Metabolomics Workbench : NIH Data Repository : Analyze Studies

Data for ST003736

(Analysis AN006130): Average values per metabolite and experimental factor (Units:µg/g)

Metabolite structure	F1	F2
10,11-Dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl...	4415.87	1823.51
10E,12Z-Octadecadienoic acid	3379.78	3061.12
1-[1-[1-[1-[1-[1-[1-[1-(1-Butoxypropan-2-yloxy)propan-2-ylox...	133143.30	234013.12
1,1,1-Trichloroethane	459763.39	397389.11
1-(11Z,14Z-eicosadienoyl)-glycero-3-phosphate	778.49	1260.85
1-18:1-lysoPE	5555.45	2817.38
1,1-dioxo-N-prop-2-enylthiolan-3-amine	1213.78	1135.05
11-Keto-beta-boswellic acid	2766.12	948.23
1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)...	13917.18	1112.18
1-(1Z-Octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)...	1714.36	1896.49
12,13-epoxy-9-alkoxy-10E-octadecenoate	4071.35	4768.82
1,2-Dioleoyl-sn-Glycero-3-Phosphocholine	13991.56	31829.41
1,2-Dipalmitoleoyl-sn-glycero-3-phosphocholine	1089.77	838.76
1,2-Diphenylhydrazine	1040419.49	1416262.96
1,2-Distearoyl-sn-glycero-3-phosphocholine	6449.28	11980.21
12-Ethyl-71,71-dihydroxy-8-isobutylbacteriochlorophyllide c	3442.00	3403.79
12-Hydroxydodecanoic acid	293.74	2435.70
1,3-Benzothiazole-2-sulfonamide	40786.21	30050.12
13^-Carboxy-alpha-tocopherol	307.36	717.60
1,3-dimethoxy-5-methyl-2-[(1R,6R)-3-methyl-6-(1-methyletheny...	2423.57	3328.12
13-Docosenamide	3495138.32	5681755.07
1,3-Propanediol	15416.22	15396.91
1,3-Thiazole-2-Sulfonamide	5774.76	5533.39
1-(4-Chlorophenyl)-3-naphthalen-1-ylurea	3870.16	6881.61
1-(4-Hydroxy-2-methylpyrimidin-5-ylmethyl)-3-(2-hydroxyethyl...	889.22	2284.51
1-(5-(2,3-Dichlorophenylthio)-4-nitrothiophen-2-yl)ethanone	1609.21	2985.75
15-cis-4,4^-Diapophytoene	4152.32	4568.34
1,5-Diaminobromo-4,8-dihydroxyanthraquinone	3513.20	4048.36
15d-Prostaglandin A1	3366.48	3365.66
1-[5-Ethyl-2-hydroxy-4-[[6-methyl-6-(1H-tetrazol-5-YL)heptyl...	1186.78	1330.58
16,16-dimethyl-PGE1	4573.98	4658.47
1,6-Dimethyl-4-isopropyltetralin	195.68	5.61
16Z,19Z,22Z,25Z,28Z,31Z-tetratriacontahexaenoic acid	11378.10	15548.16
18-Nor-4(19),8,11,13-abietatetraene	5618.11	5968.67
19-Noretiocholanolone	21737.54	22918.95
1-(9Z-heptadecenoyl)-sn-glycero-3-phosphoethanolamine	14460.62	6808.31
1-(9Z-nonadecenoyl)-glycero-3-phosphoethanolamine	4113.32	4259.45
1-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine	16624.92	6010.87
1-(9Z-tetradecenoyl)-sn-glycero-3-phosphocholine	2640.69	823.23
1-Aminocyclopropanecarboxylic acid	8607.30	8745.22
1-Benzyl-2-phenyl-1H-benzoimidazole	4704.52	4661.70
1-Benzyl-3-cetyl-2-methylimidazolium iodide	21.03	18.96
1-(Benzyloxy)-3-(3-fluorophenyl)benzene	3692.34	3859.41
1-beta-D-Galactosylsphingosine	4931.28	4675.11
1-Deoxyvaleric-acid	2275.02	2676.63
1-Heneicosanoyl-2-heptadecanoyl-glycero-3-phosphate	9870.83	17832.05
1-Heptadecanoyl-sn-glycero-3-phosphocholine	936763.73	816062.97
1-Heptanol	40066.29	49534.04
1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-sn-gly...	15688.82	41010.49
1-Hexylamine	712171.26	836795.61
1-hydroxy-5-[[(9S)-9-hydroxy-8,8-dimethyl-2-oxo-9,10-dihydro...	1629.27	1162.45
1-Meadoyl-3-meadoyl-sn-glycerol	2672.69	1004.63
1-Methylhistamine	6143.94	8297.80
1-Methylnicotinamide	1236.41	1952.25
1-Myristoleoyl-2-(1-enyl-palmitoyl)-sn-glycero-3-phosphochol...	3597.35	4400.81
1-octadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethan...	3206.67	2440.48
1-octadecyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-...	2563.96	654.72
1-Octadecyl Lysophosphatidic Acid	2986.64	2978.74
1-O-Hexadecyl-2-O-ethyl-SN-glycero-3-phosphorylcholine	6382.58	6761.42
1-O-Hexadecyl-sn-glycero-3-phosphocholine	1767.77	719.11
1-Oleoyl-2-acetyl-sn-glycerol	2159.27	2156.91
1-Oleoyl-2-myristoyl-sn-glycero-3-phosphocholine	12516.40	8557.06
1-Oleoylglycerone 3-phosphate	1777.66	83.81
1-O-Octadecyl-2-O-methyl-sn-glycero-3-phosphocholine	8303.99	10700.73
1-Palmitoyl-2-oleoyl-sn-glycero-3-phosphocholine	106180.48	62232.31
1-Palmitoyl-2-thiopalmitoyl phosphatidylcholine	276.17	452.31
1-Palmitoyl-3-osbondoyl-sn-glycerol	11018.26	3398.51
1-Pentadecanoyl-2-tetradecanoyl-glycero-3-phosphoethanolamin...	11287.17	5196.83
1-Pentadecanoyl-glycero-3-phosphoethanolamine	8287.06	7171.18
1-Phenyl-1-propanone	2781.48	2664.57
1-Phthalazinamine, N-(3-chlorophenyl)-4-phenyl-	2219.02	1469.88
1-Piperidinecarboxaldehyde	12084.00	11779.31
[(1R,2S,3R,4aR,5S,6R,8S,8aR)-5-[(3aS,5S,6aS)-3a,4,5,6a-tetra...	1454.24	412.19
(1R)-Glutathionyl-(2R)-hydroxy-1,2-dihydronaphthalene	2107.38	993.88
(1S,2S,4R,8R)-p-Menthane-1,2,8,9-tetrol	9829.08	9483.44
[(1S,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R...	1.57	0.86
(1S)-Deltamethrin	76367.97	87101.62
1-Stearoyl-2-arachidonoylglycerol	833.34	363.19
1-Stearoyl-2-Arachidonoyl PC-d8	2814.67	2098.85
1-Stearoyl-2-arachidonoyl-sn-glycero-3-phosphocholine	235120.09	948618.06
1-Stearoyl-2-arachidonyl-sn-glycero-3-phosphocholine	49128.43	52112.46
1-Stearoyl-2-docosahexaenoyl-sn-glycerol	5488.02	6755.29
1-Stearoyl-2-palmitoyl-sn-glycerol	2032.87	786.00
1-Stearoyl-2-vaccenoyl-sn-glycero-3-phosphocholine	148074.24	70244.13
2-(1H-indol-3-yl)-2-oxoacetaldehyde	1189.41	975.21
2-[2-[(2E,3aS,4S,5R,6aS)-Hexahydro-5-hydroxy-4-[(3S,4S)-3-hy...	2350.71	3215.36
2,2^:5^,2^^-Terthiophene	5950.61	7519.26
2-[(2-Amino-3-hydroxypropanoyl)amino]-3-sulfanylpropanoic ac...	3449.72	3628.32
2,2-Dimethylpentanoic acid	53564.27	53794.74
2-(((2-Ethylhexyl)oxy)carbonyl)benzoic acid	19346.56	23527.21
2-[(2^-Methylthio)heptyl]maleate	5887.96	1793.30
2-(2-nitrophenyl)-2,3-dihydro-1H-perimidine	1971.90	1098.72
2,3^,4,5^-Tetramethoxystilbene	118560.12	179058.29
2,3,7,8-Tetrachlorodibenzofuran	15317.55	16291.51
2-(3-acetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,1...	18.39	390.06
2-((3-Aminopropyl)amino)ethanethiol	1560.06	1205.57
2,3-Butanediol	1734.30	1702.45
2,3-Diaminopropionic acid	3575.50	3743.06
2,3-Dihydrobenzofuran	9490.40	8341.60
2^,3^-Dihydro-phytomenadione	2526.32	3008.98
2,3-Dihydroxy-4-methoxybenzoic acid	67227.01	158868.46
2,3-Diphenyl-3-(2-pyridinyl)acrylonitrile	10107.30	9860.52
2-[4-(3,4-Dichlorophenyl)-1,3-thiazol-2-yl]acetonitrile	2371.93	1583.12
