Data for ST002761   

(Analysis AN004487): Average values per metabolite and experimental factor (Units:Area)

Metabolite structureAll dataF1F2F3F4F5F6F7F8F9
(10E,15Z)-9,12,13-Trihydroxy-10,15-octadecadienoic acid
7689598.12 8153631.57 5544015.00 4400606.07 326173.84 2249156.72
10-formyldihydrofolic acid
2776042.04 1652997.04 2792600.37 3041278.27 35295.74 2147605.84
10-HDA
6029859.70 7445157.53 7235438.69 19307458.38 355416.00 5269674.46
10-Nitrolinoleate
1358596.17 1752405.08 724211.80 1335113.90 279740.13 243785.04
10-oxo-8-decenoic acid
11817764.84 12484160.04 12368471.80 59882107.33 660610.84 8644339.65
(10S)-Juvenile hormone III acid diol
2677469.31 3089844.33 3511325.97 15492991.56 69031.36 2307603.77
10-Undecenoic acid
24469119.35 16039756.30 17465980.69 20074858.47 4237684.79 16874653.36
11-Aminoundecanoic acid
598023.45 456342.18 803271.45 5581774.85 364718.97 861377.87
(11E,15Z)-9,10,13-trihydroxyoctadeca-11,15-dienoic acid
1839529.55 882665.37 1629879.78 6126442.66 367635.17 1418190.62
1-(1H-Indol-3-yl)-1,2-ethanediol
2124030.00 1218349.40 1667075.37 4286073.55 54296.43 1298698.68
11-Nor-9-carboxy-thc
4980129.18 3579772.74 8482403.88 1251117.21 78329.32 3992325.56
12,13-Epoxytrichothec-9-ene-4,7-diol
2324254.00 1067015.27 2288699.46 3310053.23 714321.03 661717.05
1-(2,2-Dimethyl-2H-chromen-6-yl)ethanol
398925.70 432647.38 403158.06 1910380.14 83861.45 118204.64
1,2,3,4-Tetrahydro-β-carboline-3-carboxylic acid
5707669.70 4833375.60 6690090.40 27070178.23 45469.71 4613516.62
1,2,3,4-Tetramethyl-1,3-cyclopentadiene
33945513.84 23221762.68 32804155.61 93713240.46 575675.45 9042848.83
1-(2,3-Dihydro-1H-pyrrolizin-5-yl)-1,4-pentanedione
2846434.57 371230.77 2763512.16 611336.45 66453.09 350240.67
1-(2,4-Dihydroxyphenyl)-2-phenyl-1-propanone
1366372.02 1631772.02 1097701.73 952771.00 35598.93 571154.04
1,2-Benzoquinone
5426613.14 5264534.52 5323191.98 9480884.34 1253443.41 3587068.39
1-(2-{[benzyl(methylsulfonyl)amino]methyl}phenyl)-4-piperidi...
8347607.15 2361992.95 8281660.00 1631758.90 84179.23 1912223.14
1-(2-Carboxyethyl)-2,3,4,9-tetrahydro-1H-beta-carboline-3-ca...
341417.74 352595.50 345848.86 3162494.62 26728.94 291145.65
1-(2-Furyl)ethanethiol
30022281.30 24173533.88 26210158.84 57132312.07 393424.99 18586510.53
1-[2-(Hydroxyamino)phenyl]-1,3-decanedione
673179.29 547905.89 666102.57 3303172.57 34182.74 378496.38
12-oxo-ETE
1016862.13 1493184.08 605660.66 236574.88 102840.60 523468.99
12-oxo Phytodienoic Acid
1487437.91 1581516.43 1150773.80 2326947.89 104393.01 720619.37
(12Z)-9,10,11-trihydroxyoctadec-12-enoic acid
12022299.85 19611552.46 4282545.18 1586120.50 460236.77 4477573.27
1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid
817876.67 2677131.50 1158087.81 9010800.23 168401.02 1139290.42
1,3,5-Heptatriene
845305.49 859217.98 852587.18 4964192.37 266822.41 716548.04
1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
4140104559.00 4226333035.30 4004539669.80 2612001275.80 1970090.92 2386822265.40
1-(3a-Hydroxy-5-methoxy-3,3a,8,8a-tetrahydropyrrolo[2,3-b]in...
17730478.15 10500996.11 18628349.95 91866340.30 148066.03 15203539.89
1-(3-Amino-3-carboxypropyl)-5-oxoproline
54695295.42 49414291.44 61017257.11 94807872.85 186356.15 57605829.78
1-(3-Furyl)-1,4-pentanediol
31101136.41 11672985.88 36028939.80 22172446.53 13042114.36 17020435.59
(±)13-HpODE
22114658.58 23484382.80 16050088.71 23182670.90 151220.48 9434203.89
1-(3-Hydroxypropanoyl)-1,3,6,8-tetramethyl-1,2,4a,5,6,7,8,8a...
8669030.06 11065334.86 7916223.21 23273681.83 115494.89 5352147.79
1-(3-Hydroxypropyl)-2-azetidinecarboxylic acid
44279370.74 33178274.19 86297049.79 1706672583.10 906205.43 252399796.16
1-{[(3S,4S,5R)-2,3,4-Trihydroxy-5-(hydroxymethyl)tetrahydro-...
229641525.87 6303666.80 329408466.83 16838068.17 233168.39 5416719.52
13(S)-HOTrE
3701392.12 2164448.85 2673429.39 10635719.36 463557.74 2620610.76
1,4,5-Trihydroxy-5-hydroxymethyl-2-methoxycyclohex-1-en-3-on...
66244760.78 58637153.55 64158318.28 183265619.33 354197.38 21943386.05
1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-8-methyl-1,2,3,4-tetrah...
28076845.71 28271763.29 25243099.13 65727105.84 368365.59 18093655.89
1,4a-dimethyl-9-oxo-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octa...
60980177.13 36552415.05 54079018.87 12705360.47 1746152.31 28931808.19
1-(4-Amino-4-carboxybutanoyl)-2-piperidinecarboxylic acid
4682550.88 5774402.20 4638817.90 18661313.64 561557.45 2573278.79
1-(4-Butylphenyl)-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,...
1153424.58 1080041.45 1410868.07 7849770.62 678883.83 6458898.91
1,4-Dihydro-4-imino-1-β-D-ribofuranosyl-3-pyridinecarboxy...
264296189.83 236209630.95 264092283.44 854943082.10 147538.91 191154036.86
1,4-dihydroxy-1,4-dimethyl-7-(propan-2-ylidene)-decahydroazu...
4868330.16 5532282.07 5366893.91 27944705.79 266675.60 5267920.11
1-[5-(4-Hydroxy-2-butanyl)-2-methyltetrahydro-2-furanyl]-4-m...
5274045.34 1320023.52 6613411.14 898639.39 921978.41 1731804.87
1-(5-Acetyl-2-hydroxyphenyl)-3-methyl-1-butanone
2465362.67 2274133.48 2355642.98 4664421.17 2713334.70 2625765.00
1,5-Anhydro-D-erythro-hexo-2,3-diulose
29132091.73 26683764.16 36261005.61 37653763.61 15509320.75 29924622.09
1,5-Dimethyl-8-[(1E)-3-oxo-1-buten-1-yl]-6-oxabicyclo[3.2.1]...
1993395.06 1616591.36 2291018.56 5406225.91 482842.14 773331.80
1-(7-Amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-1,4-anhydro-5-S...
21649993.26 16231059.76 20313275.64 19941605.70 121606.52 13825440.35
1,7-Dihydroxy-12-methyl-13-vinyl-2,10-dioxatetracyclo[5.4.1....
21111027.49 11375060.47 19935216.61 10995968.01 3374616.73 9873821.39
1,7-Dihydroxy-6,6-dimethyl-3,5,5a,6,7,8,9a,9b-octahydronapht...
1261475.17 537730.66 2329260.34 2954126.39 592675.90 4108733.84
1,7-Diphenyl-3-heptanone
418494.16 294608.89 830605.06 1391707.04 31378.79 395364.59
17-(Hydroxymethyl)-12-methyl-8-oxapentacyclo[14.2.1.0~1,13~....
3460341.87 3903455.60 2370659.18 817273.62 87397.58 929797.95
1′-Acetoxyeugenol acetate
5788282.94 5784089.25 6762383.42 21276311.26 181932.49 4873697.93
1-acetyl-3-(2-furylmethylene)tetrahydropyrazine-2,5-dione
117455.00 192625.17 300539.13 3210060.63 47617.22 323921.79
1-arachidonoyl-sn-glycero-3-phosphoethanolamine
11349370.95 7330586.92 5884210.90 13294790.99 368570.03 276616369.88
1-(beta-D-Ribofuranosyl)-1,2-dihydropyrimidine
7821911.89 10329023.60 9731904.27 22526866.55 153588.60 13334253.48
1-(beta-D-ribofuranosyl)thymine
1035779422.91 784467677.72 1104843605.79 1932786519.90 873967.79 840072554.38
1-Cyclohexenecarboxylic Acid
3664051.59 4910996.90 3503984.02 9063392.71 703752.27 1601124.38
1-(Diisobutylamino)-3-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrah...
13257800.01 7364116.15 9543221.17 39643807.62 62889.37 6474294.01
(1E)-1-(3-Oxo-6,7-dihydro-2-benzofuran-1(3H)-ylidene)-2-buta...
325396.13 1176523.53 270671.62 941338.45 32179.35 218328.07
(1E)-N-Hydroxy-4-(methylsulfanyl)-1-butanimine
44740544.17 13052489.75 14812550.43 6522576.73 161416.33 8178554.69
1-guanidino-1-deoxy-scyllo-inositol
6747032.77 5931668.36 7768955.07 3688129.18 37114.93 8745213.88
1H-Benzimidazol-5-ol
59523945.06 61313920.89 51237546.17 171237218.86 239833.89 37960813.33
1-heptadecen-4,6-diyn-3,9,10-triol
718907.67 907254.01 1202616.46 3504061.36 131653.88 857726.76
1-Isopropenyl-3-isopropylbenzene
2426215.71 2686920.59 6228707.90 4035538.06 87932.36 1139914.81
1-Isopropyl-4,8-dimethyl-9-oxospiro[4.5]dec-7-en-2-yl acetat...
3060704.84 4069232.92 3826215.75 17715916.79 143225.15 4467183.90
1-(malonylamino)cyclopropane-1-carboxylic acid
14976331.41 18397888.72 15930245.37 36408430.65 43213.61 2954102.39
1-Methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1,3-dicarboxyl...
2271579.25 2483436.46 3479436.98 3750661.64 76491.34 1022611.05
1-Methylguanine
14547628.06 12998049.35 15371694.83 58464180.93 36978.65 11514821.67
1-Methylhistidine
16533767.20 17916372.54 17210607.83 58731564.98 134344.40 31429466.32
1-Methylimidazoleacetic acid
12199749.51 10613026.94 28831231.68 184621632.84 2689048.23 17272294.57
1-Methylinosine
77835611.01 71719939.05 87050520.08 319018101.35 87639.87 64777211.68
1-(Methylnitrosoamino)-4-(3-pyridinyl)-1,4-butanediol
29517493.70 27654129.31 25772024.73 96285190.28 103829.66 14233280.23
1-Methyluric acid
241072981.25 178097292.20 246965746.79 407749693.28 537488.47 163849730.58
1-nonanoic acid
60683569.47 64860471.30 42550106.64 113119068.00 655032.33 12992980.26
1-O-[2-(Methylamino)benzoyl]-beta-D-glucopyranose
6199004.01 7466365.38 4586182.18 41797337.16 98748.81 4533713.91
1-Pentofuranosyl-2,4(1H,3H)-pyrimidinedione
14849749.53 18491128.87 16022537.44 21415510.32 108795.74 130005264.06
1-Phenyl-2-hexanone
3823401.76 3487827.81 2852685.33 3723938.74 419450.31 1538500.25
1-Piperideine
81890293.54 65318912.26 78095058.51 186002017.84 2761102.57 60915539.01
(1R,2S)-1-(7,8-Dihydro-6-pteridinyl)-1,2-propanediol
34181373.55 30626070.00 38537484.83 91856617.20 13748809.13 31658968.46
(1R,4aS)-7-(2-Hydroxypropan-2-yl)-1,4a-dimethyl-9-oxo-3,4,10...
126650083.14 163447410.66 110801603.04 34166843.07 604248.39 41983324.12
(1R,5R)-3,3,5-Trimethylcyclohexyl 5-oxo-L-prolinate
5706820.38 252409.49 5196293.43 553025.90 31080.92 617530.11
[(1S)-2,2,3-Trimethyl-4-oxocyclopentyl]acetic acid
20674361.41 19723449.15 15174553.49 10743182.32 910213.51 7952389.75
(1S,2R)-3-(4-Chlorophenyl)-3,5-cyclohexadiene-1,2-diol
3959295.83 7771286.36 6969811.45 84822116.52 32967.82 10089508.06
(1S,2R,5S)-2-Isopropyl-5-methylcyclohexyl 3-oxobutanoate
506781.12 314951.03 724660.33 1837157.16 102047.64 161600.84
(1S,2S,4aR,7R,8aR)-1-[(3Z)-5-hydroxy-3-methylpent-3-en-1-yl]...
