-Hydroxypropanoyl]-L-leucine	ME709246	1.13	2.08	0.69	0.73	0.79	0.68	1.48	1.25	0.12	0.84
N-(tert-Butoxycarbonyl)-L-leucine	ME709186	1.27	2.15	0.73	0.62	0.68	0.67	1.43	1.26	0.05	0.95
NP-000919	ME709348	1.37	1.80	0.79	0.62	0.79	0.88	1.38	1.13	0.13	0.92
N-Acetyl-L-leucine	ME708911	1.26	1.92	0.86	0.53	0.92	0.71	1.47	1.22	0.01	0.89
(4E)-2-Amino-3-oxo-4-undecenoic acid	ME709061	1.41	1.86	0.70	0.57	0.83	0.72	1.31	1.26	0.07	1.12
2-Acetyl-3,5-dimethylfuran	ME708944	1.31	1.81	0.79	0.61	0.80	0.68	1.45	1.27	0.01	1.10
Bemegride	ME708942	1.28	1.94	0.78	0.61	0.78	0.67	1.42	1.27	0.01	1.07
LQ1825000	ME709046	1.30	1.90	0.81	0.63	0.77	0.70	1.38	1.22	0.07	1.03
4-methyl-5-oxo-2-pentyl-2,5-dihydrofuran-3-carboxylic acid	ME709167	1.49	2.01	0.75	0.47	0.73	0.67	1.34	1.30	0.03	1.04
Methyl (2R,3S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate	ME709088	1.33	1.90	0.69	0.58	0.72	0.65	1.51	1.38	0.03	1.00
2-methyl-4-ethyl-5-propyloxazole	ME709268	1.42	1.93	0.72	0.60	0.70	0.64	1.40	1.38	0.02	1.02
hexapropymate	ME709204	1.40	1.92	0.71	0.60	0.69	0.65	1.43	1.39	0.02	1.00
NP-014287	ME709097	1.53	1.30	0.89	0.55	0.65	0.88	1.22	1.59	0.07	1.16
(E)-2-Butenyl-4-methyl-threonine	ME709314	1.26	1.35	0.86	0.60	0.97	0.89	1.37	1.52	0.09	0.89
NP-002322	ME709114	1.23	1.31	0.85	0.65	0.85	0.72	1.39	1.65	0.03	1.16
2-{[(2S)-1-Methoxy-1-oxo-2-hexanyl]amino}-2-oxoethanediazonium	ME709146	1.26	1.58	0.83	0.71	0.64	0.72	1.20	1.45	0.43	1.09
THREO-SPHINGOSINE, (-)-	ME709200	1.31	1.34	0.91	1.08	0.75	0.78	1.01	1.34	0.27	1.09
N-pentylpantothenamide	ME709367	1.07	2.06	0.61	0.69	0.92	0.58	1.11	1.75	0.04	0.97
TO0127900	ME709325	1.23	1.68	0.72	0.64	0.75	0.62	1.26	1.85	0.05	1.02
C8-HSL	ME709127	0.79	2.01	0.63	1.05	0.96	0.72	1.07	1.56	0.07	0.95
Azelaic acid	ME708964	0.91	1.67	0.73	0.95	0.93	0.94	1.03	1.46	0.40	0.84
(2E,6E)-2,6-Octadienal	ME709187	0.99	1.66	0.81	0.99	0.94	0.93	1.04	1.44	0.12	0.90
NP-018716	ME709154	0.91	1.75	0.78	0.98	0.86	1.10	0.94	1.41	0.21	0.90
NP-018661	ME709395	0.85	1.69	0.93	0.94	0.79	0.71	1.25	1.55	0.09	1.02
Sebacic acid	ME709152	0.81	1.57	0.80	0.76	0.86	1.09	1.08	1.58	0.28	1.05
2,4-Dimethyladipic acid	ME709120	0.92	1.62	0.78	0.77	0.87	0.86	1.19	1.79	0.13	0.87
2,5-Dimethyl-4-ethoxy-3(2H)-furanone	ME709202	0.92	1.60	0.75	0.81	0.84	0.91	1.18	1.73	0.17	0.89
4-Ethylguaiacol	ME709091	1.08	1.69	0.85	0.82	1.05	0.89	1.10	1.17	0.17	1.01
(2S)-2,3-Dihydroxypropyl pentadecanoate	ME709098	1.10	1.83	0.85	0.62	1.10	0.78	1.23	1.28	0.08	0.92
N-Nonanoylglycine	ME708928	1.09	1.73	0.78	0.77	0.94	0.79	1.28	1.39	0.03	1.01
Pivagabine	ME708899	1.15	1.76	0.80	0.77	0.90	0.76	1.23	1.34	0.03	1.07
gepefrine	ME709142	1.18	1.75	0.82	0.82	0.86	0.77	1.23	1.33	0.02	1.03
3-Tropanol	ME708970	1.18	1.70	0.82	0.83	0.87	0.79	1.21	1.33	0.03	1.06
6-[(1Z)-1-Propen-1-yl]-2,3,4,5-tetrahydropyridine	ME709101	1.18	1.71	0.81	0.83	0.88	0.79	1.21	1.35	0.02	1.04
Dihydrocapsaicin	ME709275	0.96	1.55	0.63	0.75	1.02	0.84	1.41	1.45	0.05	1.17
N-lauroylglycine	ME709273	0.96	1.43	0.88	0.78	0.82	1.03	1.34	1.47	0.07	1.05