2,4-Diaminobutyric acid	29824.30	29342.07
2-(4-Fluorophenyl)acetohydrazide	2411.80	3870.62
24-Methylcycloart-23-en-3beta-yl acetate	9649.08	10394.51
2,4-Pentanedione	6652.82	7026.86
2-[(4s)-6-(4-Chlorophenyl)-8-Methoxy-1-Methyl-4h-[1,2,4]tria...	1596.05	1753.99
25B-NBOMe	1601.80	1529.11
(25R)-3beta,4beta-dihydroxycholest-5-en-26-oate(1-)	1075.62	1325.37
2,6-Cyclolycopene-1,5-diol	6430.92	6141.89
2,6-Diaminooimelic Acid	2845.65	716.50
2,6-Dichloro-3-phenylpyridine	1005.95	6740.44
2,6-Dichloro-4-fluorobenzaldehyde	8333.48	9634.05
2,6-Dichlorobenzamide	212117.12	136348.40
2,6-Dichlorobenzonitrile	6256.27	6761.30
[2,6-Dihydroxy-4-({[5-hydroxy-2-(hydroxymethyl)-4,6-bis(3,4,...	9376.15	21068.77
{2,6-dimethoxy-4-[3-oxo-3-(2,4,6-trihydroxyphenyl)prop-1-en-...	9616.72	8694.66
2,8-Dichloro-3-dibenzofuranol	48624.70	54699.39
{2-[(9E)-hexadec-9-enoyloxy]ethyl}trimethylazanium	1396.64	795.69
2-(Acetamidomethylidene)succinic acid	1479788.55	1533016.40
2-Acetylfuran	18187.63	13660.94
2-Amino-1-phenylethanol	139846.04	115143.17
2-Amino-4,6-dichloropyrimidine-5-carbaldehyde	535718.63	890489.30
2-Amino-5,6-dihydro-4H-1,3-thiazine	177262.88	171903.77
2-Amino-5-bromo-2^-chlorobenzophenone	3643.18	3551.73
2-Amino-5-methyl-4-phenylthiazole	13314.29	19529.08
2-Aminoacetophenone	3491.75	3529.12
2-Aminobenzenesulfonamide	29745.26	27812.87
2-Aminoethyl dihydrogen phosphate	333120.11	235016.82
2-azaniumyl-5-[[1-(carboxylatomethylamino)-3-[(Z)-N-hydroxy-...	7847.00	9452.37
2-azaniumylethyl (2R)-2-[(9Z)-octadec-9-enoyloxy]-3-(stearoy...	880.46	5872.97
2-Bromo-5-fluorophenylacetic acid	10250.76	7128.68
2-Butoxyethanol	3899.41	5294.98
2-Chloro-1-(2-hydroxy-3,4-dimethoxyphenyl)ethanone	2934.48	4624.95
2-Chlorobenzoic acid	3287.61	3469.61
2-Chlorobenzophenone	6495.69	5959.19
2-Cyclohexyl-N-(1-isopropylpiperidin-4-yl)-6-methoxy-7-(3-(p...	0.53	0.99
2-Decenal	4471.19	4632.44
2^-Deoxyadenosine-5^-monophosphate	3002.45	2997.37
2^-Deoxyguanosine-5^-diphosphate	3207.39	4096.66
2^-Deoxymugineic acid	4313.11	3408.33
2-Dodecenal	1266.58	1837.89
2-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-d...	365429.00	345745.27
2-Furancarboxaldehyde	3502.94	3302.54
2-Hexadecenal	331.89	512.93
2-Hexaprenyl-6-hydroxyphenol	26155.43	7457.83
2-Hydroxy-2-methylbutyric acid	78600.17	55570.59
[2-hydroxy-3-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropyl] 2-(t...	6603.86	4463.61
2^-Hydroxy-4,4^,6^-trimethoxychalcone	6962.16	7698.61
2-Hydroxy-6-pentadecylbenzoic acid	3217.78	3922.14
2-Hydroxybutyric acid	1727694.29	1823469.94
2-Isopropoxy-5-trifluoromethyl-phenylamine	2632.02	3247.44
2-Mercapto-5-trifluoromethoxybenzothiazole	234573.85	268185.12
2-Methoxy-3,5-dimethylpyrimidine	40915.04	31174.56
2-Methoxy-4-[2-propenyl]phenyl 6-O-beta-D-glucopyranosyl-bet...	754.80	1441.32
2-Methoxy-6-all-trans-nonaprenylhydroquinone	3988.93	956.54
2-Methyl-3-furanthiol	39206.16	24878.96
2-Methylarachidonoyl-(2^-fluoroethyl)amide	2298.64	2718.63
2-Methylpropyl hexanoate	33453.84	30234.52
2-[N-Cyclohexylamino]ethane sulfonic acid	4083.71	3194.95
2-Octanamidoacetic acid	13309.88	4215.76
2-Phenylacetamide	1484.37	1170.22
2-Phenylaminoadenosine	12058.49	14209.52
2-Phenylphenol	80999.25	75120.05
2-Phenylpropylamine	1466.50	779.11
2-Phospho-D-Glyceric Acid	4797.27	3433.98
2-Propanamine, 2-methyl-N-(phenylmethylene)-, N-oxide	4535.33	4404.93
2-Propanoylthiazole	2384.41	2044.34
2-Propenoic acid, 3-phenyl-, phenylmethyl ester	2525.57	2699.90
2-Pyrimidin-2-yl-propionic acid	18371.01	16859.90
2-[(Pyrrolidinium-2-ylcarbonyl)amino]propanoate	3687.79	3006.70
(2R)-2-[[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-...	3445963.81	2548997.22
(2r)-3-(Hexadecyloxy)-2-methoxypropyl 2-(trimethylammonio)et...	8340.77	7946.30
[(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-bis(azaniumyl)-3-[(2S...	10.04	11.94
(2R,3R)-5,7-dihydroxy-2-{3,4,6-trihydroxy-5-oxo-8-[(2R,3R)-3...	581.20	1761.15
[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydrox...	2446.72	1376.30
(2R,3S,4S,5R,6R)-2-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymeth...	3610.42	4274.05
(2R,3S,5S,8R,9S,10S,13S,17R)-17-[(2S,3R,4R,5S)-3,4-dihydroxy...	1161.98	1038.93
(2S)-2-amino-3-[[3-hexadecanoyloxy-2-[(Z)-octadec-9-enoyl]ox...	1977.51	4120.85
(2S)-2-ammonio-5-{[(2R)-1-[(carboxylatomethyl)amino]-1-oxo-3...	13302.15	6966.68
[(2S,3R,4R,6R)-3-hydroxy-2-methyl-6-(12-oxo-3,13,23-triazahe...	5552.60	5290.00
(2S,3R)-5-hydroxy-3-[(2S,3R)-5-hydroxy-2-(4-hydroxyphenyl)-4...	416.56	2637.82
(2S,4S)-1-Acetoxy-16-heptadecene-2,4-diol	241.53	185.53
2-Thiophenethiol	36755.62	33760.51
2-Thiouracil	6149.32	6471.56
2-Undecanone	37334.83	44897.48
2-Undecylsulfonylacetic acid	11429.05	14130.06
3-(11,12-Dihydroxy-15,19-dotriacontadienyl)-5-methyl-2(5H)-f...	1163.88	2819.65
3,3^,4,4^-Tetrachlorobiphenyl	22988.81	23382.04
3-[3-[(4-Fluorophenyl)sulfonylamino]-1,2,3,4-tetrahydrocarba...	2237.11	1900.57
3,3-Difluoroandrostane-17-ol acetate	15861.62	15323.37
3-{3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-2-yl}propanoic ...	3069.86	4911.94
3,4-Bis[(3-hydroxyphenyl)methyl]oxolan-2-one	131.99	698.09
3,4-Difluoro-2-((2-fluoro-4-iodophenyl)amino)benzoic acid	6832.37	8441.60
3,4-Dihydrocoumarin	2492.15	1868.45
3,4-Dimethyl-5-pentyl-2-furantridecanoic acid	419.30	1964.20
3,4-Diphenyl-7-hydroxycoumarin	1461.84	3208.07
3-[(4-Hydroxy-3,5-dimethoxyphenyl)methyl]-4-[[4-[4-[[4-[(4-h...	1873.06	1536.12
3-(4-Methylpent-3-enyl)thiophene	12020.58	12040.50
3,5,5-Trimethyl-2-cyclohexen-1-one	4706.46	4390.77
3,5-Dinitrobenzamide	13112.22	14345.55
3,6,9,12,15,18,21-Heptaoxatricosane-21,23-diol	1850.36	1654.47
3,6-Epoxy-5,5^,6,6^-tetrahydro-b,b-carotene-3^,5,5^,6^-tetro...	1684.46	2143.48
(3a,5b,7a)-23-Carboxy-7-hydroxy-24-norcholan-3-yl-b-D-Glucop...	3816.77	3778.49
3-Acetyl-11-keto-beta-boswellic acid	3350.90	2583.74
3alpha-3-Hydroxytirucalla-7,24-dien-21-oic acid	253.67	8718.51
3-Amino-2,3-dihydrobenzoic acid	35105.20	46616.54
3-Amino-2-naphthoic acid	6349.34	1876.80
3-Amino-3-oxopropanoic acid	2757.47	3553.66
3-Amino-5-(3-thiophenyl)-2-thiophenecarboxamide	2480.89	2682.47
3beta-Hydroxy lanostane-7,11-dione acetate	2610.68	1152.97