1060013.25 448214.86 1606080.00 332022.89 47969.84 384769.30
(1S,3R,4S)-3,4-Dihydroxycyclohexanecarboxylic acid
22822609.35 18030786.55 21304541.00 26714131.20 1290118.96 9906395.80
(1S,4aR,5S)-5-[(3E)-5-Methoxy-3-methyl-5-oxo-3-penten-1-yl]-...
3913944.30 4418727.97 5319398.44 1466301.10 36492.59 1781043.96
(1S,4aS,5R)-5-[2-(3-Furyl)ethyl]-1,4a-dimethyl-6-methylenede...
6341158.31 11158550.00 3438488.68 1072189.43 79655.22 2293440.97
(1S,4S,5R,9R,13S)-5,9-dimethyl-14-methylidenetetracyclo[11.2...
33182545.03 41203319.75 13523023.01 2977779.45 91637.91 15057928.22
(1S,5R)-5-Isopropenyl-2-methyl-2-cyclohexen-1-yl beta-D-gluc...
322649.75 171253.39 575213.78 2009210.34 93786.42 277021.74
(1S)-6-Acetamidooctahydro-1-indolizinyl acetate
2353260.00 2620899.91 2846995.12 609810.64 41320.40 853340.70
(1S,6R,11aR,13R,14aS)-1,13-dihydroxy-6-methyl-1H,4H,6H,7H,8H...
8766019.00 9903469.25 7230029.97 23115872.45 218735.94 5763257.79
(1S,6S)-6-Aminooctahydro-1-indolizinyl acetate
3934692.01 6103256.51 1734382.40 949015.51 56319.05 415942.37
1-Tetradecylamine
5691863.74 5836643.76 4810924.73 6065122.47 418529.71 2180307.61
1-Vinylimidazole
9839616.45 7904509.92 8628667.24 23238405.50 744761.22 8383198.96
(1Z)-N-[2-(3-Hydroxy-5-methoxy-2,3-dihydro-1H-indol-3-yl)eth...
2120941.93 1410608.34 2381978.76 3992307.33 41202.62 885411.98
2-(1,2-Dihydroxy-2-propanyl)-6,10-dimethylspiro[4.5]dec-6-en...
1039481.60 1035049.18 1388647.68 4827455.04 80621.18 707548.59
2-(1-Carboxyethyl)-5-methylcyclopentanecarboxylic acid
23519746.44 26182318.11 25869867.97 80641483.27 5307824.23 13429431.20
2,2^-[1,2-Propanediylbis(oxy)]diethanol
11856252.75 10225409.12 11479264.52 9917664.11 842432.44 1833458.19
2-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-2,3-dihydropyran-...
2010673.26 3703607.59 1715884.50 8535531.42 426292.71 1833492.64
2,2,3-Trimethyl-5-oxo-3-cyclopentene-1-acetic acid
23612875.85 31144399.30 33970831.24 35777225.80 2433797.26 13954830.32
2-[2,4-Dihydroxy-3-(3-methyl-2-buten-1-yl)phenyl]propanoic a...
6234184.93 4279192.42 5979144.19 12102666.31 1028621.65 3494743.76
2-(2,4-Dihydroxyphenyl)-3-[(2E)-3,7-dimethyl-2,6-octadien-1-...
6976643.54 4900745.86 5260176.49 15836299.94 49033.59 2948901.98
2,2,6,6-Tetramethyl-1-piperidinol (TEMPO)
9366087.61 9793306.19 14979239.05 11469454.44 7612114.35 14069768.66
(2,2,7,7-Tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4^,...
3938872.62 2212901.31 2583396.41 10394443.84 36286.44 2192249.93
2-(2E)-2-Octen-1-ylcyclopentanone
315024.17 488113.19 437710.91 6967645.64 76692.38 1419637.31
2-(2-Ethoxyethoxy)ethanol
10172609.14 3724634.51 13727906.52 5735595.71 2249173.33 7883559.77
2-(2-Hydroxy-2-propanyl)-4-methoxy-7-methyl-2,3,6,7-tetrahyd...
3836906.79 6160662.83 2409416.21 6714120.81 240696.11 1106722.42
2,2^-Iminodipropan-1-ol
67581949.10 59493533.11 66320307.80 149964844.18 1949085.64 48254015.72
2-(2-methylthioethyl)malic acid
5417982.80 4284922.45 5380076.58 3594393.07 43763.25 2895221.94
2,3,4,9-Tetrahydro-1H-beta-carboline-1,3-dicarboxylic acid
5731330.27 5703158.25 5476006.58 12237271.34 70755.49 3687764.09
2,3,4,9-Tetrahydro-1H-ß-carboline-3-carboxylic acid
16325559.61 13005402.04 16051867.27 36485018.77 58618.23 10050932.11
235BBF3K97
316180.79 329777.98 362727.57 270723.48 348521.63 15484804.72
2,3-Diaminosalicylic acid
80451282.62 68110721.97 86389066.40 193344271.05 175939.09 59343511.26
2,3-Dimethoxy-5-methyl-6-(3-methyl-2-buten-1-yl)-1,4-benzene...
3832398.21 2171458.61 5007284.31 4119216.02 499133.11 753370.45
2,3-Dinor-11ß-prostaglandin F2a
3545496.32 8210187.90 2277819.69 1539421.49 89378.45 1111994.61
2-[3-(Hydroxymethyl)-2-oxiranyl]phenol
7436541.01 7659020.94 6879944.63 9657647.73 325487.69 3310632.22
2444643WXK
3391622.90 2873101.82 2564133.98 11832089.17 605971.43 1791620.10
2,4,6-Octatriyn-1-ol
2454931.96 3422967.91 4001469.48 21977525.28 46940.91 3796634.11
2,4-Diacetamido-2,4,6-trideoxy-alpha-D-mannopyranose
66320357.14 65014479.65 64187495.04 198630915.13 617714.82 47576106.32
2,4-DIFURFURYLFURAN
2191227.61 1823709.33 2225996.51 2131913.68 31257.14 686234.30
2,4^-dihydroxyacetophenone
17116258.42 15357081.59 22548034.64 37486487.60 792069.83 14581365.90
2^,4-Dihydroxychalcone
99515.91 177354.52 114112.38 604717.99 98423.12 3138109.85
2,4-Dimethyl-5,6,7,8-tetrahydroquinoline
797400.14 471291.21 722029.94 1838522.56 76236.76 358328.72
2,4-Dimethyladipic acid
63035101.59 65703422.44 64828134.41 116075257.07 1270995.03 47248572.49
2,4-Dimethylbenzaldehyde
6438797.08 6210321.66 7570426.57 13124521.75 318215.94 4719411.38
2,4-Quinolinediol
96772711.17 108412704.76 96360461.83 258308555.08 529295.44 79080873.96
2-[5-(2-hydroxypropyl)oxolan-2-yl]propanoic acid
8030110.06 6994796.35 8347763.06 18998312.73 257568.51 4273837.51
2,5-Dimethyl-2,5-hexandiol
33790297.18 14541230.71 39750985.80 14504593.36 28119016.02 103015273.92
2,5-Dimethyl-4-ethoxy-3(2H)-furanone
8727884.47 6280573.20 12451583.53 9533853.14 1811379.84 10558764.36
2,5-Dipropyl-4-methylthiazole
65093623.16 61563491.69 52259535.03 91351792.59 46685696.15 51041874.45
2,5-Furandicarboxylic acid
37103254.48 45785130.60 65448981.89 6473809.48 158159.97 63999920.18
2-[(5-Hydroxy-1H-indol-3-yl)methyl]-1,3-thiazolidine-4-carbo...
2213488.85 1886515.31 2117537.33 7038540.40 32768.81 1409345.06
2-[(5R,8S,8aS)-3,8-dimethyl-2-oxo-1,2,4,5,6,7,8,8a-octahydro...
10631139.30 10362006.69 10057372.27 23212012.76 81260.17 8062676.78
267Z8UAR9Q
56268372.35 65407750.97 51450491.36 78093108.00 2103371.87 34357550.11
2-(6-Amino-1H-purin-1-yl)ethanol
7171158.90 7936762.85 10022302.46 20431039.65 195258.47 5064083.05
2,6-Diamino-4-methyleneheptanedioic acid
55053607.66 59622703.82 87144102.42 123856279.16 1612963.57 51680477.30
2,6-Diamino-7-hydroxynonanedioic acid
9389510.74 9469083.29 8771154.80 28454301.26 52545.87 5497107.50
2,6-Dideoxy-3-C-methyl-beta-L-ribo-hexopyranose
35424552.13 30362691.08 33488761.39 74563034.78 613623.38 27543207.28
2,6-dimethyldeca-2,4,6,8-tetraenedial
6950855.51 8978670.52 5025034.47 4590374.43 187345.57 2249527.88
2,6-Dimethylpyrazine
142446006.79 91512210.43 147505861.64 217576812.67 1441597.86 142340073.24
2-({6-O-[(2R,3R,4R)-3,4-Dihydroxy-4-(hydroxymethyl)tetrahydr...
1189265.59 1291735.53 1231058.33 4422123.67 40802.35 654317.42
(+)-2,7-Dideoxypancratistatin
1769359.35 1968648.87 1907463.39 4430236.05 47090.71 1454933.44
2,7-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one
7008942.65 7228063.17 6978673.11 15204471.73 84228.09 4872123.71
(2,7-Dimethyloctahydro-1H-cyclopenta[c]pyridin-4-yl)methanol
352023.29 184873.60 1138684.51 540057.93 68657.85 129770.22
2-[(8E,11E,14Z)-8,11,14-Heptadecatrien-1-yl]-6-hydroxybenzoi...
2829501.86 1395446.45 3316382.57 26494775.65 102393.84 4760988.52
2-(8-Hydroxy-4a,8-dimethyldecahydro-2-naphthalenyl)acrylic a...
2522006.41 6108816.53 2468728.48 5131153.28 70848.72 1500077.10
2-Acetamido-4-methylphenyl acetate
1275692.92 1108659.94 1653656.83 12241036.91 43519.12 3202738.08
2-Acetamido-4-O-[2-(carboxyamino)-2-deoxy-beta-D-glucopyrano...
16515899.88 16013679.92 16956575.38 51564048.85 34530.84 12507625.20
2-Acetamidooctanoic acid
52560334.37 41264073.41 51304631.92 266385574.79 178044.25 41260271.70
2-Acetyl-1-methylpyrrole
2376811.89 2024562.32 2111921.55 7640345.77 144234.33 2092567.94
2-Acetyl-3,5-dimethylfuran
8947870.15 7229469.17 12782144.47 9693870.42 1152630.79 8683993.67
2-Acetyl-4-methylpyridine
8558200.72 6996841.62 8332364.11 68201383.58 928042.14 8878534.46
2-(Acetylamino)-4-phenylbutanoic acid
1387797.88 971818.85 2193311.62 9862023.83 35850.54 1344319.10
2-Acetylcyclohexanone
10458452.27 11027993.61 8940649.89 39266410.48 3048267.85 6762017.72
2-amino-2,3,7-trideoxy-D-lyxo-hept-6-ulosonic acid
8656532.19 8578184.58 8667446.50 11180790.00 183612.78 7085234.37
2^-Amino-2,3-biphenyldiol
3033496.83 3225841.45 2753853.61 2868855.74 160538.82 1301668.96
2-Amino-2-deoxy-4-O-β-D-galactopyranosyl-D-glucose
8119046.24 7998981.72 9667109.02 5934349.51 65154.56 8863703.76
2-Amino-3-(1H-imidazol-4-yl)propanal
7982182.11 6479288.37 7347626.04 26386319.70 1301060.32 4877005.96
2-Amino-4-{6-[(3-methyl-2-buten-1-yl)amino]-3H-purin-3-yl}bu...
1862063.72 3337496.72 1459543.22 1438823.10 90420.39 586399.96
2-Amino-6-[(E)-(5-amino-5-carboxy-2-hydroxypentylidene)amino...