(2S)-2-Amino-8-oxodecanoic acid	ME709259	1.65	1.29	1.17	0.46	0.85	0.75	1.35	1.31	0.06	0.90
ala-ile	ME709224	1.53	1.22	1.25	0.56	0.99	0.77	1.49	0.91	0.02	1.07
Gly-Ile	ME709406	1.49	1.14	1.21	0.59	0.99	0.70	1.80	0.93	0.07	0.88
N~1~-(5-Aminopentyl)-N~2~-(1H-indol-3-ylacetyl)-L-aspartamide	ME709342	1.45	1.73	0.87	0.70	0.97	1.04	1.44	0.61	0.08	0.90
Caprolactam	ME709184	1.62	1.51	0.97	0.60	0.86	0.85	1.32	0.93	0.31	0.85
N,N-Bis(2-hydroxyethyl)dodecanamide	ME709190	1.82	1.54	0.92	0.37	1.09	0.82	1.38	0.77	0.05	1.06
Atagabalin	ME709117	1.71	1.62	0.88	0.55	0.85	0.70	1.52	0.89	0.03	1.07
capuride	ME709053	1.64	1.66	0.91	0.57	0.81	0.82	1.52	0.88	0.03	0.97
NP-011548	ME708929	1.59	1.43	0.85	0.41	0.89	1.11	1.10	1.16	0.15	1.17
(8E)-10-Hydroxy-8-decenoic acid	ME709386	1.11	1.69	0.80	0.71	1.18	0.98	1.19	0.97	0.27	0.96
Ricinoleic Acid	ME709252	1.17	1.63	0.96	0.59	1.18	1.08	1.12	1.02	0.11	0.94
4-oxododecanedioic acid	ME709283	1.32	1.57	1.10	0.80	1.03	1.01	0.99	0.83	0.10	1.07
9-Nitrooleate	ME709333	1.59	1.71	0.91	0.62	0.98	1.01	1.04	0.95	0.08	0.91
(2S)-4-Methyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]methyl}amino)pentanoic acid (non-preferred name)	ME709201	0.93	1.18	0.93	1.13	1.30	1.69	1.29	1.08	0.02	0.07
2-Hydroxybenzothiazole	ME709266	0.93	1.21	1.25	1.11	1.18	1.02	1.26	1.20	0.31	0.24
Pseudomonas quinolone signal	ME709365	1.07	1.48	1.01	1.30	0.98	1.29	1.13	1.18	0.05	0.14
Tasimelteon	ME709263	0.96	1.64	1.08	1.23	0.98	1.10	1.25	1.29	0.02	0.07
(2Z,4E)-2,4-Hexadienedial	ME709216	0.95	1.39	1.22	1.26	1.08	1.08	1.20	1.31	0.02	0.11
5-Hydroxy-6-methyl-5,6-dihydro-2H-pyran-2-one	ME709144	0.90	1.40	1.22	1.24	1.05	1.10	1.21	1.36	0.03	0.14
DL-Glutamine	ME708946	0.67	0.92	0.82	0.92	0.67	1.39	1.20	1.54	0.01	1.82
Corticosterone	ME709001	0.61	0.77	1.11	0.87	0.74	1.91	1.09	1.70	0.00	1.01
DL-Serine	ME708935	0.52	0.91	0.67	1.30	0.57	1.56	1.22	1.88	0.01	1.21
D-Sphingosine	ME709292	0.39	1.34	1.09	1.34	0.43	1.30	1.29	1.57	0.02	1.04
Cyclohexylamine	ME709194	0.63	1.17	1.17	0.87	1.07	0.76	1.11	1.71	0.02	1.36
NP-003459	ME709278	0.59	1.29	1.02	0.79	1.19	1.02	0.80	1.87	0.36	0.92
Glycocholic acid	ME709331	0.80	1.29	0.62	0.85	1.14	1.84	1.13	1.05	0.02	1.08
L-Hydroxyproline	ME709052	0.88	1.29	0.55	0.69	1.02	1.63	1.26	1.31	0.02	1.18
Serotonin	ME709104	0.81	1.50	0.41	0.92	1.15	1.49	1.13	1.21	0.01	1.21
Capsi-amide	ME709139	0.86	1.06	1.09	0.73	0.87	1.73	1.29	1.01	0.08	1.14
lysophosphatidylethanolamine (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)	ME709251	0.68	0.93	0.77	0.82	0.89	1.83	1.59	1.26	0.05	0.99
4-Hydroxybenzaldehyde	ME708998	0.58	1.41	0.96	1.25	0.88	1.02	1.41	1.60	0.01	0.61
L(-)-Pipecolinic acid	ME708925	0.49	1.49	1.04	1.32	0.77	1.04	1.17	1.75	0.01	0.64
Diphenylamine	ME709072	0.91	1.54	0.83	1.09	0.92	1.12	1.27	1.49	0.01	0.54
N-Acetyl-alpha-neuraminic acid	ME709287	0.67	1.60	0.79	1.12	0.92	1.11	1.12	1.74	0.03	0.61
muramic acid	ME709236	0.62	1.05	0.73	1.08	1.21	1.22	1.58	1.76	0.03	0.41