3-Bromo-7-nitroindazole	3170.66	1944.71
3-Chloro-1H-pyrazol-4-amine	392.37	593.38
3-Chloroaniline	2788.81	3070.99
3-Decaprenyl-4,5-dihydroxybenzoic acid	18261.56	11501.01
3-Dehydrosphinganine	394.48	301.24
3^-Fucosyllactose	43723.97	33065.28
3-Hexanol	10507.57	10321.55
3-Hexaprenyl-4,5-dihydroxybenzoic acid	3554.69	4202.81
3-Hydroxybenzoic acid	43528.05	41520.00
3-HYDROXYDEOXODIHYDRODEOXYGEDUNIN	24198.34	36873.50
3-Hydroxypropanal	7884.98	8637.56
3-Methyladenine	2787.96	5096.36
3-Methylbenzenecarbothioamide	11955.35	17753.54
3-Methylindole	2037.15	2482.20
3-Methyloxindole	8734.05	8872.77
3^-N^-Acetylfusarochromanone	534.59	2534.91
3-Oxovalproic acid	3015.34	3785.13
3-Palmitoyl-sn-glycerol	3683.04	3468.73
3-(p-Coumaroyl)ursolic acid	1148.12	1175.87
3-Penten-2-one	579.31	544.48
3-Phenylbutyric acid	2903.68	3656.22
3-Phenylpropyl isothiocyanate	9407.67	8013.49
3-Phosphoglycerate	15075.27	40181.56
(3R,4R)-3,4-Dihydroxycyclohexa-1,5-diene-1-carboxylic acid	15474.37	16057.55
(3S,10R,13R)-10,13-dimethyl-17-[(E,2R)-6-methyl-5-methyliden...	1382.11	1654.30
(3S)-3-azaniumyl-4-hydroxy-4-oxobutanoate	38483.84	42423.66
3-Vinyl-1,2-dithiacyclohex-4-ene	7821.78	16437.91
{4-[2,3-Dioxo-3-(2,4,6-trihydroxy-3-methoxyphenyl)propyl]-2-...	13414.92	6498.43
4-(2,4-Dichlorophenoxy)butanoic acid	8418.69	8711.22
4-(2-ethyl-2-methyltetrahydro-2H-pyran-4-yl)-1,3-thiazol-2-a...	2437.65	2964.59
4-(2-Pyridylazo)-N,N-dimethylaniline	405335.33	381829.20
4-(2-Thienyl)-6-(trifluoromethyl)pyrimidin-2-ol	3924.03	3675.72
4-(3,4-Dichlorophenyl)-2-hydrazino-6-(trifluoromethyl)pyrimi...	7927.82	7232.82
4-(4-(benzo[d][1,3]dioxol-5-yl)-5-(pyridin-2-yl)-1H-imidazol...	1640.71	1467.71
4-(4-Chlorophenyl)-6-(difluoromethyl)-2-(ethylsulfonyl)pyrim...	1688.48	4053.45
4,4^-Diaponeurosporene	7095.56	329008.57
4,4^-Diapophytofluene	5420.92	4668.87
4,4^-Thiodianiline	7203.74	7905.58
4-(5-(3-Hydroxyphenyl)thiophen-2-yl)-2-methylphenol	2292.95	1835.06
[4-(5,7-dihydroxy-6,8-dimethyl-4-oxo-3,4-dihydro-2H-1-benzop...	28558.84	8564.87
4-(5H-Dibenzo[a,d]cyclohepten-5-ylidene)-1-[4-(2H-tetrazol-5...	13436.83	13768.81
4-Amino-5-hydroxymethyl-2-methylpyrimidine	47124.92	50987.34
4-(Aminomethyl)pyrimidine	2602.45	2462.50
4-Aminophenol	4304.52	3611.90
4-Aminophenylsulfur Pentafluoride	312767.30	136187.76
(4aR,5S,8aR)-5-[2-[(1S,4aR,8aR)-5,5,8a-trimethyl-2-methylide...	116611.42	98046.76
(4aR,6aS,6bR,12aS,12bR,14bS)-2,2,4a,6a,6b,9,12a-Heptamethyl-...	2717.21	2639.88
(4-Bromophenylsulfanyl)pyruvic acid	3388.45	3249.02
4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl acetate	3324.50	3823.12
4-Chloro-3-nitrobenzoic acid	3403.88	1239.73
4-Chloro-6-{5-[(2-morpholin-4-ylethyl)amino]-1,2-benzisoxazo...	490.89	1534.02
4-Chlorobenzenesulfonamide	11886.42	12247.29
4-Chloronitrosobenzene	6794.91	3271.57
4-deoxy-2-O-sulfo-beta-L-erythro-hex-4-enopyranuronosyl-(1,4...	6711.42	5095.57
4-Dodecylbenzenesulfonic acid	1421.93	1626.72
4-epi-11-nor-Aristola-1(10),11-diene	1299199.88	1800623.20
4-Guanidinobutyric acid	3377.41	3513.99
4-Hydroxy-3-methoxycinnamaldehyde	21272.88	24914.76
4-Hydroxyamphetamine	9417.12	14562.21
4-Hydroxybutanoate	510.48	1110.26
4-Methylhexanoic acid	14677.16	15014.91
4-Methylthiobutanaldoxime	1183.86	847.70
4-Methylumbelliferyl glucuronide	10837.30	12117.91
4-O-hexopyranosylhex-2-ulofuranose	106063.98	125505.46
4-Pentenoic acid	6265.38	3469.66
4-Pentyn-1-ol	24688.34	25374.82
4-phenyl-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione	6082.26	3664.99
4-Phenylquinolin-8-amine	1412.08	1586.29
4-Propylphenol	57103.60	62448.74
[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl] phosphono h...	27115.36	18729.27
4-tert-Butylbenzoic acid	11174.24	10317.27
4-(Trifluoromethyl)pyrimidine-2-carbaldehyde	132082.45	56872.66
4-Vinylcyclohexene	2366.38	2578.54
5-(3^,5^-Dihydroxyphenyl)-gamma-valerolactone-O-sulphate-O-m...	3293.57	3189.64
5-(3-Buten-1-ynyl)-2,2^-bithiophene	9791.76	6241.46
5,6,7,8-Tetrahydro-2-naphthoic acid	23628.10	20471.07
5-(7-Acetyloxy-4-methoxycarbonyl-9-methyl-11-oxo-10-oxatricy...	8060.86	3651.83
5,7-Dichlorokynurenic acid	3273483.29	1828407.36
5,7-Dimethoxyflavanone	2.41	212.94
5,7-Dimethoxyflavone	28.88	1124.20
5-{9,32-Dihydroxy-6,10,13,19,20,32-hexamethyl-27-methylidene...	2257.25	2326.76
5alpha-Campestane	13321.46	3511.49
5-Aminopentanoic acid	3629.48	3463.18
(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitri...	2342.73	1980.70
5-Bromo-4-(trifluoromethyl)pyrimidin-2-amine	2693.51	3677.09
5-Bromo-7-methoxy-1-benzofuran-2-carboxylic acid	4391.10	4324.23
5-Chlorohydroxyquinone	5762.46	4679.90
5-(Diphenylphosphinyl)pentanoic acid	138271.26	115390.79
5-Hydroxy-1-(4-hydroxyphenyl)-3-decanone	6.28	6.25
5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxyl...	14721.90	11390.83
5-Hydroxyhexanoic acid	4548.41	5258.27
5-Methoxy-N,N-diisopropyltryptamine	6722.32	5821.78
5-Methoxytryptophan	1537.12	2148.57
(5-methyl-2-methylidenehexyl) (Z,2S)-2-hydroxy-6-[(1S,4Z,6E,...	148.89	486.83
5-Methyl-5-hexen-2-one	2941.70	3371.09
5-Methylthiopentanaldoxime	1547.53	1512.12
5-O-Methyllicoricidin	1436.87	1204.81
5S-Hydroxy-6R-(S-cysteinyl)-7E,9E,11Z,14Z-eicosatetraenoic a...	2092.22	1580.79
5-Sulfamoylfuran-2-carboxamide	15813.86	12255.51
5-[(Z)-(5-chloro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl...	1250.03	2482.66
6-(2-(2-Methyl-1H-imidazol-1-yl)ethyl)-1,3,5-triazine-2,4-di...	1205.30	1190.05
6-{[2-(3,4-dihydroxyphenyl)-7-hydroxy-4-oxo-6-[3,4,5-trihydr...	2212.96	2347.63
6-[4-(1-cyclohexyltetrazol-5-yl)-4-[(2-oxo-3,4-dihydro-1H-qu...	1623.64	2380.01
6beta-Hydroxydexamethasone	2189.52	1897.83
6-Hydroxychlorzoxazone	25664.44	22971.20
6-Hydroxyflavanone	893.87	276.86
6-Methyl-5-hepten-2-one	94426.40	108684.40
6-Methylcoumarin	13853.93	16584.92
6-Phosphogluconic acid tri(cyclohexylammonium) salt, Grade V	1374.37	1704.91
7-[(2R)-3-hydroxy-2-(3-hydroxy-5-methylnon-1-enyl)-5-oxocycl...	310.88	343.75
7-[3-(Dimethylamino)propoxy]-6-Methoxy-2-(4-Methyl-1,4-Diaze...	2546.85	1271.22
7alpha-Hydroxycholesterol	21703.54	16445.27
7-Chloro-3-methyl-3,4-dihydro-2H-1,2,4-benzothiadiazine 1,1-...	24158.20	24817.02