1997665.35 1679782.10 4526956.26 52867969.78 47411.44 6287019.88
2-Amino-9,10-epoxy-8-oxodecanoic acid
15018767.51 10416866.36 17164738.68 68463716.03 190997.32 12234689.80
2-Aminonicotinic acid
9049280.19 7891065.88 9698732.86 27832347.27 332644.11 6506700.16
2-Aminooctadec-4-yne-1,3-diol
163041.39 182528.97 165322.85 175517.53 138327.66 11042027.07
2-Anisic acid
11088853.90 10242800.57 13248408.41 32377075.30 410598.12 9615936.85
2-Butyl-6-methoxyphenol
2050173.70 3487311.63 2135622.90 8213347.01 762230.90 1501460.14
2-[(Carboxymethyl)amino]-7-octenoic acid
20105083.92 20173466.77 24129915.07 101325906.61 159985.00 20505599.53
2^-Deoxyadenosine
334532.24 1163861.02 571476.86 44393395.91 38439.30 2894280.75
2^-Deoxycytidine
1548600820.15 1447474069.85 1598482838.42 6220820464.60 465658.62 1291354921.80
2^-Deoxycytosine
19463010.98 14379563.44 25531994.99 12047976.78 12772705.76 9759056.64
2-Deoxyhexopyranose
5058112.38 2754232.28 4726799.43 2434702.23 693023.79 2456174.70
2^-Deoxyinosine
6272785.78 7138626.26 6983264.98 19113489.37 71406.28 4990488.21
2^-deoxymugineic acid
43526802.82 41436304.47 44606271.17 145148816.60 257242.31 35517336.12
2^-Deoxysepiapterin
50428145.60 41513900.83 39445108.11 138432757.61 32301.55 3205317.91
2-Deoxystreptidine
12716973.48 11524359.90 11452583.05 21938624.36 621237.99 6006139.36
2^-Deoxyuridine
20600990.26 109429833.85 29764914.91 39083114.47 473510.01 22296959.53
2-Dimethylamino-5,6-dimethyl-4-hydroxypyrimidine
25115187.59 23697992.14 43971446.76 30548419.80 143805.87 17881299.46
(2E)-2-[2-(1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydron...
16541699.10 29960430.93 14253334.30 35660439.02 66181.93 9494233.58
(2E)-2-(2-Furylmethylene)butanal
14624635.74 13614232.70 14999709.75 43588262.30 518392.48 9949077.32
(2E)-2-Heptenoic acid
12316989.99 12879376.26 8696459.74 8991241.77 844507.15 6566809.17
(2E)-2-Octenal
82002524.69 57490057.03 83551018.85 188898202.62 1706138.78 17942932.26
(2E)-3-(2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymeth...
390549.19 3491644.92 8744184.64 878218.59 41809.25 716698.80
(2E)-3-(3,4-Dimethoxyphenyl)acrylic acid
9529808.05 7303522.82 9271518.62 9773009.53 223159.97 4071198.76
(2E)-3-(3-Hydroxyphenyl)acrylaldehyde
4743428735.30 4270802282.40 4056865446.20 10248823685.40 1554615.88 3486081915.20
(2E,4E,7E)-2,4,7-Decatrienoic acid
12761602.87 11906282.42 14635566.40 29586402.34 695599.16 8106238.56
(2E,4E,7Z)-2,4,7-Decatrienal
1545706.71 3890004.13 2195371.21 3364567.36 419005.43 3823258.47
(2E,4Z)-2,4-Decadienal
8768958.29 7965375.11 9489809.16 44825461.47 558580.43 5996985.25
(2E,4Z)-Heptadienal
310245092.95 184239513.79 379298598.05 237723705.53 20983800.55 36965719.78
(2E)-5-Hydroxyferulic acid
11960877.24 17113401.80 11027708.42 12846382.91 89940.20 6827670.84
(2E)-5-(Methylsulfanyl)-2-[(methylsulfanyl)methyl]-2-pentena...
4777393.28 4465323.89 6016740.66 2649670.21 11533253.71 29320032.56
(2E,6Z)-Nona-2,6-dienal
23414955.08 22502196.77 17924832.32 26170729.88 529307.52 10361728.31
(2E)-decenoic acid
7989906.42 7596450.13 10643080.35 37705258.72 518487.37 5318373.38
(2E)-N-(4-Aminobutyl)-3-(2,4-dihydroxy-3-methoxyphenyl)acryl...
3989052.69 5826377.93 4121650.76 3503280.78 27640.61 3527490.69
2-Ethyl-4,5-dimethylthiazole
15437677.50 14902398.70 12599033.37 26482492.26 3893363.24 9083357.54
2-formylphenylformamide
184821529.46 168288975.77 184692667.91 317080632.42 2464937.30 117649885.56
2H-Pyran
9931884.91 10862734.25 30905912.37 66225323.38 2703923.09 9091633.36
2-Hydroxy-1-(6-hydroxy-2-isopropenyl-2,3-dihydro-1-benzofura...
350136.76 206261.11 395105.61 2059216.73 132941.01 287520.98
2-Hydroxy-2-(2-oxopropyl)succinic acid
15684592.72 62243869.05 98169051.42 18479050.33 249801.57 13161935.67
2-Hydroxy-3-isobutyl-9,10-dimethoxy-1,2,3,4,6,7-hexahydro-11...
257890.80 347504.91 325489.69 2587434.88 52321.39 531496.08
2-Hydroxy-4,5^,8a^-trimethyl-1^-oxo-4-vinyloctahydro-1^H-spi...
16855534.43 22392458.57 9882730.22 3174341.76 438813.62 5538961.52
2-hydroxy-4-methoxy-3-(3-methylbut-2-en-1-yl)-6-(2-phenyleth...
9479420.12 7466438.23 10407795.87 31539499.12 4265473.74 7251045.15
2-Hydroxy-6-[(E)-2-(4-hydroxyphenyl)vinyl]-4H-pyran-4-one
3798669.90 6020558.92 5295697.72 24711050.34 53793.73 8338793.10
2-Hydroxy-cis-hex-2,4-dienoate
30501403.68 31707619.09 47306683.53 52639810.31 1172389.74 15864706.46
2-Hydroxyethylclavam
405574924.88 358668597.11 431642970.18 1633416308.14 1801793.26 313070607.70
2-Hydroxyhippuric acid
11835349.30 12757385.26 15623475.60 28393366.75 49492.04 10068256.13
2-(Hydroxymethyl)-3,5-dimethoxyphenol
16686788.09 15417107.06 12765355.84 36811974.15 1596205.11 7600783.15
2-Hydroxyquinoline
7642909.79 7972208.86 8474355.20 14369681.66 520429.16 5993265.22
2-hydroxysebacic acid
63560860.26 49981349.05 69122942.02 149066888.76 1049909.90 41497653.36
2-Isobutyl-3-methylpyrazine
5658132.62 4902038.76 4449043.06 15740948.26 101075.96 1859995.94
2-Keto-glutaramic acid
7099746.84 9141812.50 7032604.55 6920802.51 445897.42 7051617.47
2-MeO-E1
4257939.01 4781157.30 3400277.48 1097159.10 73881.08 1759003.66
(2-Methyl-3-methylenebicyclo[2.2.1]hept-2-yl)acetaldehyde
1301232.89 1095949.46 714445.14 2581458.70 208922.80 176431.73
2-Methyl-3-phenylpropyl hydrogen sulfate
81434388.16 78162955.94 85231330.60 151653472.66 85825.72 53840530.97
2-methyl-4-ethyl-5-propyloxazole
1282592.44 2529349.85 630037.49 3683348.65 42454.39 353866.56
2-Methyl-4-quinolinol
75501544.74 58495693.96 66740661.87 166829481.39 168280.65 46371585.51
2-Methyl-5-propionylfuran
5112067.84 4190105.29 6682217.04 8517920.39 1112769.13 2994970.15
2-Methylthiazolidine
180856792.29 133464099.81 199261690.14 201386737.22 211998.56 112754055.02
2-Monocaprin
746821.46 682317.90 1495032.59 739545.76 142236.91 263942.88
2^-O-Methyladenosine
1166366.06 1251076.22 1024591.04 7289566.17 37369.35 1189844.60
2-Oxindole
78868170.97 65346704.46 110997098.70 220629841.46 284383.90 73861962.32
2-oxo-10-methylthiodecanoic acid
8139217.66 6239191.63 8511123.22 18619341.33 81039.82 3881139.38
2-Oxo-5-pentyltetrahydro-3-furancarboxylic acid
37413332.08 29439981.89 42544086.04 81591863.86 2344656.07 26582027.58
2-Oxo-6-pentyltetrahydro-2H-pyran-3-carboxylic acid
7193073.37 6395081.36 9519520.42 29879982.35 1005945.29 3581084.60
2-oxo-8-methylthiooctanoic acid
5520511.55 4427991.77 6202508.25 13822412.11 31702.63 2706109.49
2-oxo-9-methylthiononanoic acid
377129.66 288405.74 544958.81 3112605.35 42683.42 407061.16
2-Phenylethyl D-glucopyranoside
5382219.07 5455196.24 4672638.06 16981100.59 1090558.95 3313293.74
2-Propionyl-1,4,5,6-tetrahydropyridine
1790621.41 1268807.34 1596852.07 1567858.74 50652.24 718229.33
2-Propyl-2,4-pentadienoic acid
47983057.93 31083948.00 43439829.22 38636934.02 19917027.87 27925833.21
2-Propylfuran
1412526.62 800837.55 1421658.67 3071611.74 660487.95 883084.52
2-Pyrrolidone
7675411.75 8730076.28 10145363.11 13970730.94 964388.57 5189051.20
2-Quinolinecarboxylic acid
43358357.78 38926398.76 38712042.19 66840556.72 114203.55 20981077.46
(2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoic...
13464918.80 5403417.23 13685799.05 14896334.16 1643880.16 5426253.79
(2R,3R)-3,5-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-3,4-dihy...
977438.51 4019275.18 744390.47 1149305.30 51383.93 565172.61
(2R,3R,4S,5S,6R)-2-[(3Z)-hex-3-en-1-yloxy]-6-(hydroxymethyl)...
30120312.55 23852725.22 29494015.83 31585313.95 1201765.57 13453105.65
(2R,3S)-3-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carbo...
15526466.67 9869866.83 16473138.92 60910080.48 1609552.44 7770552.09
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(2-phenylethoxy)oxane-3...
4901789.09 5276411.69 5224560.67 5206567.81 594166.63 1361828.94
(2R)-4-[(E)-2-{[(1S)-1-Carboxy-4-hydroxybutyl]amino}vinyl]-2...
5865224.57 3561592.35 6406378.80 10263510.20 41869.05 3264561.19
(2R,5R)-2-Benzyl-5-(hydroxymethyl)-2,5-dihydro-2,3,5,6-pyraz...
17658516.58 12470344.33 21961506.74 15957550.66 118540.08 9823176.96
(2R,6S)-2,6-Diamino-3-hydroxyheptanedioic acid
7882002.43 7819705.68 10976773.32 11138125.27 221079.50 2984002.76
(2S)-2-Acetamido-4-aminobutanoic acid
19880502.23 16010290.76 21165346.58 75969969.72 312788.94 14693891.05
(2S)-2-Amino-4-hexynoic acid
34210148.26 37528850.07 35587583.69 121721397.96 1408777.57 20734224.93
(2S)-2-Amino-8-hydroxyoctanoic acid
125446941.26 123770799.16 128675350.62 368819819.00 232635.15 105838624.04
(2S)-2-Amino-8-oxodecanoic acid
383168.85 339008.60 431975.91 4851287.86 109011.25 284079.98
(2S)-2-Piperidinecarboxamide
81100717.27 74547063.95 116394272.79 85499701.28 45013186.92 102093728.25
(2S)-3-Methyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymet...
16886186.40 14784514.76 16520145.51 47570604.84 168044.82 10559003.07
(2S)-3-Phenyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymet...
1252699.24 731101.89 529767.10 12513782.46 34848.39 2880895.61
(2S,3S)-2,3-dihydro-3-hydroxyanthranilic acid zwitterion
16434964.99 18602804.74 15946154.62 32416892.83 625476.73 15015151.03
(2S,3Z,5S)-3-(2-Aminoethylidene)-7-oxo-4-oxa-1-azabicyclo[3....
104047.52 214105.29 102531.92 2582218.71 39607.26 1254342.20
(2S)-4-Acetamido-2-aminobutanoic acid
16365028.05 25008348.95 15951682.42 70371634.53 517080.53 18398570.52
(2S)-4-Methyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymet...
7058319.77 9707082.12 7186988.76 19918156.01 147268.08 4200277.21
(2S)-6-Amino-2-[(E)-(hydroxymethylene)amino]hexanimidic acid
4565428.23 3887388.93 4940169.65 3419581.42 1505241.18 5131031.61
(2S,8R)-2-Amino-8-hydroxydecanoic acid
16835242.03 16561050.06 19041931.10 35817164.89 123114.23 12646560.96
2-sec-Butyl-3-methoxypyrazine
26464663.72 22736306.46 25849212.17 61886040.85 174739.54 11934341.97
(2Z,12Z)-2,12-Tetradecadiene-4,6,8,10-tetrayne
39613031.52 38185371.33 38020888.86 30166424.41 66960.54 23582754.89
(2Z)-2-(3-Hydroxybenzylidene)heptanal
3195938.30 263104.28 2924493.24 311459.44 205233.33 433177.87
(2Z)-2-Ethyl-2-heptenal
74912185.76 81313544.15 30720960.64 114697846.29 3319642.04 3157417.66
(2Z)-2-Nonenoic acid
44367091.02 45397709.20 40658496.37 75966877.50 1207324.66 24460425.34
(2Z)-3-(1,3-Benzodioxol-5-yl)acrylaldehyde
6515571755.00 5957791254.47 7058584838.60 22976193460.90 1825497.90 7380552921.40
(2Z)-3,7-Dimethyl-2,6-octadien-1-yl 3-oxobutanoate
435205.75 1024802.18 330974.45 327505.15 268988.39 462214.78
(2Z)-3-Phenyl-2-propen-1-yl propionate
7678594.24 3529243.16 9151477.82 3641798.83 4677104.76 6283323.32
(2Z,4E)-2,4-Hexadienedial
2780889.01 1850808.02 943872.40 1617249.79 484519.09 554892.41
(2Z,4E)-2,4-Octadien-1-ol
5101732.25 3435811.25 6095363.62 4775892.77 4402666.91 21417137.03
(2Z,4Z,6Z)-2,4,6-Nonatrienal
20685996.47 15181258.58 19574277.45 54855229.69 882272.38 6403373.56
3-(1,2-Dihydroxyethyl)-3,5,12-trihydroxy-10-methoxy-6,11-dio...