DL-Lactic Acid	ME708987	0.71	1.03	1.10	1.16	0.89	1.24	1.66	1.34	0.00	0.58
2-Methylthiazolidine	ME709133	0.56	0.99	0.91	1.33	0.82	1.49	1.37	1.55	0.00	0.74
Chromone	ME709056	0.64	1.29	0.85	1.24	0.98	1.31	1.30	1.50	0.00	0.59
NP-020521	ME709077	1.12	1.04	0.91	1.21	0.53	1.20	1.11	1.57	0.10	1.04
6-Hydroxycaproic acid	ME709062	1.05	1.03	1.12	1.10	1.09	0.99	0.79	1.27	0.05	1.41
1-Piperideine	ME709298	0.75	1.15	0.81	1.13	0.94	1.11	1.13	1.28	0.52	1.10
2-Butyl-6-methoxyphenol	ME709247	0.77	0.95	1.01	0.93	1.34	1.19	1.16	1.13	0.54	0.85
D-Homoproline	ME708920	0.74	1.20	0.71	1.43	1.23	0.98	1.07	1.50	0.01	0.92
cystine	ME709102	0.70	1.20	0.80	1.02	0.85	1.75	1.06	1.35	0.01	1.06
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (11Z)-11-icosenoate	ME709030	0.73	1.24	0.74	1.10	1.00	1.57	1.15	1.13	0.01	1.17
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-hydroxypropyl (9Z)-9-hexadecenoate	ME709288	0.76	1.22	0.86	1.18	0.96	1.39	1.07	1.20	0.02	1.19
Bis(4-ethylbenzylidene)sorbitol	ME708996	1.00	1.16	1.00	1.16	0.89	1.50	0.95	1.09	0.00	1.06
Dioxy-creatinine	ME708915	0.95	1.23	0.93	1.11	0.77	1.32	1.05	1.32	0.01	1.14
L(+)-Ornithine	ME709106	0.86	1.40	0.90	1.03	1.02	1.28	0.96	1.16	0.10	1.14
MFCD00016472	ME709125	0.87	1.20	0.98	1.08	0.98	1.45	0.88	1.00	0.26	1.19
NP-001445	ME709017	0.65	1.22	0.80	1.28	1.05	1.12	1.52	1.14	0.01	1.02
1-(3-Hydroxypropanoyl)-1,3,6,8-tetramethyl-1,2,4a,5,6,7,8,8a-octahydro-2-naphthalenecarboxylic acid	ME709074	0.72	1.16	0.70	1.41	1.04	1.10	1.38	1.13	0.01	1.19
2,4,9a-Trimethoxy-3,4a,5-trimethyl-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-6-ol	ME708930	0.66	1.25	0.79	1.42	0.97	1.11	1.38	1.16	0.01	1.05
3-{2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-decahydronaphthalen-1-yl]-1-hydroxyethyl}-2,5-dihydrofuran-2-one	ME709027	0.67	1.31	0.79	1.48	0.90	1.10	1.35	1.13	0.00	1.08
Cytidine	ME708959	0.68	1.16	0.97	0.95	0.88	1.13	1.56	1.57	0.00	0.86
glu-tyr	ME709092	0.58	1.15	1.06	1.04	0.97	1.13	1.55	1.48	0.00	0.81
N,N-dimethylarginine	ME709124	0.78	1.11	1.03	0.97	0.98	1.08	1.55	1.37	0.01	0.91
Methyl alpha-aspartylphenylalaninate	ME709130	0.77	1.06	1.01	1.05	0.94	1.14	1.45	1.32	0.01	1.05
5-methyldeoxycytidine	ME709048	0.70	1.11	0.91	1.07	1.02	1.14	1.42	1.43	0.00	1.00
Indole-3-lactic acid	ME709291	0.76	1.07	0.90	1.01	1.03	1.17	1.45	1.42	0.01	1.00
(4R)-5-Hydroxy-L-leucine	ME709173	0.68	1.10	0.98	1.09	0.98	1.25	1.31	1.50	0.02	0.86
L-Glutamic acid	ME708948	0.86	1.15	0.98	0.96	0.99	1.19	1.32	1.42	0.02	0.91
4-Phenylbutyric acid	ME709377	0.56	1.01	0.89	1.09	0.78	1.29	1.51	1.55	0.15	1.00
N(tau)-Methyl-L-histidine	ME709217	0.66	1.11	0.98	0.99	0.82	1.38	1.27	1.70	0.01	0.83
PEG n8	ME708937	0.60	1.33	0.82	0.97	0.99	1.25	1.19	1.53	0.01	1.15
1-arachidonoyl-sn-glycero-3-phosphoethanolamine	ME708943	0.76	1.00	1.12	1.12	0.97	1.15	1.43	1.02	0.00	1.27
1-linoleoyl-sn-glycero-3-phosphoethanolamine	ME708954	0.76	1.11	1.06	1.13	0.98	1.33	1.24	1.01	0.00	1.22
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl (7Z,10Z,13Z,16Z)-7,10,13,16-docosatetraenoate	ME709170	0.82	1.15	0.88	1.11	0.96	1.27	1.31	1.11	0.03	1.21