7-Chloro-6-demethylcepharadione B	2934.04	4852.17
7-Ethyl-10-hydroxycamptothecin	4441.20	3304.40
7-Hydroxywarfarin	1765211.38	1716375.91
7-nitro-10-octyl-3-phenyl-pyrimido[4,5-b]quinoline-2,4(3H,10...	1472.96	413.80
7-Nitroindazole	1679.41	1648.34
8,11,14-Eicosatrien-5-ynoic acid	2586.89	2956.88
8,12-iso-iPF2-VI 1,5- lactone	1706.78	908.69
8,9-Epoxyeicosatrienoic acid	40565.00	40714.57
8^-apo-beta-Carotenol	6075.41	4679.22
8-Chloro-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine-...	4980.37	3628.53
8-Hydroxy-8-(2-pentyloxy-phenyl)-oct-5-ynoic acid methyl est...	3573.81	2288.25
8-iso Prostaglandin F2d4	2940.83	4324.26
9(10)-EpOME	2751.59	3722.23
9,10-Epoxystearic acid	2597.70	1888.63
9,10-Phenanthrenequinone	9644.60	17677.62
9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one	15291.67	16047.19
9-Hydroxycalabaxanthone	4132.82	243.34
9-Octadecenal	3057.69	3736.53
9-oxo-11R,15S-dihydroxy-1a,1b-dihomo-13E-prostaenoic acid	1541.10	1425.34
Aceclofenac	7508.63	11996.49
Acetazolamide	26969.08	78333.88
Acetic acid	48667.21	50862.48
Acetophenone	14494.50	15583.43
Acetoxyacetone	1463.34	2201.08
Acetylcholine	2795.93	3598.71
Acetylglycine	2485.32	3046.45
Acetyl-L-carnitine	13239.59	25362.56
Acetyl sulfide	458.73	475.02
Acrylamide	17650.92	17257.99
Actara	21281.44	24607.26
Acylsucrose S4:17[2](2,5,5,5)	1038972.20	990659.74
Adenosine	14461.02	8002.90
Adenylylselenate	11398.43	5709.93
Adrenoyl ethanolamide	18198.91	20064.34
Ala-Leu-Val-Lys-Ala	526.90	115.68
Ala-Ser-Ser-Thr-Lys	6401.83	8384.94
Ala-Thr-Ile-Lys	2306.78	1852.05
Ala-Val-Ala-Ile-Gln	3838.59	4003.19
Alendronic acid	12890.15	13406.87
Alfentanil	1840.22	1930.00
Allantoic acid	2347.61	1407.32
all-trans-13,14-Dihydroretinol	4974.62	6464.42
all-trans-Carophyll yellow	893899.87	852773.70
Allyl methyl sulfide	54016.08	35092.96
Aloesin	21840.13	8816.84
Aloin	2411.99	774.23
alpha-L-Fucp-(1->3)-[beta-D-Galp-(1->4)]-D-GlcpNAc	4367.59	4139.20
alpha-Sanshool	6642.74	7060.85
Alprenolol	5133.70	5861.36
Alternariol	5104.68	5609.46
Amantadine	25939.90	24548.01
Ametryn	7103.15	8994.20
Ammodendrine	2537.29	2569.51
Ampicillin sodium	1728.79	1798.76
Androsterone	1569.64	1619.88
Aniline	16478.38	16753.78
Annomutacin	14183.88	21152.37
Antanapeptin A	3643.53	3604.88
Antibiotic KM 208	2007.23	2485.24
Apixaban	1702.77	134.80
APMF-Glu	16731.39	19531.48
Arachidonic acid-biotin	1751.65	748.60
Arachidoyl glycine	11955.47	16359.27
Araliacerebroside	113.35	10287.01
Arg-Arg-Lys-Ser-His	1513.62	160.81
Arg-Asp-Arg	4678.18	4993.97
Arg-Gln-Arg	1834.74	1185.17
Arg-Glu-Ala-Phe-Arg	2013.58	1012.03
Arg-Ile-Ala-Glu-Glu	5831.95	7708.87
Arginine	3957.03	4132.57
Arg-Leu-Leu-Asn-Leu	2031.49	1415.22
Arg-Lys-His	5690.55	2350.79
Arg-Met-Met	761632.42	813446.20
Arg-Phe-Arg	13631.56	12000.85
Arg-Thr-Ala-Arg	1453.09	1196.62
Arg-Thr-Lys-Arg	132500.01	145328.95
Arg-Val-Asn-His-Val	845.03	351.36
Arg-Val-Phe-Asp-Lys	1353.41	1303.13
Aromatized deshydroxy-C-1027 chromophore	210.15	947.34
Asn-Arg-Gln	22395.29	19853.49
Asn-Arg-Glu-Ser-Leu	746.28	1222.45
Asn-Glu-Lys	1285.36	1151.82
Asn-Gly-His	2748.15	3747.69
Asn-Leu-Pro-Ala-Lys	693.58	548.39
Asn-Phe-Met	14619.76	14250.81
Asn-Tyr-Asp-Arg	233.39	810.88
Asparagine	4722.75	5223.54
Asparagylalanine	2042.57	1341.59
Asp-Arg-Gln-Arg	9874.36	8554.58
Asp-Leu-His-Ala-His	3465.38	3052.95
Asp-Leu-Met	11575.94	12901.83
Asp-Trp-Tyr	10320.86	19207.17
Asp-Tyr-Asp-Asn-Phe	2697.70	3013.04
Avenoleic acid	7538.84	5527.07
Azacitidine	176092.31	153666.39
Azelaoyl PAF	1589.58	1785.13
Azobenzene-4-sulfonic acid	1835.02	1599.09
Azuleno(6,5-b)furan-2,5-dione, 3,3a,4,4a,7a,8,9,9a-octahydro...	1425.09	1581.31
Ba 2652;Stilbamidin	5806.98	5067.69
Barbaloin	4974.07	1224.45
benfluralin	3859.57	3605.99
Benzaldehyde	20119.64	23861.16
Benzamidine	84506.01	86058.09
Benzidine Yellow GR	9787.73	10532.65
Benzydamine	2687.82	2013.59
Benzyl-furan-2-ylmethyl-amine	1978.82	2234.76
Benzyl n-[(2s)-4-methyl-1-[[(2r)-4-methyl-1-[[(2s)-4-methyl-...	22216.46	22102.28
beta-Alanine	3092.43	1446.18
beta-Amyrone	21.04	30.13
beta-D-gentiobiosyl crocetin	513.32	934.88
beta-Glycerophosphoric acid	94643.75	76615.73
Betaine	48804.27	35011.71
Betaine aldehyde	1239.22	1653.65
Beta-Mercaptoethanol	29794.81	22584.16
beta-Peltatin A	2903.17	3109.18
beta-Sitosterol	4249.37	4934.81
Bethanechol	3172.88	2340.43
Bezafibrate	2902.52	3757.30
Bicalutamide	17907.90	10468.32
Biliverdin	9731.05	9328.53
Biosone	3488.93	1341.45
Bis(2-ethylhexyl) adipate	29673.75	32429.10
Bis(2-ethylhexyl) phthalate	169.58	945.64
Bis(chloromethyl) ether	23311.92	21728.99
bisphenol A diglycidyl ether	1667085.03	1752696.39
Bispyribac	4279.64	4851.28
Biuret	37391.69	18536.81
Brassinolide	19754.29	18697.29
Bufexamac	158610.85	159510.47
Butanoic acid, 4-((1,2-dioxohexadecyl)amino)-, ethyl ester	4642.31	3853.08
Butopyronoxyl	383667.86	366082.30
Butylate	10650.65	11283.97
Butylone	48475.77	59576.40
C24:1 Sphingomyelin	18562.74	11458.92
C24 Sphingomyelin	59144.62	23186.91
C25H50NO6P	26903.88	21170.00
Caffeic acid	2471.36	1918.09
Caffeine	1944.06	713.20
Calcitriol	2498.84	2338.57
Calcium Metasilicate	5766.80	5735.29
Camptothecin	5266.44	4696.44
Cannabisin G	10671.03	7990.31
Caprylic acid	8855.43	9524.76
Carbaprostacyclin-biotin	5675.88	5194.20
Carbaryl	55226.59	54860.47
Carmustine	2863.81	4212.66
Carnitine	1741.90	1638.33
Carnitine C4:DC	31350.19	25619.41
Caruilignan D	2863.25	3196.68
Carvedilol	48772.20	51786.90
Cedrol	890.81	643.50
CE(MonoMe(11,3))	2899.94	1319.59
Cephemimycin	1295.56	1320.09
Cer(d18:1/24:1(15Z))	4573.14	18245.67
Chinomethionat	3777.08	3943.59
Chlomethoxyfen	30281.85	16063.63
Chloramine	37064.61	20885.85
Chloramphenicol palmitate	620.95	1009.11
Chloroacetaldehyde	5311.51	5165.53
Chloromethyl methyl ether	208196.96	213021.95
Chlorpropamide	1395.88	1386.32
Chlorthiamid	5809.69	7329.09
Chlorthiophos	29102.77	85205.06
Choline	3838.43	4282.04
Cicerin 7-(6-malonylglucoside)	9763.72	13264.50
Cimetidine	2503.03	2434.35
Ciprofibrate	629.82	3176.36
cis-3-Hexen-1-ol	185.21	224.42
Citraconic acid	1284.17	1389.50
(+)-Cloprostenol methyl amide	20440.95	18531.85
Colfosceril palmitate	12102.76	14567.78
Conessine	144021.34	116654.20