857915.31 2494485.15 4246721.06 3248442.38 55920.35 801478.39
3,14-dihydro-15-keto-tetranor Prostaglandin E2
1200992.42 958146.61 1227916.27 3498022.92 145867.87 684877.94
3-(1-hydroxyethyl)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyraz...
14482231.76 13932486.58 15807846.96 51476778.34 351947.54 12572186.53
3-[(1S)-2-Cyclohexen-1-yl]-L-alanine
4142182.41 2149197.05 4955700.99 1360086.07 88459.81 1268440.12
3-[(1S,4R)-4-Hydroxy-2-cyclohexen-1-yl]-L-alanine
72327110.84 64095030.79 82129444.66 346883817.33 536649.07 64701345.09
3-[2-(3-Hydroxyphenyl)ethyl]-5-methoxyphenol
2571157.99 2111729.00 3369034.12 10401805.14 36235.82 611422.01
3-(2,4-Dihydroxy-3,5-dimethoxyphenyl)propanoic acid
35832082.09 129502923.32 34637630.83 188599362.57 755152.89 111399147.64
3-(2-Deoxy-beta-D-erythro-pentofuranosyl)-4,6,7,8-tetrahydro...
1205815.01 1506948.09 1006110.66 650462.97 40181.52 838119.56
3-[(2-Isopropyl-5-methylcyclohexyl)oxy]propane-1,2-diol
14863936.53 7875598.47 19561228.91 5943068.58 7830997.29 14262236.55
3-[(2Z)-1-Hydroxy-2-buten-2-yl]pentanedioic acid
18541651.33 16134242.64 18991383.13 42846751.55 303287.93 12284364.95
3-[(2Z)-1-Oxo-2-buten-2-yl]pentanedioic acid
214647.08 336897.28 231813.91 1358618.94 79624.06 331848.58
3,3^-(2,2^-Dihydroxy-4,4^-biphenyldiyl)bis(2-aminopropanoic ...
455212.26 851531.15 604426.21 4471483.84 21898.21 919533.44
{3-[(3,3-Dimethyl-2-oxiranyl)methyl]-4,6-dihydroxy-2-methoxy...
1311330.57 1194878.34 2041083.82 17986724.28 311584.59 2034058.48
3-[(3aS,8R,8aR)-8-hydroxy-6,8-dimethyl-3-methylidene-2-oxo-2...
535303.46 835980.00 1780479.28 3301943.13 165884.21 674789.71
3-[(3-Methylbutyl)nitrosoamino]-2-butanone
964258.75 1462508.97 1375283.60 3617167.60 32485.55 1723696.49
3-(3-methylthio)propylmalic acid
8223273.25 4596594.99 7133015.08 4512536.46 214068.89 3705290.86
3-(3-Oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl)propanoic aci...
3144264.57 2919087.11 3152850.60 15120566.56 47360.57 2637605.40
3-(3-Oxopropyl)phenyl hydrogen sulfate
3549232.08 3009978.60 4871865.67 10862302.23 74923.43 3373752.23
3,4,5-Trimethoxyphenyl acetate
6342988.32 3054173.46 6404412.84 6009665.15 166880.05 2562580.89
3,4,5-Trimethoxyphenyl ß-D-glucopyranoside
2035351.24 2722182.07 1393393.52 2552873.26 39226.33 1076907.92
3,4-Didehydroretinoic acid
2586327.81 2471704.63 2228945.42 553875.70 112639.87 1460134.49
3,4-dihydro-7-methoxy-2-methylene-3-oxo-2H-1,4-benzoxazine-5...
19878842.41 20058671.69 18823816.64 29335167.99 32946.00 13526599.94
3,4^-Dihydroxy-5,5^-dimethoxybibenzyl
272545.08 286030.13 299557.80 2662580.88 135966.74 334917.78
3-(4-Hydroxy-3-methoxyphenyl)-2-oxiranecarboxylic acid
1205438.65 1088702.98 1499185.14 4304485.00 69687.08 1300836.78
3-(4-Hydroxyphenyl)-2-oxiranecarboxylic acid
1307837.14 719880.66 1193525.14 1921473.26 79603.62 769196.58
3,4-Methyleneadipic acid
7889953.37 6607339.89 8304355.51 8633955.69 1321764.29 5832716.90
3,4-Methylenedioxyamphetamine
1418312.35 1315717.39 1123686.67 5396941.21 50406.60 1226252.71
3,4-Methylenesebacic acid
42090289.29 47285497.35 34171542.77 51891485.38 1437346.47 14661634.22
3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]propanoic acid
6685515.29 6008540.09 5899036.79 6183196.48 986901.52 3533073.78
3-(5-tert-Butyl-3-hydroxy-1,2-oxazol-4-yl)-L-alanine
6254220.42 3804102.89 8011316.01 3228065.46 3636675.63 4590221.55
3-(6,7-Dimethoxy-1,3-benzodioxol-5-yl)-2-propen-1-ol
35219634.14 22386869.60 33305271.13 64331833.98 138163.96 18272147.49
3-Amino-2-piperidinone
1899699.27 1419360.26 6849764.69 41122171.00 491285.47 3616405.20
3-Amino-4,7-dihydroxy-8-methylcoumarin
56568254.13 55062499.40 54850042.88 105757504.08 56115.77 40264844.19
(3aR,4aS,5R,6S,8S,9aR)-5,6-dihydroxy-4a,8-dimethyl-3-methyli...
982987.60 881925.49 1336612.36 7207432.12 408618.08 840289.52
3-(Benzylsulfinyl)alanine
3592082.92 3853981.02 2801915.11 3906421.54 102438.90 4642714.46
3beta,21-Dihydroxy-4,4,14-trimethyl-5alpha-pregn-8-en-20-one
9068592.91 1054175.94 14861720.87 4270930.93 127688.67 9789659.09
3-Carbamoyl-2-phenylpropionic acid
7168749.97 1662666.81 6606966.61 5059672.53 171177.95 1892448.06
3-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8...
4549089.53 8574754.56 2832162.47 1869280.16 50189.60 1190424.84
(3E)-3-Ethylidenehexahydropyrrolo[1,2-a]pyrazine-1,4-dione
979148.86 819190.05 984426.00 5077672.55 39088.98 731654.40
(3E)-3-propylidenephthalide
2354929.27 3329745.95 3505666.89 14444482.83 28554.13 5076950.72
(3E)-4,8-Dimethyl-1,3,7-nonatriene
1826697.14 1040855.09 2256832.16 794971.23 1313823.35 1754291.07
(3E,5E)-3,5-Octadien-1-ol
12564909.22 11058750.05 12347158.65 6972157.58 3835235.74 19853144.89
3-Ethylphenol
34893368.45 34310617.00 41085823.74 97687213.72 3951917.06 27589113.07
3H-Cyclodeca[b]furan-2-one, 4,9-dihydroxy-6-methyl-3,10-dime...
9747148.36 8924765.98 11558553.55 28480136.92 248342.72 7087257.91
3-Hydroxy-2,4,5-pyridinetrimethanol
47700166.28 41178771.67 48922651.01 101926734.10 945810.79 72881733.66
3-Hydroxy-3-methyl-2,3-dihydro[1,3]thiazolo[3,2-a]indole-9-c...
88751357.73 87558882.36 95473654.67 275295264.85 54984.03 72878493.31
3-Hydroxyanthranilic acid
52086145.45 14537941.07 46941724.65 7759354.03 260710.41 16912454.46
3-hydroxy-L-glutamic acid
23894746.37 22162115.11 22460393.96 33977016.58 1407482.75 12164533.72
[3-(Hydroxymethyl)-3-methyl-2-oxobicyclo[2.2.1]hept-1-yl]met...
5167794.38 4268599.38 7077623.30 17591831.34 394224.76 3755864.29
3-Hydroxynonanoic acid
5059695.06 5091078.35 1602136.65 560577.97 120201.10 1394476.63
3-Hydroxyphenylacetic acid
4890414.09 5327248.71 4645379.67 23687359.77 669743.16 5454437.99
3-Hydroxytridecanoic acid
8570162.90 4830965.90 8153543.32 2740312.28 3186570.55 7485212.09
3-Imino-1,2,4-oxadiazepane-5-carboxylic acid
11235512.30 8068696.04 13866952.73 20354430.52 7281220.45 11355720.66
3-Indoleacetamide
13905577.46 11430822.24 12806025.76 27925957.91 123008.79 8116577.25
3-Isopropenylpentanedioic acid
63185341.70 50791738.13 73130780.54 119137189.14 1609030.85 46484619.89
3-Methoxy-4-hydroxyhippuric acid
22469398.45 24163080.01 19959856.26 56033848.98 90911.94 12696575.24
3-methoxy-4-hydroxyphenylhydracrylic acid
563737.66 1813703.73 266491.74 226019.04 98932.20 191581.60
3-Methoxytyramine
5595559.42 5990193.83 5995787.29 17155572.30 49147.83 4768906.23
3-Methyl-2,5-piperazinedione
9705569.92 15040909.33 12246246.45 6147719.02 14206868.09 10620264.98
3-Methyl-2-butenyl caffeate
8993482.43 9700740.56 9074870.20 11728587.82 310473.26 3133860.32
3-Methylbutanoic acid
11397620.65 6593909.76 13376278.70 4713127.95 9706357.58 13053630.64
3-Methylcrotonylglycine
5719030.57 6300557.08 6275612.97 26045761.06 352617.25 7338252.67
3-Methylcyclopentene
1329605362.65 1012965908.27 1155117284.44 2005347165.10 494490.11 460198665.76
3-Methylenenorleucine
13702131.32 14949342.42 16722871.58 38325380.00 389297.12 14149553.24
3-Methylhistidine
10418465.99 9285812.92 11362778.37 60177504.41 560598.01 30897985.27
3-Methylthiofentanyl
5105919.40 6558100.04 6130554.11 7694707.15 33308.98 1948616.54
3-Methylxanthine
51445317.45 48953452.55 62779616.48 27813560.29 111679499.42 294415523.42
3-Nonanon-1-ol
174396409.29 127938529.09 155535470.73 433763572.83 628573.52 34851891.61
3-O-methylgallic acid
8404229.44 7388206.63 7154354.73 6663713.92 343135.00 4276538.79
3-oxo-C12-HSL
1118348.59 2108008.06 970091.18 8497608.70 56800.36 1255601.65
3-oxolauric acid
5483575.86 1367561.80 7932339.62 2314156.95 727797.03 1322895.30
3-Oxooctanoic acid
8723364.23 10870728.28 9362249.27 43156852.42 3337414.80 4588055.79
3-Phenoxypyrocatechol
1299858.88 1100839.94 1381809.95 3662327.28 34626.49 867165.49
3-Phenylacrylic acid
1099359.32 1432362.14 1404223.92 652269.09 182156.73 836130.02
3-(propan-2-yl)-octahydropyrrolo[1,2-a]pyrazine-1,4-dione
17883245.61 16907212.65 17910917.55 52679279.26 159436.28 12472167.64
(3R)-3-[(3R,5S)-7-Oxo-4-oxa-1-azabicyclo[3.2.0]hept-3-yl]ser...
28000181.89 10312366.79 30130925.62 148592620.27 300324.16 30450369.77
(3S,6S)-3-(Hydroxymethyl)-6-{4-[(3-methyl-2-buten-1-yl)oxy]b...
1485599.59 8402959.92 1651405.93 24994928.31 158708.02 4473311.14
(3S,9aS)-3-(1H-Imidazol-5-ylmethyl)tetrahydro-2H-pyrido[1,2-...
614350.53 430468.40 776171.47 9599514.24 41825.66 811851.31
(3S,9S,14aR)-3,6-Dimethyl-9-{6-[(2S)-2-oxiranyl]-6-oxohexyl}...