Pipecolic acid	ME708910	0.83	1.18	1.08	1.28	0.89	1.22	1.12	1.20	0.01	1.01
Thymidine	ME709108	0.71	1.12	1.19	1.27	0.88	1.17	1.20	1.25	0.01	1.00
Thymine	ME709041	0.81	1.10	1.14	1.28	0.93	1.09	1.19	1.27	0.00	0.98
(2Z,12Z)-2,12-Tetradecadiene-4,6,8,10-tetrayne	ME709084	0.99	1.11	1.13	1.11	1.05	1.10	1.19	1.10	0.00	1.03
9-Anthroic acid	ME708904	0.96	1.11	1.13	1.10	1.04	1.18	1.16	1.10	0.00	1.03
Caffeine	ME708897	0.97	1.14	1.09	1.08	0.99	1.12	1.14	1.16	0.00	1.14
LU3453000	ME709119	0.90	1.14	0.99	1.12	1.05	1.08	1.17	1.20	0.02	1.17
Pyridoxamine	ME708962	0.68	1.24	1.02	1.05	1.04	1.05	1.22	1.35	0.00	1.19
DL-Lysine	ME708916	0.78	1.19	0.95	1.07	1.02	1.14	1.19	1.33	0.00	1.18
D-(+)-Pipecolinic acid	ME708919	0.78	1.19	0.94	1.07	1.02	1.13	1.19	1.33	0.00	1.19
Golotimod	ME709360	0.78	1.15	1.09	1.13	0.94	1.06	1.31	1.29	0.01	1.07
Bis(8-methyl-8-azabicyclo[3.2.1]oct-3-yl) (1S,4S)-1-phenyl-1,2,3,4-tetrahydro-1,4-naphthalenedicarboxylate	ME708999	0.81	1.19	0.99	1.19	0.97	1.22	1.12	1.17	0.01	1.17
N-Aceyl-L-tyrosine	ME709301	0.83	1.19	1.04	1.10	0.93	1.20	1.15	1.25	0.01	1.13
Benzaldehyde	ME709305	0.82	1.25	1.03	1.12	1.01	1.09	1.25	1.27	0.02	0.92
(2E)-3-(3-Hydroxyphenyl)acrylaldehyde	ME708896	0.85	1.19	1.01	1.14	0.98	1.16	1.19	1.27	0.00	1.02
L-Phenylalanine	ME708895	0.85	1.19	1.02	1.14	0.98	1.16	1.19	1.26	0.00	1.02
glu-leu	ME709033	0.77	1.19	1.01	1.11	0.99	1.23	1.22	1.27	0.00	1.01
L-gamma-Glutamyl-L-leucine	ME709239	0.82	1.20	0.94	1.09	0.99	1.23	1.22	1.28	0.01	1.03
L-Isoleucine	ME708892	0.84	1.25	0.95	1.23	1.05	1.22	1.11	1.25	0.00	0.88
9,10-Dihydroxy-11-(3-pentyl-2-oxiranyl)undecanoic acid	ME709178	0.77	1.22	1.05	1.26	1.00	1.27	0.93	1.30	0.01	0.99
Valine	ME708903	0.85	1.19	1.01	1.13	0.98	1.38	1.06	1.21	0.00	1.00
L-Histidine	ME708991	0.65	1.20	0.99	1.12	0.95	1.27	1.11	1.45	0.03	1.04
Ureidopropionic acid	ME709082	0.70	1.20	0.81	1.02	0.97	1.38	1.21	1.38	0.13	1.02
DL-Tryptophan	ME708894	0.81	1.23	0.90	1.00	1.03	1.33	1.13	1.36	0.00	1.01
4-Indolecarbaldehyde	ME709009	0.89	1.19	0.91	1.02	1.05	1.28	1.11	1.35	0.00	1.01
Indole	ME708995	0.86	1.22	0.89	1.00	1.07	1.28	1.12	1.37	0.00	0.98
L-Valine	ME708898	0.72	1.31	0.84	1.26	1.04	1.15	1.11	1.35	0.00	1.03
Furaltadone	ME709036	0.58	1.29	0.88	1.16	0.90	1.05	1.30	1.58	0.00	1.07
ascopyrone M	ME708972	0.69	1.29	0.95	1.21	0.99	1.03	1.22	1.39	0.02	1.03
Meglutol	ME708960	0.65	1.28	0.93	1.18	0.98	1.02	1.22	1.47	0.02	1.06
UQ1000000	ME709038	0.89	1.26	0.97	1.16	0.96	0.97	1.27	1.40	0.01	0.89
5-Methylcytosine	ME709085	0.84	1.08	0.92	1.11	1.08	0.96	1.43	1.37	0.01	1.00
Pyrone	ME709199	0.77	1.23	0.99	1.09	1.10	0.93	1.30	1.33	0.01	1.06
Aprobarbital	ME709404	0.73	1.09	0.78	0.78	1.05	1.15	1.62	1.48	0.02	1.11
Tetraacetylethylenediamine	ME709094	0.93	1.05	0.85	0.76	1.03	1.29	1.63	1.30	0.01	0.94
3-Hydroxyanthranilic acid	ME709166	0.88	0.90	0.92	0.90	1.15	1.29	1.40	1.33	0.01	1.03
QS4476500	ME708921	0.90	0.87	0.84	0.83	1.15	1.44	1.33	1.33	0.00	1.12