Convicine	3403.54	3614.47
Coumaphos	18799.51	20421.62
Crustacean Erythrophore Concentrating Hormone	386.44	154.04
Cucurbitacin P	99712.92	44698.53
Curcumol	9620.03	8831.27
Curtisian O	9333.14	5490.65
Cyanidin	1565.64	1897.48
(Cyclic(glycyl-N(5)-acetyl-N(5)-hydroxy-L-ornithyl-N(5)-hydr...	1613.37	651.40
Cys-Arg-Met	467668.02	457845.51
Cys-His-Lys	83700.29	72629.26
Cysteylhistidyllysine	11625.92	12746.36
Cythioate	3626.74	3652.59
Dalcetrapib	1722.40	1876.25
Dehydrocarpaine II	3229.52	4377.77
delta-Hexanolactone	13830.04	15851.52
Deoxycholic acid glycine conjugate	2148.36	1898.85
Deoxyhexose	1879.53	2026.00
D-Erythroascorbic acid 1^-a-D-xylopyranoside	32586.96	28535.77
D-Erythrose 4-phosphate	435856.97	546380.43
Desmethylalborixin	1104.25	12079.90
Desoxycortone	3640.62	3570.02
Devazepide	3094.27	2049.34
Dexamethasone	399.17	4.47
D-Fructose-6-phosphate	51897.23	26861.53
DG(18:3(6Z,9Z,12Z)/16:0/0:0)	93.73	2433.38
DG(18:3(9Z,12Z,15Z)/20:2(11Z,14Z)/0:0)	184580.74	154553.37
DG(18:3(9Z,12Z,15Z)/20:3(8Z,11Z,14Z)/0:0)	5476.03	3105.79
DG(18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z)/0:0)	16981.61	7945.52
Di-2-propenyl heptasulfide	6402.12	4643.19
Diallyl trisulfide	16092.64	15145.88
Dibasic sodium phosphate	122967.71	89459.02
Dibucaine	4588.23	4254.25
Dibutyl phthalate	562258.75	601335.95
Dichlofluanid	14218.81	13597.00
Dichlorvos	2151.89	2112.30
Diclofenac	5373.97	5233.35
Dicyclohexylamine	6480.26	7108.42
Diethyl disulfide	6953.62	4687.67
Diethyl glutarate	1435.85	1868.64
Diethyl hydrogen phosphate	4316.18	478.32
Dihydroconiferyl alcohol	5633.38	3251.13
Dihydromethanophenazine	1076.13	2375.86
DI(Hydroxyethyl)ether	40815.99	47053.26
Diisononyl phthalate	28356.74	892735.12
Diisooctyl phthalate	39897.29	58953.16
Dimepiperate	8394.98	8940.50
Dimethyl 4-(3-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarbo...	731.15	565.68
Dimethyl sulfoxide	12109.16	12925.16
Dinitrogen trioxide	62663.71	79508.15
Dinoseb	27462.10	12176.61
Dioctyl phthalate	10383.85	11763.06
Dioleoylphosphatidylcholine	50314.45	68145.29
Diphenyleneiodonium	6101.74	3231.72
Diprogulic Acid	4130.50	3893.36
Diquafosol	16593.32	25206.63
Disodium 2-hydroxypentanedioate	44000.68	115208.81
DL-Citrulline	1899.23	1799.82
DL-Homocysteine	4134.45	4514.29
DL-Ornithine	6741.61	6546.07
d-Myo-inositol-1,4,5-triphosphate	100253.06	104392.23
D-Nmappd	1572.01	1487.20
Docosanamide	33004.77	46470.94
Docosatrienoic acid	14012.01	18082.11
Donhexocin	16848.10	17987.97
D-phenylalanine	76252.52	62902.38
Drofenine	2519.16	2509.20
Dropropizine	449522.34	424461.96
D-Xylono-1,5-lactone	106329.66	80785.55
(E)-6-[(7S,10S,13R,14R,17R)-7-hydroxy-4,4,10,13,14-pentameth...	1957.62	2029.01
Eicosane	2687.72	2865.62
Emodin	1616.00	1851.34
Endoxifen sulfate	6488.34	6811.31
(-)-Epicatechin	2895.33	1503.65
Ergosterol peroxide	1686.80	1410.61
erythromycin A(1+)	2891.15	921.03
Erythrosine	8446.52	5609.48
Esculetin	9050.02	4638.32
Ethacrynate sodium	2975.59	4125.81
Ethanethioic acid	5815.14	5617.43
Ethephon	13616.05	15534.68
Ethopabate	2707.36	3210.85
Ethoxzolamide	9843.63	6837.55
Ethyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetate	13594.49	6966.42
(+-)-Ethyl 3-hydroxy-2-methylbutyrate	1905.94	1709.62
Ethyl 4-(cyclopropanecarbonylamino)benzoate	3496.78	3654.85
Ethyl alpha-linolenate	3765.16	2216.91
Ethyl arachidonate	3369.43	2650.22
Ethyl pyruvate	31078.38	34468.15
Ethyl tetradecanoate	1081129.61	1003746.93
Ethyl vanillin	3511.16	2721.36
Etilamfetamine	18490.73	16960.78
Etobenzanid	1490.69	2803.42
Eudesobovatol B	2512.05	2386.62
EUK 134	18537.05	6139.67
Euscaphic acid	7337.61	7418.21
Farnesyl Thiosalicylic Acid Amide	3971.56	2529.96
Fasciculic acid C	878.68	1534.37
Fenchlorphos	8504.72	6310.58
Fendiline	2348.11	1388.74
Fenothiocarb	11873.82	11288.42
Fenoxanil	65002.33	65330.04
Fenson	2406.64	2760.10
Feruloylputrescine	1683.80	858.27
FFA(12:1)	83.10	2279.46
Fidaxomicin Metabolite OP-1118	1789.20	319.47
Fipronil	13249.79	19818.78
Firefly luciferin	572176.52	365811.54
Flavone	243204.45	588087.70
Fluorodifen	2672.78	2630.80
Fluphenazine sulfoxide	25329.44	23445.66
Flusulfamide	1544441.74	836785.88
Formononetin 7-O-glucoside-6^^-O-malonate	3162.52	670.45
Formylanthranilic acid	1713.45	1870.55
Formylisoglutamine	1809.54	858.49
Formyl phosphate	6247.60	7267.11
Fucoxanthin	2198.98	523.07
Furafylline	8810.72	9436.10
Furametpyr	15478.77	16402.10
Fusidic acid	2225.51	2223.91
Gamma-Caprolactone	1200.07	1554.91
gamma-L-Glutamyl-L-pipecolic acid	1428.43	1543.60
gamma-Linolenic Acid	2102.70	1933.85
ganoderal A	1306.27	1104.50
Ganoderic acid A	1724.28	3427.42
Ganoderiol I	3214.05	3435.20
ganoderol A	151806.02	137982.36
GcNeu	6805.58	12274.66
GENALKDAK/2_0	1176.08	350.67
Genistein	21880.78	21134.24
Gentian violet cation	7429.20	3477.51
Geodin	2105.31	836.07
Geranylcitronellol	20083.16	22742.60
Geranylgeraniol	1362136.75	1548852.33
Gingerglycolipid A	2651.95	1366.47
Ginkgolic acid	1110.63	236.89
Ginsenoside F1	20397.01	2015.45
Gln-Gln-Gln-Glu-Gln	23193.26	27223.97
Gln-Gln-Ser	2041.89	1156.92
Gln-Phe-Asp	1715.70	1484.77
Gln-Val-Leu-Arg	1919.47	1446.88
Glu-Ile	105034.07	124323.69
Glu-Leu	31745.61	31983.21
Glutamine	25346.92	15282.20
Glu-Tyr-Ile-Glu	24048.28	39955.23
Gly-Arg-Lys	13508.98	5202.23
Glycerol 1-myristate	1487.36	1402.69
Glycerophospho-N-Palmitoyl Ethanolamine	4019.02	2169.97
Glyceryl monooleate	1347.77	1436.64
Glyceryl monostearate	1625.01	2282.73
Glycine	10660.86	14389.78
Glycolaldehyde	56877.00	59401.79
Gly-Leu-Ser-Pro-Lys	4375.32	3528.45
Gly-Lys-Val-Lys-Lys	7415.15	7708.85
Glyphosate	3193.03	3011.77
Glyphosine	3943.09	5598.65
Goniodomin A	1558.75	3741.75
Goshonoside F2	5435.26	5196.83
Goyaglycoside h	9396.55	1482.99
Griseofulvin	2162.80	2324.16
Harman	975.44	1429.39
HC Blue no. 2	0.48	164.33
Heptadecanoyl carnitine	1855.11	1071.92
Hexadecylamine	676.35	712.82
Hexamethylphosphoramide	20239.42	22210.85
Hexetidine	7002.53	6406.76
His-Ala-Glu-Asp-Gly	403.75	111.52
His-Asn-Ile	6574.84	8070.59
His-Gln-Thr	546.35	1569.79
His-Lys-Gln-Lys	3311.51	1831.22
His-Lys-Met	25273.62	22628.68
His-Phe-Arg	2065.37	1848.64
His-Phe-Tyr-Asp	1103.53	1508.26
Histamine	4373.66	4841.80