5469572.74 4786579.12 5914097.29 15427912.67 54849.86 3870816.66
3-Tropanol
19065376.63 2187861.32 20179316.05 45922108.53 416886.28 7747369.50
3-Ureidopropionic acid
233432063.28 220606078.91 261398060.58 462271812.02 3955014.81 235256646.56
(3Z,5Z)-6-(3,4-Dihydroxyphenyl)-4-hydroxy-3,5-hexadien-2-one
25304928.85 15089346.11 23953474.84 27536460.79 171044.82 12600985.47
4-(1,2-Dihydroxy-2-propanyl)-1-methyl-1,2-cyclohexanediol
26554934.96 27710829.16 30928101.71 66094844.25 450915.01 20493498.90
4-[2-(2-methylphenyl)-2-oxoethyl]benzamide
241397926.04 258947282.71 250052836.12 1047278834.93 122381.47 242815103.10
4-(2-Aminoethyl)phenyl β-D-glucopyranosiduronic acid
35907503.73 22339810.08 39456364.30 224537792.60 156594.40 72324779.65
4-(2-Hydroxy-2-propanyl)-1-cyclohexene-1-carboxylic acid
6410297.70 2742877.15 7268026.25 6124841.31 333927.53 1462428.86
4-[(3-Aminopropyl)amino]butanal
7460483.20 6545307.70 9850168.12 73805409.89 101178.13 11737516.54
4-(3-Hydroxy-5-methoxyphenyl)-2-butanone
3908899.81 3665661.07 3251270.47 19849522.00 826293.76 2567445.41
4-{[3-(Hydroxymethyl)phenyl]amino}-N-(isopropylcarbamoyl)-3-...
5951839.90 5777127.36 6053383.71 20793607.10 67506.56 3962792.28
4,4^-Thiobis(butan-2-one)
83176590.47 85579492.47 97098545.62 190086676.25 92644.04 61278048.74
4-(5-{5-[(2S)-1-(4-Pyridinylmethyl)-2-pyrrolidinyl]-1,2,4-ox...
10903545.17 8192324.82 16262040.37 20491500.47 2358400.66 9930904.84
4-{[5-(6-Hydroxy-5,5,8a-trimethyl-2-methylenedecahydro-1-nap...
8192075.00 5312125.57 7115145.74 33798171.96 112720.75 10223014.84
4,5-dihydroxy-3,4-bis(hydroxymethyl)-4a,8,8-trimethyl-1,4,4a...
19981604.61 26693577.43 31977380.71 17857618.36 99785.68 10676816.11
4-(5-Hydroxy-2-methyl-2-azabicyclo[2.2.2]oct-5-yl)-3-methylb...
2334957.43 2332944.29 3261334.38 3826304.18 36111.93 443875.37
4,6-Dimethyl-2(1H)-pyrimidinone
13645555.81 11286236.52 14862971.59 44674652.18 1285562.18 9176848.03
4-Acetamidobutanoic acid
194284299.13 208057783.01 207566134.19 427963005.74 3456419.24 141512911.62
4-ACETAMIDOBUTYRIC ACID
49111410.61 42608822.35 47080395.56 104448523.34 2745492.45 49046735.88
4a-Hydroxy-2-methoxy-7,7,8b-trimethyldecahydrocyclopropa[4,5...
2122218.45 2731332.39 1758152.91 1015831.92 173039.36 532006.72
4-Amino-3-hydroxybenzoic acid
486108133.31 445947458.32 541541217.37 1326828787.70 744695.50 369245809.16
4-Amino-4-deoxypentopyranose
46516086.17 36237027.83 60703388.50 78151694.38 1441088.62 37437888.43
4-aminocatechol
24383735.19 22654835.12 26514274.26 63565967.05 208597.00 17640046.82
4-Amino-DL-phenylalanine
4206886.73 4062891.01 4471415.38 18308661.70 58331.35 3584466.50
(4aS,5R,6S,8aS)-5-[(3E)-5-methoxy-3-methyl-5-oxopent-3-en-1-...
612551.29 973126.61 561652.13 778732.36 43279.36 324111.52
4beta-Phorbol
5363540.80 5264112.56 6672045.68 19140263.38 1015817.92 3359408.51
4-Butyloxazole
16510846.38 15187295.95 18370740.94 82527685.19 193314.88 13938724.71
4-Butylresorcinol
3179225.49 4375914.42 4597429.73 13488335.59 969093.11 2588622.10
4-Coumaric acid
47555889.83 46285221.41 48160518.30 41340036.40 72807.91 28204052.21
4-decyl-3-hydroxy-5-oxooxolane-2,3-dicarboxylic acid
545330.81 487890.24 539236.09 1329313.60 88716.09 272539.34
(4E)-1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one
12562392.65 10227706.17 14162127.94 40191187.26 7281220.45 11355720.66
(4E)-2-Amino-3-oxo-4-decenoic acid
8880368.11 7904447.14 10829235.52 59232134.08 59710.53 9073308.74
(4E)-2-Amino-3-oxo-4-undecenoic acid
623383.29 470241.17 2195682.02 78343484.23 111375.10 7162232.59
4-Ethoxy-m-anisaldehyde
41655619.58 39129849.58 45093641.02 96990042.14 303561.08 28326979.48
4-Ethyl-2-hydroxy-3-methyl-2-cyclopenten-1-one
4571052.86 8084973.37 4599308.17 13725869.63 4082645.62 5367908.79
4-Ethyl-6-methoxy-1,2,3-benzenetriol
10874419.69 8399986.03 10634383.22 21269391.98 994099.59 6618144.12
4-Ethylbenzaldehyde
5625585.24 6509963.16 7570426.57 12631506.70 323088.86 4719411.38
4-Ethylguaiacol
3450945.51 3365574.70 1945732.19 2449658.58 716097.81 1013913.12
4-Guanidinobutyric acid
650126807.54 534143734.01 517410183.89 1611385834.60 1114543.05 574910761.90
4-HOBA
2677846.12 2450359.81 2502085.86 6341240.36 33810.26 1581183.54
4-hydroxy-3-(3-methylbut-2-en-1-yl)benzoic acid
2576777.49 4283048.10 1686603.83 687716.40 185853.96 657321.91
4-Hydroxy-3-nitrosobenzamide
3766568.94 3151777.03 5724947.57 22863784.59 62009.36 9699752.68
[4-Hydroxy-3-(sulfooxy)phenyl]acetic acid
16104720.01 16113571.30 17471560.19 5751129.88 414766.51 10582888.40
4-hydroxy-4-(indol-3-ylmethyl)glutamic acid
5761018.19 6778338.18 6369055.44 12553970.20 39731.22 2384227.37
4-Hydroxy-4-(methylnitrosoamino)-1-(3-pyridinyl)-1-butanone
4742413.68 3840302.29 5166563.55 9641912.83 69495.80 4063935.08
4-Hydroxy-5-methylfuran-3(2H)-one
7917520.04 7904691.49 9127846.79 19335852.00 6244990.80 6509216.50
4-Hydroxy-6-methyl-2-pyrone
153621227.19 149496277.15 145704131.61 249220217.67 3539646.04 113078372.82
4-Hydroxybenzaldehyde
4845943.73 9746947.72 14611151.52 3727256.33 657323.69 4070248.06
4-Hydroxy-N~5~-[hydroxy(imino)methyl]ornithine
1859465.56 1372186.92 1613175.81 2464456.99 54457.06 1767254.86
4-Hydroxynonenal
1786312.45 1391992.75 2552229.29 1075961.90 2137526.71 3534800.36
4-Hydroxyphenyl hydantoin
3901194.06 3632977.71 2617130.95 6475218.84 39712.50 1773223.18
4-Hydroxyphenylpyruvate
2630498.39 2173209.89 2612510.74 3736598.08 94561.72 1605623.64
4-Hydroxyprolylleucine
78102759.81 67574361.47 88169479.90 302539739.98 64979.68 76981689.41
4-Hydroxyprolyllysine
2730672.80 2071472.98 4169436.27 12861496.07 83694.89 4006945.52
4-Hydroxyprolylvaline
215800761.66 221994713.38 213639195.72 766187611.36 445705.04 156641722.48
4-(β-D-Glucopyranosyloxy)-2,5-dimethyl-3(2H)-furanone
5483392.73 8194414.71 6884383.29 34725540.67 202838.26 5659943.10
4-Imidazolemethanol
100381480.25 88288687.80 88608065.37 152347840.67 2309241.97 91476548.67
4-Indolecarbaldehyde
32740612.06 28613101.59 29079653.28 44084353.95 178532.74 22150311.45
4^-Methoxy-3-morpholino-propiophenone
507084.92 723011.38 443501.79 3681671.41 60612.62 525291.51
4-Methoxycinnamaldehyde
45082934.29 26539227.81 37775142.37 40349054.32 316512.70 1530800.83
4-Methyl-12-oxa-4-azapentacyclo[9.6.1.0~1,13~.0~5,17~.0~7,18...
7141363.38 6586047.57 8569801.53 26368194.27 50902.86 5137843.22
4-Methyl-2-[(1Z)-3-methyl-1,3-butadien-1-yl]tetrahydrofuran
1959027.16 1839549.03 2571616.52 3953047.95 1132547.16 2014267.24
4-Methyl-2-propyltetrahydro-2H-pyran-4-yl acetate
1169410.43 415563.20 1203850.88 2108040.86 388168.68 584236.38
4-methyl-5-nitrocatechol
110610301.33 106099887.53 106187161.80 269046386.92 248218.28 72814041.58
4-methyl-5-oxo-2-pentyl-2,5-dihydrofuran-3-carboxylic acid
4420693.58 4230981.77 5037805.07 20611675.82 901507.74 2150870.41
4-Methylcarbostyril
1173102.48 1269021.50 1156662.07 4589173.92 250575.02 750183.61
4-Methylene-2-oxoglutarate
5417972.64 6044421.26 5871265.97 13383597.19 358640.27 16878703.57
4-methylocta-2,4,6-trienedial
2493380.92 1874196.00 2833610.93 3042131.45 272080.58 768264.41
4-Methylumbelliferyl-a-D-glucopyranoside
2084663.50 1238889.22 4135199.75 2898890.41 33342.15 932524.53
4-O-Acetyl-2-deoxy-2-[(Z)-(1-hydroxyethylidene)amino]-alpha-...
70123239.39 71144369.92 66258595.20 182331152.78 115382.32 74350205.03
4-oxo-5-phenylpentanoic acid
2655304.06 2635489.63 1998855.00 4201624.69 180739.77 1229686.15
4-Oxocyclohexanecarboxylic acid
1898284.24 1918996.70 1448073.38 1200068.24 444944.68 747906.96
4-oxododecanedioic acid
11251806.30 10088464.67 8951920.98 13100268.29 686330.64 5820288.01
4-Oxononanal
26506462.62 33971432.62 13637902.06 20765205.43 718206.96 7298030.75
4-phenylbutanic acid-O-sulphate
3771480.46 3214472.44 3591436.24 5161754.48 69108.31 2031957.37
4-Piol
1888938.03 1423713.83 3325678.15 4539148.73 186968.90 1058269.16
4-Pyridoxic acid
643738852.90 605001071.34 693982072.20 1939125124.88 2685218.10 421937045.30
(4R,5R)-2,3,4,5-Tetrahydroxy-5-(hydroxymethyl)-2-cyclohexen-...
153210833.80 149270046.08 128500291.95 145349504.53 346330.77 137907404.68
(4R,5S,9S,10R,12S,13S)-1,5,9-Trimethyl-11,14,15,16-tetraoxat...
11287559.71 20259133.62 10369440.77 29469156.14 5921822.35 8021790.21
(4R,6R)-4-Hydroxy-6-{2-[(1R,2R,3S,6R,8aR)-3-hydroxy-2,6-dime...
1992120.73 2856326.42 1514186.01 505701.17 123981.88 789925.33
[(4R,6R)-6-(6-amino-9H-purin-9-yl)-2,2-dimethyltetrahydrofur...
10650386.60 16314037.11 6867732.96 45596168.76 30125.58 2770133.57
(4S)-4-{[2-O-(beta-L-Arabinofuranosyl)-beta-L-arabinofuranos...
20066101.11 14585112.27 15693990.87 14060944.69 39393.98 8144434.33
(4S)-4-Hydroxy-4-methyltetrahydro-2H-pyran-2-one
30512001.80 29647131.64 33616565.85 33581774.24 2585629.72 25135956.41
(4S,5R,8S,9R,12R,13R)-1,5,9-Trimethyl-11,14,15-trioxatetracy...
5352767.72 1126529.42 8140439.09 1254088.51 1162776.90 5854147.39
4-Sulfanyldihydro-3(2H)-furanone
13228352.24 14462892.75 8592115.91 34548344.76 232418.72 4939203.03
4-Vinylcatechol
7258363.96 7642640.35 7995282.80 13835449.46 623123.86 5509334.87
4-Vinylcyclohexene
70768693.02 51133610.40 71060761.77 166961028.58 654630.38 15896150.54
4-[(Z)-2-Aminovinyl]phenol
1400985.34 1203975.25 1946447.38 1941447.22 820691.10 730544.21
5-{[1-(3-Hydroxypropoxy)-2-methyl-2-propanyl]amino}-3,4-dihy...
6689718.29 5981555.64 6535871.09 473330.76 2470487.98 4661967.49
5-(2,4,5-Trihydroxybenzyl)dihydro-2(3H)-furanone
11717393.51 8092628.34 11572623.98 13449338.59 94776.42 4975465.94
5-(2,5-dihydroxyhexyl)oxolan-2-one
632457.20 663074.43 502566.29 791653.53 79065.71 426817.42
5-(4-carboxy-3-methylbutyl)-5,6,8a-trimethyl-3-oxo-3,4,4a,5,...