Homo-L-arginine	ME709162	0.69	1.08	0.72	0.88	1.08	1.45	1.41	1.53	0.01	0.93
Tetranor-12(S)-HETE	ME709329	0.88	0.96	0.65	0.88	0.99	1.48	1.29	1.41	0.24	1.07
Gamma-Hydroxybutyric acid	ME708990	1.14	0.96	0.89	0.84	1.11	0.91	1.30	1.43	0.04	1.24
Creatinine	ME708957	0.97	1.02	1.21	1.14	1.10	0.92	1.41	1.09	0.01	0.92
MFCD00037215	ME709155	0.92	1.07	1.01	0.75	1.33	0.95	1.40	1.12	0.01	1.30
(S)-(+)-allantoin	ME709118	0.90	1.13	1.06	0.86	1.03	0.95	1.50	1.29	0.00	1.09
Norophthalmic acid	ME709158	0.84	1.09	1.04	0.96	1.01	1.18	1.57	1.14	0.01	0.96
4-Methyleneglutamine	ME709004	0.88	1.06	1.05	0.86	1.26	1.14	1.43	1.07	0.02	1.04
L-(+)-Citrulline	ME709012	0.86	1.06	1.05	0.87	1.27	1.15	1.42	1.07	0.01	1.04
2-Amino-3-methoxybenzoic acid	ME709076	0.74	1.45	1.14	1.21	1.20	1.02	1.25	0.98	0.01	0.75
D-(+)-Proline	ME708953	0.91	1.23	1.03	1.35	0.99	1.14	1.23	1.22	0.01	0.59
Vanillin	ME709376	1.02	1.15	1.10	1.17	1.10	1.19	1.16	1.05	0.18	0.67
Fenfuram	ME709289	0.65	1.27	1.32	1.42	1.10	1.22	0.91	0.91	0.08	0.92
4-Hydroxybenzotriazole	ME709080	0.94	1.19	1.19	1.52	0.99	0.91	0.94	1.03	0.00	1.13
L-Methionine sulfoxide	ME708901	0.93	1.18	1.15	1.22	1.17	0.96	1.03	1.13	0.00	1.03
Pentahomoserine	ME708902	0.92	1.28	1.01	1.32	1.13	1.06	1.11	0.92	0.00	1.05
Phenylisocyanate	ME709320	1.19	1.24	0.95	1.06	1.36	1.34	0.92	0.92	0.02	0.77
N6-Acetyl-L-lysine	ME709188	1.04	1.07	0.90	0.91	1.43	1.29	1.25	1.07	0.01	0.80
3-Indoleacetamide	ME709171	1.31	0.99	0.94	1.07	1.18	1.24	1.02	1.12	0.01	0.91
3-Indoleacetonitrile	ME709254	1.10	1.11	0.99	1.03	1.14	1.14	1.10	1.20	0.01	0.97
5-Hydroxy-DL-tryptophan	ME709025	1.13	1.13	1.00	1.04	1.20	1.15	1.10	1.13	0.00	0.89
(+/-)-Camphoric acid	ME709191	0.90	1.37	0.87	0.89	1.30	1.35	0.90	1.10	0.47	0.68
5-[(5-Hydroxytetrahydro-2-furanyl)methyl]-1,3-benzenediol	ME709179	0.82	1.41	0.84	1.00	0.87	1.42	1.11	1.27	0.26	0.82
2-phenyl-2,4,6,7-tetrahydrothiino[4,3-c]pyrazol-3-ol	ME709390	0.93	1.43	1.01	0.90	1.10	1.34	1.02	1.20	0.13	0.70
D-(+)-Pyroglutamic Acid	ME708931	1.00	1.42	0.85	1.01	1.03	1.21	1.13	1.34	0.03	0.73
N-[1-Carboxy-3-(methylsulfinyl)propyl]glutamine	ME709049	0.45	1.07	1.37	1.24	1.06	0.75	1.75	1.40	0.01	0.64
3-amino-2-phenyl-2H-pyrazolo[4,3-c]pyridine-4,6-diol	ME709403	0.70	0.75	1.41	1.48	0.69	0.94	1.38	1.45	0.03	0.97
Cyclo(phenylalanyl-prolyl)	ME709380	0.69	0.97	1.18	1.26	0.86	0.80	1.51	1.47	0.04	1.04
2-(tert-butyl)-1,3-thiazolane-4-carboxylic acid	ME709373	0.57	0.83	0.98	1.15	0.60	1.00	1.69	1.88	0.04	1.09
S-Allyl-L-cysteine	ME709177	0.52	0.70	0.86	1.26	0.54	1.04	1.58	2.16	0.02	1.13
N-Tridecanoylglycine	ME709279	0.78	1.11	0.86	0.77	0.71	1.03	1.86	1.26	0.10	1.43
N-(3-acetamidopropyl)pyrrolidin-2-one	ME709185	0.70	0.92	0.79	0.77	0.97	1.16	1.79	1.70	0.01	1.00
N4-Acetylcytidine	ME709181	0.61	0.93	0.84	1.01	0.90	1.11	1.68	1.72	0.01	1.00
Indole-3-acetic acid	ME709218	0.79	1.28	0.86	1.11	0.74	0.83	1.56	1.53	0.01	1.12
Piperonylonitrile	ME709351	0.65	1.12	0.76	0.89	0.82	0.86	1.65	1.78	0.03	1.33
L-(+)-Arginine	ME708956	1.06	1.45	1.35	0.98	1.12	1.14	0.84	0.70	0.02	1.19