His-Thr-Lys-Lys	3721.29	1730.70
Histidinol	16469.35	14606.00
Histidylmethionyllysine	26767.53	28385.18
Homobaldrinal	2766.93	1636.99
Hordenine	1990.25	1738.49
Huperzine b	3608.93	3557.92
Hv-NCC-1	991.99	2553.56
Hydrogen carbonate	1559.59	1813.60
Hydrogen oxalate	7764.92	4093.41
Hydrogen phosphate	12519.08	14273.41
Hydrogen sulfide	25527.46	16317.22
Hydroxyecdysone	4130.40	2095.54
Hydroxyurea	52319.01	44373.98
Ile-His-Arg-Arg	1758.88	1764.20
Ile-ile-thr	567.57	3007.88
Ile-Leu-Ala-Ile-Val	70752.90	56813.39
Ile-Lys-Arg-Asp-Phe	2536.46	853.17
Ile-Thr-Val-Lys-Leu	6118.70	6262.21
Ile-Val-Leu-Glu	28844.44	28739.49
Imibenconazole	12487.04	6702.14
Imidapril	2393.30	1973.47
Imidazole-4-methanol	104422.81	76328.29
Imipraminoxide	3262.11	1060.34
Imperialine	2040.84	2501.82
Indole	7128.94	7086.76
Indole-3-carbinol	2042.60	2596.23
Indole-3-carboxaldehyde	13157.79	11497.64
Indoleacetaldehyde	30176.46	30133.24
Indoleacetic acid	2119.91	1216.32
Indolepyruvate	1523.29	1989.54
Inosine triphosphate	12571.78	16849.43
Inosinic acid	1819.31	17.10
Inositol 1,3-bisphosphate	14466.86	15820.22
Iodotyrosine	4988.46	3668.72
Iriomoteolide 1a	1488.31	2033.16
Isobutyl isothiocyanate	25001.61	26079.45
Isocarbamid	117528.62	144334.09
Isofraxidin	6101.79	11567.18
Isoliquiritigenin	1505.88	2038.53
Isopropyl dodecylfluorophosphonate	4852.89	6071.23
Isoprothiolane	8564.44	9257.04
Isorescinnamine, dihydro-	37483.32	66321.46
Isoxathion	1642.91	1859.40
Itaconic acid	137915.19	147932.20
Jasmone	92517.56	53793.32
Juvenile hormone I	4424.34	2917.96
JWH 018 N-(4,5-epoxypentyl) analog	5727.15	4834.68
JWH 200-d5	440.89	3299.21
Kinoprene	5677.82	4779.97
Kojibiose	62560.94	78487.21
Kynurenic acid	2476.67	2657.80
L-3-Aminodihydro-2(3H)-furanone	1509.04	1653.64
L-Alanyl-gamma-D-glutamyl-L-lysine	837.95	1755.94
L-Alanyl-L-alanine	185340.95	284624.57
L-Aspartic acid	11929.28	12589.47
Lauroyl diethanolamide	6069.78	7301.73
Lavendustin c	10874.03	8479.51
L-canavanine	3099.38	2409.15
Lecanoric acid	62448.12	52767.97
Lenticin	128.87	1.47
Letrozole	201.59	200.47
Leu-Ala-Met-Glu-Arg	2851.49	4978.47
Leucodelphidin	4528.99	4451.03
Leukotriene D4 methyl ester	1657.85	997.40
Leupeptin	547.35	783.63
Leu-Ser-Leu-Glu-Glu	1984.15	2383.85
Leu-Thr-Gln-Gln-Leu	6253.06	7245.85
Leu-Thr-Phe-Gln-Met	2603.99	4031.65
Leu-Thr-Pro-Asp-Ala	5747.25	4354.44
Leu-Thr-Trp	3358.31	3615.14
Leu-Val-Val-Val-Asp	5766.39	2408.43
Leu-Val-Val-Val-Gly	3439.88	3606.67
Licoricesaponin B2	6203.66	3243.16
Lidocaine	937416.01	867791.63
Liriodenine	14494.85	12133.73
L-Isoleucine	6108.86	2291.61
L-Leucyl-L-alanine	2163.90	512.93
L-Lysine, L-valyl-L-valyl-	6310.02	6269.13
L-Norleucine	3601.10	3453.46
L-Octanoylcarnitine	87003.63	87073.37
Longicamphenylone	4910.32	3923.07
Losartan 3-[(nitrooxy)methyl]benzoate	3183.77	884.79
LPC(0:0/18:3)	4237.51	3950.69
LPC(0:0/20:4)	10569.23	5284.66
LPC(14:0/0:0)	3720.75	1855.66
LPC(15:0/0:0)	2311.95	951.07
LPC(16:0/0:0)	8387.71	5688.38
LPC(16:1/0:0)	6266.11	3090.91
LPC(18:1/0:0)	11475.54	7290.06
LPC(18:3/0:0)	3075.95	3172.03
LPC(20:5/0:0)	4970.16	2483.08
LPC(22:6/0:0)	2375.16	1855.18
LPC(O-16:0/2:0)	6603.65	4508.68
LPC(O-18:0/0:0)	5815.38	10177.42
LPE(0:0/20:4)	3387.48	2314.16
LPE(14:0/0:0)	1586.34	527.43
LPE(16:1/0:0)	14361.17	6830.62
LPE(18:0/0:0)	41818.10	47950.71
LPE(18:1/0:0)	4293.65	3602.30
LPE(18:2/0:0)	9432.40	4938.21
L-Phenylalanine	50730.50	19369.44
L-prolyl-L-tyrosine	1898.98	1938.55
L-Saccharopine	3347.61	3847.56
L-Serine	2273.85	3054.31
Lucidenic acid N	2195.99	1519.95
Lumichrome	2034.32	1412.77
Lys-Ala-Glu	2482.71	68.01
Lys-Ala-Leu-Glu	169436.67	160728.06
Lys-Cys-Val-Ala-Phe	1211.87	2246.45
Lys-His-Met	688325.58	621647.89
Lys-Ile-Val-Lys	4606.45	4661.09
Lys-Leu-Asn-His-Gln	3308.74	3220.12
Lys-Leu-Thr-Arg	11753.74	10065.71
Lys-Met-His	53226.88	60065.50
Lyso-PAF c-18	2953.30	634.67
Lys-Phe-Leu-Glu	1325.65	1818.98
Lys-Phe-Lys-Met-Lys	2375.61	689.12
Lys-Ser-Asp-Glu-Thr	15270.68	13233.20
Lys-Thr-Glu-Lys-Ala	4828.57	5331.55
Lys-Tyr-Phe	4311.19	4844.69
Lys-Tyr-Val-Lys	2777.94	2726.44
Maclurin	254865.88	174225.80
Mactraxanthin	4320.93	3381.62
Makisterone A	34296.69	29528.18
Maltopentaose	9507.41	34452.81
Maltotriose	83509.31	119700.60
Manglupenone	2432.20	1507.54
Marmesin	1196.78	339.45
Maslinic acid	206.21	121.83
Matairesinol	4157.09	4497.15
Medifoxamine	1649.33	1834.65
Mefenorex	1851.44	2380.33
Meldonium	3606.03	6237.27
Melibiose	23503.83	25705.13
Menadiol disulfate	39161.13	21298.44
Mequitazine	2510.51	2224.61
Metaproterenol	1228.61	2267.27
Metformin hydrochloride	2691.85	2763.13
Methacycline	10734.07	2423.52
Methamidophos	7342.59	8301.96
Methanesulfinate	2850.73	2516.16
Methanophenazine	385063.63	362390.53
Methenamine	5789.15	6353.14
Methimazole	6001.44	7855.23
Methionine	151353.13	222230.58
Methiothepin	2633.72	5674.81
Met-His-OH	5029.61	4945.89
Methoxsalen	62518.69	62118.36
Methoxybauerenol	1851.71	1767.40
methyl (1S,15R,17S,18S)-6-[(1S,12R,14R,15E,18S)-15-ethyliden...	1978.94	913.67
Methyl 2-chloro-3,5-dinitrobenzoate	1505.06	2353.33
Methyl 2-thiofuroate	998.18	1431.33
methyl 4-(1-methylpyrrolidin-1-ium-3-yl)-3-oxobutanoate	45395.91	47838.27
Methyl 4-amino-3,5,6-trichloropicolinate	8204.01	8134.49
Methyl 4-hydroxycinnamate	165390.68	164111.10
Methyl 5-bromo-2-fluoro-3-nitrobenzoate	2769.55	2603.53
Methylarsonite	17113.47	16945.02
Methyl caprylate	103784.42	101097.99
Methyl cholate	8157.00	4529.52
Methyl cinnamate	17636.35	18981.89
Methyl dioxindole-3-acetate	13665.65	11307.59
Methyldiphenylphosphine	29873.85	22212.99
Methylthiouracil	18215.61	13636.29
Met-Met	32726.74	35512.03
Metronidazole	4876.54	4480.51
Met-Ser-Phe-Thr-Phe	9193.66	8216.60
Met-Thr-Ser	5166.81	3960.82
Metyrapone	80721.81	94015.40
MG(0:0/18:2(9Z,12Z)/0:0)	1481.46	1158.08
MG(16:0/0:0/0:0)	7781.70	9373.67
MG(18:0/0:0/0:0)	754.13	1413.59
MG(18:2/0:0/0:0)	3224.25	3789.32
Miconazole nitrate	1715.46	1438.32
Misoprostol	1499.89	1369.90
Mitoglitazone	4228.98	4555.21
Momordicilin	18616.61	21490.12
Monomethyl phenylphosphonate	6769.11	7137.71
moracin I	142.12	8.97
Morphine N-oxide	3879.40	4085.13
Morpholin-4-ium (4-methoxyphenyl)morpholin-4-ylphosphinodith...	1509.97	1406.39