1455493.98 2185326.98 1072106.08 526597.74 95526.57 392645.66
5,5^-Dihydroxy-4,4^,8^,8^-tetramethyl-4,5-dihydro-2^H,3H-spi...
12789717.58 16256466.50 6807140.22 26344298.94 831019.61 5969961.17
5,5-Dimethyl-4-(3-oxobutyl)dihydro-2(3H)-furanone
118254813.12 96311129.09 136480334.59 360987915.13 4925320.55 74486494.45
5-(6-hydroxy-6-methyloctyl)-2,5-dihydrofuran-2-one
32362598.43 33528192.27 38251179.40 30649170.45 9007536.18 60347968.30
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2H-1...
270712.93 296836.65 238445.07 2134607.84 50103.83 319558.19
5,8,12-Trihydroxy-2-oxododecanoic acid
43560009.05 53708298.45 37206353.98 39942307.31 990750.22 18962724.48
5-Amino-6-(4-hydroxybutanoyl)-2,2-dimethyl-2,3-dihydro-4H-ch...
19516448.42 24196049.39 19050875.48 109862895.72 135853.35 14573758.62
5-Aminovaleric acid
923358236.51 756279192.00 996162227.26 4055371355.40 4296100.98 1831857443.40
(5-Benzyl-3,6-dioxo-2-piperazinyl)acetic acid
9742192.27 11010662.10 10590933.56 49509879.83 72403.94 9889638.29
5-Benzyldihydro-2(3H)-furanone
4499364.31 3967155.11 3246258.03 9165320.61 158176.40 2100476.46
5-Butyloxazole
9885085.48 1438509.00 9417436.47 1288927.57 2402639.49 3076046.39
(5E)-2-[(Carboxymethyl)amino]-5-octenoic acid
31146416.48 36872979.88 30454135.69 45316642.08 250445.86 19664366.40
5-Ethyl-4-hydroxy-3(2H)-furanone
15433209.28 16871832.76 22128698.60 56945603.82 826786.24 19897416.11
5-Formyl-2-furoic acid
882128.45 885372.85 582971.98 3883761.93 53031.01 758470.96
5-Geranyloxy-8-methoxy-psoralen
4771211.16 2343819.29 4496672.30 2249776.94 597457.46 1951924.43
5-guanidino-2-oxopentanoic acid
200929337.99 203743956.04 202848543.43 413894008.51 340346.90 192352005.00
5-guanidino-3-methyl-2-oxopentanoic acid
150326185.79 112826182.08 205684548.17 476000667.51 129025.46 175512977.92
5-Hexyl-2-oxotetrahydro-3-furancarboxylic acid
14991144.20 19606128.00 13269188.48 7509319.74 1592059.04 4695936.18
5-Hydantoinpropionic acid
267499445.40 389079692.02 340858555.94 74466234.26 939704.92 166535857.56
5-Hydroxy-2-furoic acid
19731559.08 18356842.75 26312893.12 5539564.15 195070.46 25938757.59
5-Hydroxy-3a,4,5,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
20773229.37 21815214.33 20006406.33 51548444.08 407973.05 18780065.56
5-Hydroxy-DL-tryptophan
142416635.04 169218379.75 119332090.32 354245877.82 215650.91 82626082.01
5-Hydroxyindole-3-acetic acid
2920115.88 4188758.26 2832562.92 8882641.30 53763.97 3302979.92
5-hydroxyindole acetaldehyde
1152632.88 1527287.30 2126845.75 3677714.14 104618.52 7582497.44
5-Hydroxypyrazinecarboxamide
508044687.81 499175239.98 497491092.86 1313008340.40 244894.71 347254642.24
5-Hydroxytryptophol
11547669.89 9671472.92 15104178.77 33490316.75 84564.13 8602410.98
5-Isopropyl-2-methyl-2-cyclohexen-1-one
12445643.02 13532001.18 13253346.86 18572142.65 392021.89 6820418.37
5-Methylcytidine
145181404.47 153310588.54 154681147.57 681393422.59 226384.27 120176545.06
5-Methylcytosine
605804990.84 636361559.23 679892056.79 3124815332.30 1750662.38 585012751.16
5-methyldeoxycytidine
709868221.23 750483130.63 734018194.95 3306775947.70 401803.31 526971677.90
5-methylthio-2-oxopentanoic acid
1739803.04 1634342.92 1865009.04 4021467.24 31834.87 1404861.36
5-methylthioribose
58575893.55 57699176.12 63363702.78 184167774.46 4515411.52 56199092.78
5-Nitrilonorvaline
642033043.34 496975445.38 512540526.61 1601203813.40 1154806.57 573133490.18
5-(N,N-Dimethylcarbamimidamido)-2-oxopentanoic acid
447377135.80 414896470.71 514187526.22 2097631962.41 529858.04 403305807.40
5-Pentyl-1,4-dioxan-2-one
8989323.55 8246126.03 8748538.74 27268590.07 1124526.44 5115998.22
5-Pentyl-2(5H)-furanone
9393189.97 11701696.37 11201936.34 30704067.66 2539579.39 10721291.37
5-Pentylresorcinol
5289386.25 2869963.77 6096086.01 17504259.71 258651.48 3491567.66
5-Phenylvaleric acid
7812627.63 9817706.35 6291329.14 5421335.65 473065.57 2359990.39
(5R,6R)-2,6-Dihydroxy-5-(hydroxymethyl)-2-cyclohexen-1-one
41038236.83 32409715.26 40875254.52 75647886.91 1117351.59 26465459.50
(5S)-3,5-Dihydroxy-5-(hydroxymethyl)-2-methoxy-2-cyclohexen-...
51140010.23 39593249.93 53395390.14 90851412.62 161770.34 32728330.39
(5S)-5-Benzyl-2,4-imidazolidinedione
1955515.46 1619137.86 2153268.01 8743521.26 35722.42 1297542.98
6-[(1E)-3-Hydroxy-1-buten-1-yl]-1,5,5-trimethyl-7-oxabicyclo...
2890192.09 2704804.81 2723639.18 7937315.10 154159.75 1499544.26
6-(1-Hydroxyethyl)-3-(hydroxymethyl)-2,7-dioxabicyclo[4.1.0]...
8313913.61 8731196.27 12550931.70 46430146.55 90890.11 10936852.91
6-[(1R,2S)-1,2-Dihydroxypropyl]-3,4-dihydro-2,4-pteridinedio...
177108097.93 121635333.36 172512182.14 383156128.37 51548.96 104877801.58
6-[(2E,6E)-7-(5-hydroxy-3-methyl-2-oxocyclopent-3-en-1-yl)-6...
1277460.54 828969.76 2148027.39 3221374.97 32344.34 1097923.44
6-[2-Formyl-5-(hydroxymethyl)-1H-pyrrol-1-yl]norleucine
10291835.92 10897856.48 9099969.50 31444111.55 47756.51 7861078.83
6-(3Z)-3-Hexen-1-yltetrahydro-2H-Pyran-2-one
6673950.37 5107977.62 4076780.04 11588410.98 1018483.65 3777407.91
6-(5-Methyl-4-hexen-2-yl)-9H-purine
3872335.43 4074845.10 3091236.04 7525768.72 100726.22 1892145.44
6-[(6-Aminohexanoyl)amino]hexanoic acid
57953901.52 38064295.97 63445987.26 141384894.81 28639.58 24701475.04
6,7,9-Trihydroxy-3,6,9-trimethyl-3a,4,5,6,7,8,9,9b-octahydro...
4256355.59 5500621.08 3208072.14 3274150.78 550374.07 1382577.89
6,7-Dihydro-3H-purine-2,6-diamine
58356394.54 24857596.88 24523149.56 65928928.37 51318395.20 158265156.64
6,7-Epoxy-4,5-dihydroxy-2-octenoic Acid d-Lactone Acetate
2243437.06 1447474.31 2254266.56 2656770.82 92978.99 939611.98
6,9a-Dihydroxy-4-methoxy-3,4a,5-trimethyl-4a,5,6,7,8,8a,9,9a...
1770872.09 2236364.61 1471185.34 4587855.89 257038.81 416914.57
6-Acetamido-2-oxohexanoic acid
13636317.69 13139624.44 15505499.87 48652036.45 511212.91 12568118.58
6-APA
12876366.15 11832527.70 13815521.62 26927530.37 154416.38 7707221.43
6-Deoxy-3-O-methyl-beta-D-galactopyranose
58357616.30 55042693.66 65141445.60 150471458.25 1815649.30 40148225.52
(6E)-3,7-Dimethyl-6-octene-1,2,3,8-tetrol
22666895.14 16034460.16 24029080.08 43667606.23 682473.08 13258920.46
(6E)-4,5,8-Trihydroxy-10-(2-hydroxypentyl)-3,3-dimethyl-3,4,...
9361597.69 10369454.88 6500902.03 18341776.74 69634.03 4138822.63
6-Ethyl-5-{3-[2-(trifluoromethyl)phenoxy]propoxy}-2,4(1H,3H)...
8390054.02 7718048.12 7644442.57 26141177.14 115277.21 7764654.86
6-Hydroxy-5-methyl-4,11-dioxoundecanoic acid
2454175.33 4678591.78 2362563.11 3495495.55 172827.49 932095.52
6-hydroxypseudooxynicotine
654206.19 771571.38 860014.78 4024414.56 51728.43 967298.08
6-imino-5-oxocyclohexa-1,3-dienecarboxylic acid
9763081.56 8706736.87 11080311.55 25685174.15 109588.81 5898973.63
6-Methyl[1,2,4]triazolo[4,3-b]pyridazin-8-ol
629065249.54 641777116.30 660663710.62 2521370264.90 856837.89 493579452.14
6-Methylquinoline
3558530842.20 3383747605.50 4397195410.50 6916469108.70 5388742.24 8954754613.60
6-Oxo-pipecolinic acid
61633751.78 44624348.23 55845813.91 100036827.90 960915.02 33682745.15
6-Pentyl-2H-pyran-2-one
41306064.73 28606065.80 47786056.90 31115577.07 9350046.77 35155345.94
(6R)-5-Acetamido-4-O-acetyl-3,5-dideoxy-6-[(1R)-1,2,3-trihyd...
49504602.77 53650421.45 54081424.70 112551070.01 451411.59 58144032.27
(6R,7S)-6,7-Dihydroxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl (...
1011758.09 1476952.45 1293506.74 4927438.91 45191.17 789031.06
(6R,8Z)-6-Hydroxy-3-oxo-8-tetradecenoic acid
664114.68 550487.91 657012.90 2102556.53 249939.04 453577.59
(6Z,10Z)-4,8-Dihydroxy-6,10-dimethyl-3-methylene-3a,8,9,11a-...
333691.07 476611.33 333498.19 2195922.23 229203.41 361627.13
(6Z)-6-Tetradecene-1,3-diyne-5,8-diol
3882329.10 4444961.83 3442676.98 10159041.37 205185.90 2011365.10
7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-o...
74236506.11 149235018.11 59642882.08 22579429.53 348393.85 43427362.71
7,8-dihydroxykynurenic acid
3254757.60 3165155.26 4093098.84 4279014.35 45910.77 3503105.39
7a-Hydroxy-3,6-dimethyl-5,6,7,7a-tetrahydro-1-benzofuran-2(4...
8177223.69 14187256.40 7173853.35 23587419.15 2692032.49 5002010.13
(7E,13Z)-3-Benzyl-6,12,15-trihydroxy-4,5,10,12-tetramethyl-2...
160779.32 104609.95 111848.38 158703.98 81851.83 4902499.45
7-hydroxy-1,4a-dimethyl-9-oxo-7-(propan-2-yl)-1,2,3,4,4a,4b,...
13530061.09 18042115.55 7946623.24 2587809.19 206493.53 4525159.03
7α-Hydroxy-3-oxo-4-cholen-24-oic acid
8392599.52 6808234.91 5948196.20 18989339.62 56604.02 6479097.84
7-ketodeoxycholic acid
9484155.63 7615926.18 7080509.18 5760817.57 125656.08 4597135.46
7-Methylguanine
2230295993.70 2150897166.20 2310012514.00 9049372285.90 1971564.59 1581546122.20
7-Octene-3,5-diyn-1-ol
8027340.57 4497572.43 6132128.35 69188161.02 260055.26 8580721.67
8-(3-Heptyl-2-oxiranyl)-1-hydroxy-4,6-octadiyn-3-one
36857734.95 57099830.27 16443019.32 6509256.92 161866.39 10862510.43
(±)8(9)-EET
7593106.14 5662145.39 7811484.99 34745304.87 45683.76 5366894.05
8-Amino-7-oxononanoic acid
2325815.64 2818278.26 5997591.36 30346843.46 410963.68 2782189.92
(8aR,12S,12aR)-12-Hydroxy-4-methyl-4,5,6,7,8,8a,12,12a-octah...