Taurochenodeoxycholic acid	ME709269	0.63	1.88	1.29	1.14	1.03	0.93	0.77	0.85	0.02	1.34
Creatine	ME708909	0.86	1.32	1.96	1.62	0.66	0.86	0.77	0.79	0.02	0.93
Dodecanedioic acid	ME709212	0.84	1.86	1.65	1.41	0.79	0.65	0.52	1.11	0.02	0.92
Dihydrothymine	ME709083	1.29	2.03	1.07	1.40	0.73	0.97	0.67	0.69	0.01	0.92
3-Amino-2-naphthoic acid	ME709391	1.09	1.54	1.42	1.64	0.70	0.81	0.76	0.77	0.03	1.06
Methyl indole-3-acetate	ME709182	1.11	1.56	1.37	1.50	0.76	0.92	0.77	0.76	0.01	1.03
N-Acetylimidoquinone	ME709383	1.08	1.64	1.32	1.33	1.49	0.86	0.95	0.52	0.02	0.50
.alpha.-Apocholic acid	ME709058	0.55	1.01	1.34	1.36	1.49	0.80	1.08	1.10	0.02	1.06
N-Methylglutamate	ME709327	0.40	1.23	1.52	1.32	1.51	1.01	1.28	0.56	0.25	0.72
1,1,6-Trimethyl-1,2-dihydronaphthalene	ME709148	0.59	0.65	0.70	0.75	0.61	2.13	2.30	0.69	0.80	0.68
9,10-Dihydrokadsurenone	ME709277	0.60	1.53	0.43	0.45	0.64	2.03	2.13	0.93	0.10	0.99
PEG n5	ME708952	0.65	1.00	0.75	0.84	0.66	3.15	0.64	1.04	0.25	0.85
3,4-Dihydroxy-5-(3-methyl-2-buten-1-yl)-2-(4-methylpentanoyl)-2-cyclopenten-1-one	ME709284	0.67	0.45	0.90	0.45	0.77	3.16	0.90	0.70	1.37	0.64
DEHYDROCOSTUS LACTONE	ME709336	0.58	0.78	0.65	0.58	0.70	3.74	0.74	0.81	0.58	0.69
2-Pentyl-3-phenyl-2-oxiranecarboxylic acid	ME709242	0.50	0.51	0.81	0.92	0.48	3.53	0.80	0.84	0.84	0.65
Dihydrokawain	ME709330	0.61	0.75	0.73	0.70	0.65	3.35	0.75	0.68	1.04	0.69
4-Propylbenzoic acid	ME709032	0.72	0.87	0.87	0.85	0.79	1.79	0.90	0.89	1.46	0.93
Panthenol	ME709008	0.71	0.82	0.88	0.83	0.93	1.75	0.81	0.82	1.66	0.89
Diethyleneglycol dibenzoate	ME709163	0.55	0.93	0.95	0.86	0.75	2.16	0.66	0.83	1.63	0.74
Aethusin	ME709261	0.75	0.77	0.86	0.77	0.79	2.06	0.75	0.79	1.40	1.17
2-(2E)-2-Octen-1-ylcyclopentanone	ME709209	0.84	0.80	0.83	0.77	0.75	2.29	0.73	0.80	1.31	0.92
MI5550000	ME709221	0.66	0.76	0.91	0.81	0.67	2.33	0.81	0.85	1.41	0.85
MDPV	ME709238	0.68	0.80	0.80	0.80	0.74	2.85	0.69	0.74	1.01	0.86
miglustat	ME708983	0.58	0.74	0.79	0.77	0.80	2.83	0.75	0.79	1.16	0.78
10-Undecenoic acid	ME709015	0.71	0.79	0.77	0.81	0.68	2.59	0.75	0.83	1.00	1.08
MFCD01111382	ME709137	0.83	0.72	0.77	0.95	0.68	2.51	0.71	0.94	0.89	0.96
4,9-dimethyldodeca-2,4,6,8,10-pentaenedial	ME708949	0.64	0.85	0.98	0.68	0.70	2.39	0.88	0.86	1.12	0.89
Phenol, 2-(3,7-dimethylocta-2,6-dienyl)-	ME709271	0.71	0.81	0.84	0.83	0.77	2.48	0.69	0.86	1.19	0.82
3-Dimethylallyl-4-hydroxymandelic acid	ME709100	0.81	0.92	0.80	0.76	0.87	2.38	0.77	0.75	1.03	0.91
Ethyl 3-methyl-3-(p-tolyl)glycidate	ME708938	0.71	0.84	0.85	0.82	0.77	2.47	0.82	0.81	1.01	0.87
Precocene II	ME708967	0.71	0.88	0.85	0.83	0.77	2.45	0.80	0.79	1.02	0.88
6-Hydroxy-4,9a-dimethoxy-3,4a,5-trimethyl-4a,5,6,7,8,8a,9,9a-octahydronaphtho[2,3-b]furan-2(4H)-one	ME708936	0.69	0.85	0.85	0.85	0.76	2.44	0.85	0.84	0.95	0.89
6-Methyl-6-(5-methyl-furan-2-yl)-hept-3-en-2-one	ME709055	0.73	0.79	0.85	0.82	0.78	2.45	0.84	0.84	0.99	0.87
Bis(2-butoxyethyl) ether	ME708985	0.66	0.88	0.89	0.85	0.75	2.35	0.81	0.90	0.98	0.89