Mycinamicin IV	16315.19	8572.56
Mycolactone	31489.79	43621.50
Myosmine	12458.26	6389.68
N-(1,3-Dihydroxyoctadecan-2-YL)-6-[(7-nitro-2,1,3-benzoxadia...	689565.73	642024.47
N-(13-Methyltetradecyl)acetamide	2810.88	3724.85
N-(13Z-docosenoyl)-sphing-4-enine-1-phosphocholine	5295.03	3398.60
N2-(1-Carboxyethyl)-L-arginine	7425.84	5611.78
N-[2-(3,4-Dihydroxyphenyl)ethyl]hexadecanamide	398.06	403.98
N-(2-Hydroxyethyl)docosanamide	6857.21	7421.53
N-(2-hydroxyethyl)icosanamide	132.21	131.35
N2,N2-Dimethylguanosine	1887.11	3936.12
N-(3,5-Dichlorophenyl)succinimide	11008.84	4289.26
N-(3-bromo-4-methoxybenzyl)cyclohexanamine	2276.42	4296.14
N-(3-propan-2-yloxypropyl)-7H-purin-6-amine	6117.93	4995.76
N-[(3S)-Tetrahydro-2-oxo-3-furanyl]hexadecanamide	6842.54	5701.68
N-[(3S)-Tetrahydro-2-oxo-3-furanyl]octadecanamide	17.68	10.83
N-(4,5-dimethylthiophen-2-yl)acetamide	2168.15	1551.82
N-(4-aminophenyl)-N-methyl-2-(4-methylpiperazin-1-yl)acetami...	107364.37	216075.97
N-(5-Adamant-1-yl methoxy)pentyl deoxynojirimycin	494.13	658.67
n-(5-Chloro-2-methoxyphenyl)-3-oxobutanamide	1597.16	1680.10
N-acetyl-D-glucosaminic acid	1784.40	1926.50
N-Acetyl-DL-methionine	7573.90	7468.11
N-acetyl-L-citrullinate	15100.76	18920.69
N-Acetyl-L-glutamyl 5-phosphate	3663.24	4822.36
N-acetyl-LL-2,6-diaminopimelic acid	3328.20	3740.88
Nagaba	3417.51	4684.74
Nap-His-OH	1470.50	1591.44
Naptalam	974.60	1967.30
Naringenin-7-O-glucoside	10228.01	11807.18
Nbd-ceramide	2341.11	2228.11
N-benzyl-5-bromofuran-2-carboxamide	12221.91	9281.79
n-Benzylacetamidine	8489.48	9462.31
N-Benzyloxycarbonylglycine	4291.48	3591.99
N-Benzyloxycarbonyl-L-leucine	24446.47	34103.51
N-Butyl-11-[(7R,8R,9S,13S,14S,17S)-3,17-dihydroxy-13-methyl-...	14376.49	16324.99
N-Caffeoyl serotonin	1558.26	1389.00
n-cis-Feruloyltyramine	2868.78	2565.48
N-Coumaroyl serotonin	2217.07	1813.06
N-Cyclohexylformamide	2823.14	3147.91
N-Cyclopropyl-11-(2-hexyl-5-hydroxyphenoxy)undecanamide	4243.04	3002.30
N-Desmethyl tapentadol	2679.06	2149.15
Neotigogenin acetate	13309.24	15337.92
N-Ethylacetamide	44945.75	31611.25
Neu5Ac2-6Gal1-4GlcSp	4143.50	2285.63
N-Formyldemecolcine	5044.04	6858.98
N-formylmaleamic acid	1697.97	1832.16
Niacinamide	2378.64	2088.77
Niclosamide	9622.83	10734.64
Nicotinamide mononucleotide	2013.79	2279.84
Nicotine	61468.37	55482.59
Nilutamide	1234.43	1765.49
N-(indole-3-acetyl)-L-leucine	4499.02	3015.53
Nitromethane	2279.48	2558.57
Nitroxoline	2001.84	2792.23
N-METHYLANILINE	4189.20	4372.18
N-methylundec-10-enamide	8574.14	6971.39
N,-N-diacetyl-O-methylhydroxylamine	105234.39	95834.59
N,N-Dimethylaniline	30896.00	34103.56
N,N-Dimethyl-N^-(3-thienylmethyl)-1,2-ethanediamine	717614.80	524558.85
N,N-dimethylsphingosine	2951.76	4823.17
N,N,N-Trimethyl-Histidine	40889.17	45220.39
N-octanoylsphingosine	6009.73	6883.42
N-octanoylsphingosine 1-phosphate	126.46	1.01
Nomifensine maleate	6188.25	5936.90
Nonoxynol-9	2207.59	2923.62
Nootkatol	3777.91	3066.70
Norcamphor	1464.39	1620.69
Noscapine	4863.57	4261.22
N-pentadecanoyl-L-Homoserine lactone	4168.67	2985.01
NSC 23766 trihydrochloride	920.78	370.87
N-tetradecanoyl-L-Homoserine Lactone	13382.44	14763.35
N-trans-Feruloyloctopamine	3820.17	1974.07
N-Undecanoylglycine	34858.83	28394.53
O2-Vinyl 1-(Pyrrolidin-1-yl)diazen-1-ium-1,2-diolate	1524.36	2124.52
O-Acetyl-L-homoserine hydrochloride	13723.68	14191.97
Obacunone	407159.28	366646.78
Octadecadienamide	8095.64	9188.97
Octadecylamine	1336.98	4608.59
Octafluorocyclobutane	7168.34	7725.02
Octylamine	1321.62	1241.56
Oleamide	28685.53	32017.64
Oleana-12-ene-3beta,28-diol 3-[(Z)-3-(4-hydroxyphenyl)propen...	6.97	8.46
Oleic acid	1320.01	368.42
Oleic Acid-biotin	25855.46	20953.93
Oleoyl Ethanolamide-d4	4332.32	4132.34
O-Methylsterigmatocystin	3153.45	4295.70
Ondansetron hydrochloride dihydrate	3516.50	2745.97
O,O-Diethyl hydrogen thiophosphate	138838.14	118973.10
o-Phenylenediamine	4653.63	5956.06
Ortophosphate	406440.21	308007.63
Oxalic acid	35915.32	18794.81
Oxandrolone	1800.31	1140.42
Oxibendazole	2008.95	1582.91
Oxotremorine	11430.50	12685.48
Oxymatrine	4446.96	4795.07
Ozagrel	10753.11	2082.73
Ozone	12047.37	14447.92
P1,P4-Bis(5^-adenosyl) tetraphosphate	997.75	580.55
Pachyrrhizin	4258.43	9453.94
Palmitic amide	24487.66	26052.03
Panaxatriol	9449.09	8870.65
Paraoxon	174968.62	201625.42
Pargyline	143060.48	133339.89
Paritaprevir	2528.10	4623.77
Paromamine	1719.73	1640.16
pateamine A	15016.28	16234.66
Pavetannin B6	2486.58	1571.48
PC(16:0/2:0)	35674.00	24708.63
PC(18:0/18:2)	1810.80	1728.16
PC(8:0/8:0)	1776.20	1760.35
PC(O-16:0/O-1:0)	61603.42	49717.50
PC(O-16:0/O-2:0)	15016.56	16971.95
PC(o-22:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))	294277.27	268812.91
p-Coumaryl alcohol 4-O-glucoside	19722.42	22032.03
PE(20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))	6632.83	27843.83
Pectolinarigenin	310.12	1473.47
(+)-Penbutolol	2849123.75	2980556.41
Penciclovir	2404.27	29.33
PE-NMe(16:0/16:0)	7452.64	8053.56
PE-NMe(20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z))	10977.40	4936.22
PE-NMe2(16:0/16:0)	12595.74	10494.41
PE-NMe2(18:1(9Z)/18:1(9Z))	174.63	276.55
Pentadecylamine	2092.48	1417.38
Pentamycin	3167.14	1646.49
Pentyl hexanoate	38.83	23.11
Perhexiline maleate	2214.82	1596.47
PG(16:1(9Z)/22:4(7Z,10Z,13Z,16Z))	206952.52	135964.75
PG(a-13:0/i-14:0)	11788.10	1873.10
PGF2alpha methyl ether	1609.75	1859.33
PG(i-12:0/18:2(9Z,11Z))	394.78	327.78
Pgp(18:0/22:5(4Z,7Z,10Z,13Z,16Z))	1535.87	368.20
Phe4Cl-Abu-OH	726.83	2349.89
Phe4Cl-TyrMe-OH	1109.27	768.44
Phe-Asn-Thr-Lys	125.11	139.09
Phe-Asp-Lys	10291.40	14198.96
Phe-Gly	2171.57	2126.36
Phe-His Zwitterion	34426.53	37998.20
Phe-Ile-His-Arg	2085.66	871.57
Phe-Leu-Tyr-Asp	2959.02	1856.79
Phe-Lys-His	0.18	0.64
Phenethyl rutinoside	50839.20	53564.56
Phenol	81025.07	91956.54
Phenthoate	9744.58	14016.55
Phenylacetone	17452.30	19084.25
Phenylacetylglycine	8637.47	7469.93
Phe-Phe-Ser	59655.49	66289.21
Phe-Thr-Asn-Lys	1152.40	561.07
Phe-Tyr-Val-Lys	17905.99	17062.54
Phlorin	1695.36	930.03
Phlorizin	4941.06	2776.20
Phoenicoxanthin	1305.87	387.63
Phosphonoacetaldehyde	11324.00	2957.85
Phosphonoacetate	203117.63	252313.78