14577281.31 8411566.97 9926233.72 26499074.14 783045.09 6440791.18
8-Azabicyclo[3.2.1]octane-1,2,3,4-tetrol
6181411.75 2258023.59 5951451.27 11082553.89 703068.47 1885443.01
8-Azabicyclo[3.2.1]octane-1,2,4,7-tetrol
1746743.86 1640532.70 1630706.90 5939507.13 131620.46 774001.86
(8E,10E,12S)-8,10-Heptadecadiene-4,6-diyne-1,12-diol
599702.61 1354781.05 496073.50 1521756.84 56397.76 289876.23
(8E)-10-Hydroxy-8-decenoic acid
34740887.82 38084623.39 39662419.19 95109838.13 645182.97 29486080.42
(+/-)8-HEPE
1923876.82 3185623.78 1302577.05 344715.39 74661.17 841217.01
8-Hydroxy-5,5,9,14-tetramethyl-7,15-dioxapentacyclo[11.3.1.0...
1942141.09 2542263.53 1448837.06 523064.43 63293.87 515580.58
8-Hydroxy-5,6-octadienoic acid
5503468.44 3996706.04 9085850.41 8877341.44 987108.27 11451312.21
8-Hydroxy-5,8a-dimethyl-3-methylene-3a,4,4a,7,8,8a,9,9a-octa...
1818086.83 1808446.02 1834915.60 6321195.70 131971.95 1356350.42
8-Methyl-8-azabicyclo[3.2.1]oct-3-yl acetate
7249308.40 6276856.96 8130349.54 42883339.58 719806.12 7412638.71
(8S,9Z)-9-Heptadecene-4,6-diyne-1,8-diol
1342942.94 2370779.78 1521181.63 7839475.34 42724.54 1529498.34
9,16-dihydroxy-6-(hydroxymethyl)-2,6,11-trimethyl-15-oxatetr...
12932536.57 13331697.54 11588445.27 18059995.60 321881.58 5825792.43
9-(alpha-D-glucosyl)dihydrozeatin
27700742.79 29178753.94 29841051.63 118393013.95 109177.11 16555240.88
9-Anthroic acid
941635047.63 921883745.78 916985298.88 716622964.94 237331.14 573756824.86
(9E)-9-Undecenal
7635431.34 2799495.13 9019225.83 3259020.37 1030631.61 2018466.92
9-fluoro-17?-oxa-dextro-homoandrosta-1,4-diene-3,11,17-trion...
2207430.37 1755486.77 3758144.36 6533871.01 94759.08 2003806.04
9-Hydroxy-10-undecenoic acid
1483593.35 1060048.43 393799.07 348500.01 157792.00 165484.96
9-hydroxy-2,10,10-trimethyltricyclo[6.3.0.0Âa,⁵]undec-...
424362.43 433432.30 446674.86 2986617.14 212142.03 722785.45
9-hydroxy-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-1,2,3,4,4a,...
213544.62 552691.53 205395.82 1436884.14 52053.91 122014.02
9-Oxo-10(E),12(E)-octadecadienoic acid
2103425.61 695127.80 2389332.13 8915032.64 298786.08 4334858.87
9-Oxononanoic acid
313174122.81 222263935.12 303374576.88 783194987.09 3152626.52 63571970.54
AAMU
11032187.77 71332406.95 16890665.68 118278807.07 78743.48 3603826.89
a-Aspartylphenylalanine
14830081.37 14722984.37 15090286.03 57684345.57 31518.50 12022815.50
Abacavir
2690719.57 3693580.94 1073870.47 1319290.84 31963.93 542917.19
(Ac)2-L-Lys-D-Ala
15686364.93 12720167.82 15763788.34 33758138.35 109298.00 8895660.97
AC4620000
14311406.33 2531829.82 3966194.51 1707894.67 226584.15 1592616.44
Acadesine
27226451.73 14216046.33 21722600.95 33709550.56 76168.94 10298042.04
Aceclidine
4168723.69 907560.03 4493833.54 952692.38 1077064.10 2191320.38
Aceglutamide
785918041.78 703650073.79 842466570.57 841098315.13 1475509.81 649290833.86
aceprometazine
2020566.17 1445434.10 2679935.13 8391017.77 37867.96 1533981.37
Acetanilide
62342890.81 54729036.43 76004116.08 108069374.05 602425.92 75781120.18
Acetanisole
1379295.27 1230507.76 1375296.41 4381879.10 422862.87 644984.79
acetophenazine
1569542.00 1298063.54 1640426.52 5028447.64 32568.33 1125377.32
Acetylarginine
858094561.61 847990601.77 986707942.69 2091231210.61 413950.55 856881833.62
Acetylhistamine
196957203.31 15917796.03 8983188.61 88308482.93 12388837.82 14232730.91
Acetyl-L-methionine
288778188.61 177345482.82 272541318.39 536030344.84 200800.56 137718268.60
acetylserine
276815307.82 274862603.40 254500463.47 150982656.68 1246799.76 328805502.74
Adenine
3328940.55 5703000.89 4453892.86 142132612.29 441702.00 70743846.12
Adenosine
158942001.68 184469052.61 173287207.83 2774437472.20 889438.80 1469742345.40
Adenosine 3^5^-cyclic monophosphate
194619405.74 187920756.28 192186952.77 507123169.62 121168.15 152740659.30
Adenosine 5^-monophosphate
6600098.69 7779196.23 7582459.00 9064160.45 665810.36 707573971.92
Adipic acid
30327096.50 32509811.69 44677110.48 54153332.95 512122.86 20041657.63
adrenaline
6112981.21 5426802.83 5351963.12 17639877.66 88237.80 4204685.24
AE1300200
253705.16 307666.04 462726.31 3950624.36 24985.58 270623.96
afegostat
3667668.23 4392173.92 5345507.77 7302535.69 218536.71 2944607.99
AL9450000
483368059.38 572328135.73 406568350.36 572435409.89 250373802.40 742257769.46
a-Lactose
1115501401.85 966374460.22 1074512616.75 1295898230.54 8240335.82 1389925000.20
ala-ile
80793216.01 101159308.97 65421052.87 118621598.34 81043.67 40309020.63
Alanylclavam
56007004.87 45521327.39 59491263.87 135114364.21 170915.34 72476043.06
ALA-PRO
16270926.34 15489717.33 21660241.19 33601978.03 126429.94 14686026.62
Ala-Thr
20002227.44 12758813.84 17478298.98 31234036.59 131879.86 18670283.29
albutoin
263411624.89 288529442.30 300619295.33 773329882.71 196816.81 274652199.92
Alizapride
5970023.88 10124676.06 5486500.43 31719051.38 35671.03 7937179.01
Allantoin
168781363.78 181804045.09 206686121.22 134768808.71 446981.49 195715212.54
allixin
5134335.85 6547345.44 3943453.70 4180599.52 753593.43 1845186.37
Allyl (2Z)-3-phenylacrylate
8030419.12 7809549.45 5153082.17 11444709.07 75037.57 3336422.34
.alpha.-Apocholic acid
382144.55 158530.84 422532.81 2259532.27 78848.17 397575.56
(-)-(alpha)-Kainic Acid
1740590.43 1140622.40 2001812.50 10770025.29 59666.95 1272244.45
alpha-Ketoglutaric acid
22594582.45 21490371.70 26358201.03 3357231.73 166927.75 30339666.65
.ALPHA.-TOCOPHERONIC ACID
1798575.61 2933045.59 2342714.44 2310590.29 409976.97 393193.22
Alvameline
19381821.74 16310228.07 16357926.51 27194737.95 43990.99 7913366.95
Aminohippuric acid
879555770.39 761305116.65 837041514.22 1960072587.40 279127.09 601354985.90
Aminolevulinic acid
50999190.15 39237620.78 63018763.78 38882426.95 2693482.92 40163312.99
Amipylo
2499151.22 2179108.40 3322319.88 5961619.33 69336.98 1620036.85
Amoxicillin
105094268.70 106470002.75 96219262.23 290142580.74 30319.00 66948650.99
amtolmetin guacil
21437290.38 18870889.52 20158735.76 99137995.46 245608.79 12089268.68
ANAGESTONE ACETATE
6933936.61 4497765.26 5968020.87 28951589.37 114840.88 8786879.80
Anhalamine
4562486.80 3928902.25 4221943.34 15265123.87 378649.74 2863223.85
Anibine
6110324.80 7513823.41 2666697.19 7718223.56 203770.39 2969503.39
Anisindione
166119.91 392220.92 876648.40 1410550.79 40336.95 200207.30
ANISURIC ACID
31426575.30 30921852.68 33347336.83 94034570.44 40040.41 26119950.39
Anofinic acid
14709372.58 13409865.29 12564033.51 23311887.53 116520.27 7642301.01
Anthranilic acid
49432315.30 46096101.38 59817752.86 125731699.14 424992.05 39857823.13
Antiarol
1332424.77 1941762.15 969814.09 1978320.20 756944.55 597838.60
anticapsin
85270112.66 75108387.62 91328667.59 197257768.33 237807.17 57915189.57
Apocynin
6543081.00 6320180.87 6183171.77 18486602.85 635561.42 4031511.90
Aprobarbital
21875472.48 18982286.49 24014180.34 97438967.21 36606.08 18449557.55
ARECOLINE
5457568.72 5098827.12 5327814.34 18014655.33 80268.37 3582685.63
Arg-pro
12729413.10 10963365.85 11234957.32 13616755.80 89944.20 5964801.94
arg-ser
4992236.60 4085248.36 4819393.65 10603543.17 69306.72 2939910.92
aromadendrin
4008846.61 14464384.72 1821829.82 609788.92 33352.16 1856436.92
Artemether
953497.38 888521.80 1189828.63 4205543.07 130933.01 922005.91
(+/-)-Asarinol B
5246958.98 11242267.45 4653111.43 21482269.43 1082157.93 2810182.77
Asarone
11841898.63 15633469.49 8485308.46 5186786.50 617172.85 2870104.74
ascopyrone M
178418331.98 172430801.54 168242330.01 300998004.46 8199807.59 128729154.16
asn-arg
2546378.26 2582685.96 2126510.35 6990178.09 39654.19 1002955.31
asn-val
2568511.47 2865135.82 2785522.91 10892948.56 31754.95 759565.00
aspergillic acid
953750.93 646731.13 249163.71 701197.62 35964.05 187336.57
asp-leu
47286834.16 36519353.60 50034405.07 146764785.55 527318.13 38310750.83
Atagabalin
41762374.21 36067783.36 14860007.67 57658128.48 240675.64 17077858.93
atractylenolide I
831444.17 536979.68 861791.95 4329565.08 42201.20 603686.45
Atropaldehyde
2644894.73 3761401.26 3606406.63 15516701.08 87028.62 5264841.24
(+)-Australine
183261309.68 166720545.97 190749672.06 439226806.65 1041638.58 144929402.60
Azelaic acid
1397301.64 756165.54 821752.56 2184315.76 213552.72 405296.07
Bacitracin A
249548.76 206214.46 251688.73 13824939.06 49446.03 237236.50
b-Angelica lactone
1969358.17 3225428.18 1772922.38 35549282.64 1215733.75 19130107.98
Benzaldehyde
2522834.87 6814796.58 10780670.93 1467261.43 67376.54 1991031.56
Benzenepentol
9346820.69 8904083.20 9817736.11 18717334.79 279559.24 6125970.95
Benzocaine
21474111.81 26191909.83 28812227.54 7616622.05 183374.03 14705408.29
Benzoxazolone
56940091.57 44934846.84 23974176.11 29169406.49 162326.99 24695499.72
Benzoyl-y-tropeine
2961795.48 2820080.86 5318914.61 3321716.91 99420.94 636864.36
Benzyl benzoate
423048.00 938968.63 3595560.75 354269.73 42591.88 377989.21
Benzylformamide
3694890.71 2609161.01 5625690.12 2145606.63 991486.75 1124252.64
Benzylpenicillin
564979.79 734056.59 910468.21 8646608.56 224223.15 1229046.93
Bergenin
8641467.53 6375078.51 10273385.64 29293154.49 160540.92 9118136.44
beta-Pyracin
22373517.55 19457035.87 23875716.76 64918223.30 1003292.63 15193903.73
Bethanidine
25029374.30 13762225.83 47152735.11 89095617.49 304418.79 9393577.51
Biacetyl
23236108.18 33285422.35 27194624.39 43558685.04 1227348.64 20698325.13
Bicyclomycin
12229490.45 12842498.79 12927608.16 1677220.96 70241.45 14619755.85
Biopterin
114869505.02 127954257.46 124641121.76 511907012.73 246644.70 89418887.29
Biotin l-Sulfoxide
1878309.08 1381096.16 4251308.35 90620317.35 131413.45 11987837.33
Bis(4-ethylbenzylidene)sorbitol
33529138.02 32020261.47 44838874.72 45560976.86 22027582.21 47949489.40
BIS-FERULAMIDOBUTANE
1261626.23 852882.89 1150031.13 7185698.37 33480.16 952999.73
Bis(methylbenzylidene)sorbitol
558784967.64 306827049.66 529707345.15 304179212.09 91252781.55 256661121.08