5-Phenylvaleric acid	ME709003	0.79	0.84	0.83	0.83	0.78	2.38	0.84	0.83	0.96	0.89
1-[2-Methyl-3-(methylthio)allyl]cyclohex-2-enol	ME709129	0.76	0.84	0.86	0.82	0.79	2.32	0.86	0.84	1.00	0.87
Valerophenone	ME708986	0.77	0.87	0.86	0.82	0.81	2.34	0.85	0.84	0.95	0.84
3-Acetyl-6-hydroxy-4a,5-dimethyl-4a,5,6,7,8,8a-hexahydro-2(1H)-naphthalenone	ME708968	0.73	0.88	0.87	0.83	0.79	2.34	0.82	0.85	0.96	0.90
NP-021844	ME708976	0.74	0.84	0.88	0.87	0.77	2.34	0.84	0.86	0.97	0.86
(2Z)-2-Benzylidenehexanal	ME709044	0.76	0.81	0.89	0.86	0.76	2.31	0.77	0.86	1.12	0.85
(2Z)-4-Methyl-2-phenyl-2-pentenal	ME709285	0.74	0.85	0.92	0.81	0.85	2.24	0.82	0.87	1.02	0.88
nylon cyclic dimer	ME709165	0.71	0.84	0.95	0.78	0.71	2.52	0.80	0.80	0.97	0.88
1,6-Hexanediol diacrylate	ME709145	0.70	0.83	0.83	0.86	0.71	2.57	0.82	0.85	0.97	0.82
Arnicolide A	ME709281	0.63	0.84	0.81	0.80	0.67	2.63	0.81	0.81	1.09	0.90
Diisopropyl phthalate	ME709018	0.70	0.80	0.84	0.79	0.73	2.60	0.78	0.82	1.05	0.87
p-menth-3-ene	ME709354	0.79	0.82	0.76	0.79	0.72	2.52	0.84	0.88	0.91	0.93
Cuminaldehyde	ME708947	0.73	0.84	0.79	0.86	0.82	2.55	0.79	0.84	0.86	0.85
Palmitic Acid	ME709031	0.71	0.88	0.85	0.77	0.83	2.49	0.89	0.80	0.83	0.89
2444643WXK	ME708977	0.69	0.89	0.89	0.85	0.82	1.95	0.96	0.89	0.95	1.10
Texanol	ME709280	0.62	0.94	0.87	0.80	0.72	2.05	0.96	0.97	0.91	1.17
(1S)-1,5-Anhydro-1-benzyl-D-galactitol	ME709400	0.80	1.00	0.82	0.88	0.72	2.07	0.86	0.91	0.93	1.01
(3Z)-Hex-3-enyl isobutyrate	ME709039	0.75	0.79	0.91	0.82	0.80	2.16	0.97	0.83	1.08	0.88
5-Benzyldihydro-2(3H)-furanone	ME709131	0.77	0.81	0.94	0.86	0.78	2.13	0.91	0.84	1.03	0.93
3-oxoindane-1-carboxylic acid	ME708963	0.80	0.90	0.90	0.88	0.83	2.06	0.89	0.80	0.98	0.95
Allylcyclohexane	ME709220	0.80	0.91	0.89	0.86	0.82	2.17	0.88	0.82	0.92	0.89
Apocynin	ME708980	0.73	0.91	0.90	0.90	0.84	2.06	0.85	0.89	1.03	0.86
Nootkatone	ME709160	0.74	0.90	0.88	0.87	0.75	2.12	0.86	0.89	1.01	0.98
5-(4-Methoxyphenyl)-2-methyl-1-penten-3-one	ME709258	0.67	0.96	0.93	0.92	0.76	1.92	0.85	0.94	1.14	0.92
ML-236C	ME709231	0.68	0.97	0.86	0.81	0.76	2.05	0.85	0.95	1.28	0.83
Trolox	ME708984	0.68	0.89	0.89	0.84	0.80	2.16	0.85	0.90	1.14	0.84
3-Methoxycinnamic acid	ME709338	0.81	0.85	0.87	0.84	0.74	2.07	0.87	0.90	1.22	0.85
4-Ethoxy ethylbenzoate	ME708905	0.75	0.79	0.90	0.88	0.85	2.03	0.88	0.91	1.13	0.89
1-(5-Acetyl-2-hydroxyphenyl)-3-methyl-1-butanone	ME709011	0.72	0.89	1.05	0.90	0.93	2.19	0.90	0.73	0.78	0.84
(2Z)-2-Benzylidene-3-hydroxyheptanoic acid	ME709297	0.60	0.93	0.89	0.79	0.83	2.27	0.87	1.00	0.78	0.99
(2-(Dimethoxymethyl)-1-heptenyl)benzene	ME709264	0.71	0.89	0.70	0.74	0.94	2.36	1.10	1.05	0.52	0.88
16-Heptadecyne-1,2,4-triol	ME709318	0.85	1.40	0.70	0.65	1.08	2.19	0.69	0.74	0.61	1.02
5-Hydroxy-4-methoxy-6-(2-phenylethyl)-5,6-dihydro-2H-pyran-2-one	ME709296	0.82	1.08	0.70	0.74	1.01	2.34	0.73	0.78	0.88	0.88
(3E)-4-(4-Hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl)-3-buten-2-one	ME709211	1.07	1.34	0.73	0.72	1.12	1.38	0.76	0.78	1.00	1.13