Phytosphingosine	230340.79	216956.98
PI(18:2(9Z,12Z)/20:3(8Z,11Z,14Z))	2637.08	458.67
Pinolenic Acid ethyl ester	4113.57	3494.94
Pinostrobin chalcone	11.81	221.16
Pipericine	2191.70	4527.04
Piperidine	3172.06	1015.65
Pivalanilide	149104.21	144019.05
Poloxamer-188	66118.54	72413.71
Polyporusterone A	628.42	1606.48
Polyvinyl chloride	3819.38	3825.80
Ponceau SX	3326.85	2518.85
Pov-pc	3063.48	2774.72
p,p^-DDE	25102.65	26386.29
Prallethrin	33399.90	24208.42
Prenol	1428.25	1472.97
Prinomide	1372.16	2069.25
Pro-Ala-Glu	2292.96	3151.91
Profenofos	80469.21	45627.79
Progesterone	29592.03	31615.14
Proline betaine	1591.20	707.02
Prolylthreonine	2212.63	2914.30
Pro-Lys	2150.98	1267.32
Promegestone	15401.61	2271.21
Propanoyl phosphate	2922.93	3836.15
Prorocentrolide	7228.23	5676.34
Prosulfocarb	2848.22	3104.43
Protoveratrine B	1176.54	413.33
Proxan	8690.01	11079.40
PS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/24:1(15Z))	5914.17	12676.10
Psilocin	1278.99	1354.64
Purmorphamine	492.51	1982.30
Pyrazin-2-carboxylic acid	25709.07	29418.16
pyrazole	75834.01	61763.41
Pyridaben	27208.72	33052.28
Pyridoxal 5^-phosphate(2-)	807.05	627.25
Pyridoxamine	12957.33	6475.37
Pyroglutamylglutaminyllysine	3671.74	4487.20
Pyrohyperforin	2092.62	2419.12
Quercetin 3,3^,7-trissulfate	1045.91	1858.56
Quinalphos	1357.03	1352.37
Quinoline	27775.40	24103.07
Quizalofop	3057.07	3276.01
(R)-3,3-dimethylmalic acid	3871.39	9444.95
Rebamipide	4878.43	8345.29
Rel-zanthodioline	1303.93	565.52
Repaglinide	24195.55	6815.96
Reticulataxanthin	69.32	108.69
Rhodovibrin	19763.81	25390.61
Rhodoxanthin	26597.06	28772.22
Riboflavin	3173.82	1786.56
Rimantadine	93.76	119.90
Risedronic acid	5117.51	3351.38
Ronidazole	3366.66	3978.97
Roxarsone	4906.41	1698.67
Rufloxacin	4190.89	3320.09
(S)-[2,8-bis(trifluoromethyl)quinolin-4-yl]-piperidin-2-ylme...	3996.46	2953.12
(S)-(+)-2-Hydroxy-3-methylbutyric acid	21619.89	22230.39
(S)-3-(2-Methylphenoxy)propane-1,2-diol	278.09	315.27
Safinamide	633.77	417.10
Salicyluric acid	5540.90	5310.10
Sanguinarine	917.05	977.73
SB 221284	1860.52	717.88
Schisandrin	99940.13	74726.48
Sebacic acid	667369.07	767531.29
Secoisolariciresinol	10031.75	4255.44
Selfotel	11514.00	2744.93
Se-methylselenocysteine	1284.10	2153.33
Ser-Asn-Thr-Arg	2471.98	2751.38
Ser-Asp-Asn	1398.56	1155.34
Ser-Ile-Asn-Lys	123429.69	112555.29
Ser-Ile-Lys-Gly-Lys	15607.77	12062.60
Ser-Nap-OH	28129.51	27375.34
Ser-Ser-Val-Gln-Glu	368.44	1709.72
Sesamol	2670.39	635.20
S-Lactoylglutathione	20169.51	17663.65
(S)-Mephenytoin	3261.78	4172.60
(S)-Methylmalonic acid semialdehyde	500.53	1300.20
Smilagenin	1823.47	610.10
(S)-N1-((1H-Benzo[d]imidazol-2-yl)methyl)-N1-(5,6,7,8-tetrah...	2639.29	1995.25
Sodium (2R,3R,4S)-2,3,4,6-tetrahydroxy-5-oxohexyl phosphate	76169.11	105613.20
Sorbitan, monohexadecanoate	2216.62	3275.85
Soyasapogenol B	73280.74	68118.09
Soyasapogenol B 24-O-b-D-glucoside	5195.39	5271.48
Spheroidenone	2867.20	2990.13
Sphinganine	2627.10	2488.12
Sphingosine 1-phosphate	28621.33	19522.93
s-(p-Nitrobenzyl)glutathione	3150.35	2393.91
Sporidesmolide 1	27521.22	2493.64
Stachyose	18802.69	77020.72
Stearic acid	770.84	1282.46
Stearidonic acid	49333.96	50419.76
Stearoylcarnitine	8932.82	7215.49
Stigmasta-4,22-dien-3-one	318.57	538.83
Stigmastane-3,6-dione	10345.18	7933.92
Styrene	48654.44	52302.05
Sucrose	29530.53	24961.22
Sulfanilamide	47522.88	34356.62
Sulfite	4522.09	4802.47
(S)-Ureidoglycolic acid	3562.44	2472.60
Tacalcitol	1993.12	2484.52
Taurolithocholic acid	2480.17	650.55
Tebuconazole	3395.01	1483.24
Tebutam	6335.63	6501.27
Tenovin-6	9941.82	12080.91
Tert-butyl 3-(iodomethyl)azetidine-1-carboxylate	8903.86	7333.01
tert-Butylamine	10325.70	11290.20
Tetradecanal	18472.27	18887.63
Tetradecanol	1474.61	1306.01
Tetraethyl pyrophosphate	1128.43	2543.48
tetrahydrozoline	648953.65	677409.02
TG(16:0/16:0/18:2(9Z,12Z))	4213.86	5127.44
TG(16:0/16:0/20:5(5Z,8Z,11Z,14Z,17Z))	364.19	1016.95
Thiazolidine-4-carboxylic acid	26347.39	37529.39
Thidiazuron	27840.04	13883.65
Thiirane	389641.50	288190.09
Thioctic acid	14819.29	22414.24
Thioetheramide PC	28141.43	5587.04
Thionicotinamide	19212.10	10214.04
Thioridazine	2388.14	3837.84
Thiosulfate	112304.38	88130.89
Thiothece-474	8684.14	9787.47
Thiourea	8742.51	7284.37
Thiram	389723.42	216749.95
Thr-Leu-Lys	2782.15	2757.35
Thr-Pro-Pro-Val-Gln	2330.46	2538.34
Thr-Trp-Met	73230.67	79287.15
Ticlopidine	10919.70	24309.88
Torachrysone 8-O-Glucoside	1992.26	419.26
trans-Anol	759.37	762.18
trans-Coumaryl acetate	10880.47	11657.52
trans-p-Menthane-1,8-diol	54678.15	50268.82
Treosulphan	3510.52	3307.40
Triacetin	6491.14	10498.88
Tribenuron-methyl	5353.59	5150.69
Tricosane	264.09	961.45
Triethylene glycol monomethyl ether	4754.90	5383.81
Triethylenetetramine	377581.09	429304.96
Trifluoperazine	7494.78	6132.95
Trilinolein	2340.62	2400.96
Trimethylamine N-oxide	10990.41	14969.63
TRIPHENYL PHOSPHATE	5310.15	5580.55
Troglitazone	889.80	649.30
Trp-Ala-Arg	120794.64	103944.99
Trp-Ala-Tyr	25399.13	27043.46
Trp-Gln-Leu	3957.09	3383.26
Trp-His-Tyr	738.62	24.70
Trp-Met-Glu	1807.60	1556.53
Trp-Tyr-His	2585.24	429.71
Trp-Val-Arg	5988.10	7010.20
Tuberostemonine	1021.53	4802.75
Tumonoic acid A	2770.76	2675.24
Turanose	242274.65	201987.70
Tyr-Glu-Arg-Arg	705.34	1970.59
Tyr-His-Ile-Glu	6631.20	6499.13
TyrMe-Lys-OH	2026.58	2341.19
Tyr-Phe-Thr-Lys	13729.02	10120.02
Tyr-Pro-Glu	2622.80	2732.38
Tyr-Pro-Trp	3291.98	4068.32
Tyr-Ser-Arg	4547.86	6540.17
Tyr-Trp-Cys	4643.06	4737.42
Ulifloxacin	2603.85	2316.09
Umbelliferone	5055.74	2168.89
Uric acid	11935.01	12725.80
Uridine-5^-diphosphate	32471.95	51475.23
Val-Arg-Ala-Glu	5338.60	4906.93
Val-Ile-Leu-Asp	1819.62	1608.48
Val-Leu-Leu-Val-Val	2219.73	1630.39
Val-Pro-Glu-Pro-Lys	4750.00	5094.64
Valproic acid	2653.11	2729.06
Val-Tyr-Gln-His-Val	6385.23	10488.24
Val-Tyr-Gln-Lys	15806.54	9555.85
Verimol B	256.82	1547.21
Vinclozolin M2	71500.36	52970.61
Vitamin K	5892.20	6120.39
Vorinostat	22280.49	16901.19
Xanthine	55479.89	64760.97
Zerumbone	5330.74	4737.73
(Z)-hexadec-2-enoic acid	10510.48	9054.08
Zoledronic acid	31348.33	32263.22

Factors:

F1	Sample date:3 day \| \| Group:T-G3
F2	Sample date:9 day \| \| Group:T-G9