PEG-4	ME708971	0.68	1.39	1.14	1.05	0.85	1.57	0.76	1.08	0.39	0.94
Lauramide	ME709016	0.89	1.02	1.07	0.85	0.71	1.55	1.12	1.14	0.54	1.02
MFCD00130070	ME709174	1.06	1.10	0.96	0.91	0.83	1.41	1.11	1.19	0.36	0.92
11-Nitro-1-undecene	ME708988	0.70	0.74	1.00	0.88	0.70	1.67	1.33	1.20	0.85	0.89
Dipropylene glycol	ME709019	0.91	0.94	0.81	0.80	1.05	1.94	0.84	0.93	0.83	0.89
Levalbuterol	ME709310	0.78	1.03	0.85	0.92	0.99	1.88	0.92	0.98	0.69	0.87
(1E)-1-(4-Methoxyphenyl)-4-methyl-1,4-pentadien-3-one	ME709267	0.85	0.98	0.88	0.92	0.99	1.86	0.89	0.98	0.69	0.87
1-Methyl-1-benzylidene-acetone	ME709189	0.88	0.98	0.86	0.89	1.01	1.89	0.89	0.93	0.69	0.89
3,5-di-tert-Butyl-4-hydroxybenzaldehyde	ME708945	0.82	1.05	1.03	1.02	0.85	1.68	0.93	1.05	0.64	0.83
7a-Hydroxy-3,6-dimethyl-5,6,7,7a-tetrahydro-1-benzofuran-2(4H)-one	ME709192	0.86	1.13	1.09	1.02	1.03	1.65	0.77	0.89	0.74	0.69
3,4-Methylenesebacic acid	ME709223	0.67	1.14	0.90	1.08	1.06	1.64	0.91	0.98	0.52	1.02
(R)-3-Hydroxy myristic acid	ME709022	0.77	1.11	0.81	0.86	0.91	1.82	0.75	1.13	0.61	1.17
Methyl undec-10-enoate	ME709093	0.69	1.04	0.93	0.89	0.86	1.66	0.89	0.96	0.97	1.13
(±)-1-Octen-3-ol	ME709110	0.76	0.94	0.89	0.88	0.84	1.78	0.91	0.93	1.01	1.09
(3E)-3-propylidenephthalide	ME709147	0.85	0.93	0.93	0.88	0.88	1.71	0.87	0.87	1.08	1.01
Iodocarb (IPBC)	ME709172	0.74	0.92	0.91	0.92	0.85	1.78	0.89	0.92	1.12	0.96
2-Decylfuran	ME709050	0.79	0.96	0.89	0.94	0.78	1.60	1.04	1.00	0.86	1.15
NP-000615	ME709066	0.75	0.95	1.03	0.97	0.88	1.53	0.99	1.00	0.89	0.96
2,2,6,6-Tetramethyl-1-piperidinol (TEMPO)	ME709079	0.78	1.08	1.02	0.96	0.94	1.27	1.00	1.03	0.87	1.02
Gabapentin	ME708922	0.79	0.88	1.08	0.97	0.90	1.18	0.98	1.11	1.09	1.05
p-Hydroxybenzalacetone	ME709026	0.86	0.96	0.95	0.87	0.89	1.37	0.99	0.97	1.16	1.01
1-(3-Furyl)-1,4-pentanediol	ME709230	0.72	1.22	0.91	0.85	1.00	0.85	0.86	1.02	0.78	1.93
3-Oxooctanoic acid	ME709034	0.89	1.20	0.88	0.86	1.04	1.06	0.86	0.85	0.74	1.70
8-Amino-7-oxononanoic acid	ME709274	0.76	1.35	0.83	0.78	1.06	0.97	0.92	1.01	0.79	1.62
carglumic acid	ME709311	0.73	1.03	0.86	0.97	1.01	1.06	0.94	1.18	0.38	1.90
Ethyl furfurylacetate	ME709126	0.73	1.05	0.91	0.95	1.09	1.10	0.85	1.22	0.56	1.56
7-Methyl-2,6,9,12-tetraoxahexadecane	ME709388	0.56	0.86	0.88	0.74	0.77	1.61	0.87	1.41	0.98	1.39
Crotamiton	ME709226	0.68	0.83	0.81	0.83	0.69	1.80	0.74	0.96	0.96	1.86
piperidinecarboxylic acid	ME709304	1.56	0.65	1.20	1.00	0.82	0.67	1.10	0.91	0.94	1.17
Muscimol	ME709111	0.78	0.99	1.27	1.07	0.76	0.92	0.78	1.31	1.19	0.95
Pseudoconhydrine	ME709398	1.10	0.95	0.91	0.75	0.74	0.85	0.89	1.84	0.73	1.24

Factors:

F1	Treatment:HS14 \| Source:Artery Plasma
F2	Treatment:HS14 \| Source:Vein Plasma
F3	Treatment:HS21 \| Source:Artery Plasma
F4	Treatment:HS21 \| Source:Vein Plasma
F5	Treatment:HS7 \| Source:Artery Plasma
F6	Treatment:HS7 \| Source:Vein Plasma
F7	Treatment:LS \| Source:Artery Plasma
F8	Treatment:LS \| Source:Vein Plasma
F9	Treatment:n/a \| Source:n/a
F10	Treatment:Plasma Pool \| Source:Plasma Pool

Data matrix