Boc-Asn-ONp
9142230.76 8799907.00 10740231.93 165902757.92 76398.30 10768711.36
Boschnialactone
13119752.60 11201653.99 15252515.28 21711768.57 2754117.03 10472682.32
Brassylic acid
3795298.94 3086169.29 4216633.09 5477221.22 804858.25 3082074.09
Broussonin C
20170512.43 26466449.65 17285530.90 5409282.37 63395.31 6398873.14
Bucillamine
23098972.86 21809711.39 23621323.63 84426220.02 63107.52 14366099.99
Bufexamac
3145248.50 2402450.22 3782849.60 17804539.69 48016.78 3039723.39
Buflomedil
727267.20 907228.78 847297.59 6808340.39 78321.76 1072520.69
Bufotalin
712790.51 395418.65 411750.48 2790345.90 162224.41 455371.82
Bumadizone
1802470.22 1670064.40 2029100.66 7082858.05 53735.03 1268938.27
butalbital
298364.28 227175.30 364660.15 2615500.21 60571.37 385199.66
butoctamide
53303897.78 1925391.12 51541947.70 888965.72 777227.62 11931314.45
(+/-)-C75
2286473.71 2352216.56 2519840.05 11568040.76 427189.98 1532167.14
C8-HSL
880980.35 733981.77 846495.63 2572034.06 49964.57 566283.25
Caprolactam
122668048.67 106531368.77 142089504.37 96391789.77 29979197.21 143074734.28
Capryloylglycine
17160377.46 15740374.16 14150556.33 18104094.88 73974.92 4145773.76
Captopril
10814444.94 9773003.24 11335193.52 34596129.26 72218.11 7486692.63
capuride
410933.88 348380.61 630186.30 3659722.39 38172.04 479560.21
Carbendazim
5189791.72 3155822.13 3869488.78 7222040.04 107447.60 1757132.19
Carbofuran
1257043.14 935697.70 1412541.71 4669884.02 29899.62 989013.00
carisoprodol
951337.11 1065097.30 640020.98 2127296.99 63732.41 156310.70
(-)-carnegine
3588773.34 1427726.52 2206067.43 2127787.99 89766.60 902872.14
cartazolate
2426266.58 2179662.00 2314310.84 7493014.70 60001.71 1410195.62
casimiroedine
2774938.29 2563422.96 2958953.99 6672614.55 38417.41 2611650.86
Catechin
4905064.27 4517052.87 1397722.09 14959566.28 208233.20 781282.09
Catramilast
1754271.33 3429152.51 2306631.36 727339.47 70502.89 457696.32
Cefazolin
2451633.48 383290.98 1821783.47 12148201.25 27096.63 2233566.56
Cefuroxime axetil
3549546.86 2937575.89 2981548.47 5476133.46 45287.69 1634193.14
Cepharadione A
1335987.46 2062355.03 2355637.83 10159486.93 73193.38 1035499.53
ceronapril
12384110.46 10434432.20 13137977.07 31621649.18 236369.33 10629805.15
Cervonoyl ethanolamide
2880678.80 402652.20 3410405.70 726136.72 100651.20 1412245.38
Cilostazol
1054641.03 5752548.62 642752.23 38913563.13 413826.22 15760338.40
Cinchonan-9-ol
2084510.56 1654242.07 2332759.82 6719371.65 30363.64 1701025.36
Cinnamaldehyde
585546.75 798496.26 1008166.51 5725594.47 72781.98 5721157.59
Cinnamoylglycine
14712705.73 13831444.78 14172746.54 48775901.72 31569.94 10561186.58
cis-2-Carboxycyclohexyl-acetic acid
11094859.33 11760622.38 10893734.74 22841381.30 3857049.80 21661953.54
cis-3-(carboxyethyl)-3,5-cyclohexadiene-1,2-diol
3689463.27 5110926.50 3261900.34 1714121.81 722904.56 1057879.84
cis-4-Hydroxycyclohexylacetic acid
7925965.11 8187681.57 7793061.25 12618811.35 1348405.36 4317432.71
cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylic a...
7136563.14 4478288.67 4225240.50 2930402.85 1180813.98 2143411.51
cis-acetylacrylic acid
23286378.89 30748493.35 28041761.52 18135489.00 7315019.24 26072093.93
cis,trans-4-hydroxymuconic semialdehyde
4738643.22 4151350.86 7250899.42 973336.01 1499542.30 1471093.01
Citric acid
1370102056.12 1038199025.82 1685039319.17 401484057.43 331468.61 673281636.54
Cladinose
5414571.59 5460920.15 5322423.70 9540003.29 62943.34 3222318.46
Clavamycin E
10647600.32 11811942.77 8900083.21 15336814.67 92838.92 7501973.72
Clebopride
828278.27 832182.89 1070862.16 2847738.09 48130.49 601755.47
Clomazone
690649.71 2345153.68 3963547.85 93702946.25 145362.09 5970293.03
coniferyl aldehyde
3087420.86 2647771.69 2780892.73 10492875.34 239193.43 2071662.72
(+/-)-Coniine
3619073.42 3466966.94 1958717.04 2967372.34 41941.42 913786.63
(-)-Corey lactone
60784475.48 62034378.51 55220374.03 99941613.04 1407429.45 42899092.56
Corticosterone
2218171.17 3969532.47 4431805.82 1608433.59 53798.70 1102439.02
Cortisol
1106630.19 941458.96 1088303.24 3166300.10 55584.85 709772.85
Cortisone
1709534.66 2439781.20 2218875.73 18466442.79 62477.80 4648246.82
COSMENE
4536938.01 4027930.18 5085760.12 17450502.26 252607.01 3343906.73
cotinine N-oxide
940009.77 1176350.21 1692088.51 6864525.79 28024.66 1106165.26
Creatine
196428891.31 147210542.39 133462904.55 270024043.39 762463.78 471372358.33
Creatinine
16032791633.90 13551456174.60 14855469672.60 44344231634.60 4667993.83 13602306431.20
Cromakalim
64546537.74 49821964.46 78584188.91 34539540.06 39937640.89 59496917.89
Crotanecine
70319986.80 84305245.83 84875585.96 165566706.60 500107.54 26416168.74
Crotonic acid
45076001.08 40897853.12 42832717.57 83966544.30 1644917.60 28908442.31
CU8460000
4170269.02 3451454.64 3944920.19 7635362.13 488424.23 2301466.97
Cunaniol
913787.81 1178000.13 1542577.54 2777360.88 36320.25 860886.92
Cuprizon
3890943.00 5391096.31 2925141.90 10863131.81 91046.15 2635430.95
cuscohygrine
4057313.23 2796851.65 1772803.77 5539954.99 124330.92 1266152.74
CY9070000
1528056.81 1611034.60 1795532.93 4808732.70 83764.51 1124109.76
Cyanohydroxy butene
13670247.68 9280129.50 37001994.72 635123717.83 1802320.61 119154418.92
cyclobarbital
284046.21 317031.71 245496.71 1621162.70 45755.49 195101.68
Cyclohexanecarboxylic acid
19358316.79 16131031.07 20204128.97 47989827.23 1412362.95 17714558.13
Cyclohexanone
4731561.38 4392391.81 4945031.32 8393290.47 485186.76 2363552.53
Cyclohexene oxide
680261.66 524683.79 787756.46 1770526.67 357006.61 301548.59
cyclohexyl[4-(2-methoxyphenyl)piperidino]methanone
411584.77 987133.72 297480.85 582086.02 33570.08 138232.00
Cyclohexylamine
1315627304.51 1002447138.65 1142675509.96 1957595363.42 437566.10 455490100.74
Cyclo(leucylleucine)
43956157.72 38320970.78 15394672.32 56303214.77 445399.64 17617578.14
Cyclo(leucylprolyl)
1072293.29 726747.24 1364547.80 2991428.39 106681.81 465132.28
Cyclopamine
92831.34 87903.07 116006.47 125467.00 109526.31 7650839.21
Cyclopentanone
3255786.94 2825010.67 3904826.92 13308339.71 404849.11 2709416.58
CYCLO(-SER-TYR)
11497808.61 28838553.69 15780755.61 119282023.99 28568.71 12661375.74
CYCLOTRIDECANOLIDE
254128.11 254303.18 291894.43 2671431.47 130694.35 709501.34
Cyprodenate
49581145.17 82231017.57 53973755.26 45785113.20 25559816.24 135879579.12
cyproheptadine
27682909.03 23118636.83 24539867.79 107884294.36 76933.52 24512655.33
Cys-pro
326960.29 425907.56 279041.79 1322514.20 43913.98 20323721.18
Cysteinylcysteine
3304108.51 7795196.76 3820247.51 25319581.72 2300449.08 8272676.06
cystophorene
3675227.53 1098540.53 4734185.92 764701.51 585526.67 1102404.02
Cytidine
65543290.69 62291031.28 66533808.33 189115805.63 331462.62 166284836.16
Cytosine
1282982151.69 1282077269.90 1156071588.94 5210740219.00 1472345.30 1394803050.00
dacisteine
6931122.65 7524382.55 7419860.74 32060012.43 122147.78 5725555.04
Daidzein
4013038.07 3467909.32 4817532.56 23007506.48 35600.02 3511705.91
D-Amphetamine
1641970.75 1341181.98 1308890.92 748623.37 124597.87 433382.09
Decanamide
312018.50 256027.97 1608417.62 791405.92 116723.07 413240.16
DEET
2778060.30 2648656.90 3912794.31 3907275.16 1648721.85 2831232.14
Deferiprone
56599575.16 50101361.94 59044351.54 205008535.16 1349868.50 42975590.09
Dehydronorketamine
1857939.23 3081831.28 11879092.89 44466831.69 31741.68 6611056.76
DELTA-9-CIS-TETRAHYDROCANNABINOL, (-)-
503252.07 1087747.42 590956.70 1485246.41 40637.56 501263.80
delta-guanidinovaleric acid
122823166.95 106374359.49 160913528.00 260351945.84 743411.09 144815380.46
delta-Nonalactone
3363094.75 2658949.06 2689059.19 3718683.06 878541.03 1412287.44
delta-Valerolactone
82203593.68 57910309.15 77955415.58 287925652.88 1339545.63 52159809.37
deoxyhypusine
2215669.81 2423333.04 2228385.75 6194541.89 52800.71 1319857.73
D-Erythronolactone
47136929.94 41926420.62 39154010.19 8272732.57 6621309.16 68401776.42
D-Erythro-sphingosine 1-phosphate
132818.19 113735.45 132743.25 177905.17 138364.21 11672600.76
Desthiobiotin
45963012.30 70182212.13 28279533.77 34455892.48 123418.76 15221798.17
DG8734020
2070266.27 1667938.76 2568667.87 8801384.25 539458.16 1371729.14
D-gamma-Glutamyl-S-[(4S,5R,6E,8E,10Z,13Z,16Z)-1-carboxy-4-hy...
8432863.79 7030515.23 8834444.51 20553732.96 81643.68 7117444.49
DH2090000
757253.25 955000.10 621379.93 483740.57 100892.56 293192.75
DIACETIN MONOPROPANOATE
5785308.10 5890648.09 7457505.34 28744783.67 194755.88 5664247.85
Diaveridine
13070387.65 12467058.38 11737779.38 14807933.65 712383.63 3443107.15
Dibenzylamine
4732851.61 5201292.48 5292342.47 26020160.32 200129.13 3552534.54
Dibutyl malate
7557444.65 7407326.09 6703381.65 18317509.35 59211.34 3588163.95
Diethanolamine
76649917.27 83397600.58 77207581.44 258734652.95 15548377.28 64729203.25
Diethyl (2R,3R)-2-hydroxy-3-methylsuccinate
6315050.13 5017187.47 7255618.14 5337962.00 439624.29 3422041.29
Diethylene glycol
472746757.72 229088255.47 709810768.55 512082349.64 7015172.74 11015891.94
Diethyleneglycol diacetate
3353853.71 5524279.43 3553633.03 4972710.90 392664.43 2443743.42
Diethyl malonate
31436643.29 28846869.72 35447411.52 79387173.97 541030.01 25312228.85
Digitoxose
25812945.87 32262774.90 30302560.69 32419727.09 1416924.28 20199610.43
dihomomethionine
4787307.83 4292012.80 4536235.31 6829775.12 50585.73 2102481.14
Dihydrokavain
4051761.32 3943638.02 2557056.40 6118154.65 257739.49 1330064.43
dihydropyranone
5267628.02 23003303.43 6500960.86 8743057.64 717911.90 4806738.08
Dihydrothymine
12602836.15 14963415.41 12152916.63 12108774.45 586194.98 11251334.57
Dihydrouracil
35765712.98 39602940.31 41491898.56 61917125.82 2508622.72 52318895.21
Dihydrouridine
32814264.18 25557758.56 54154010.83 50219365.40 221391.73 75596594.52
Dihyroxy-1H-indole glucuronide I
75619758.88 53698267.90 88993736.22 282150619.75 134538.73 39249743.37
(Dimethylamino)acetaldehyde
8651655.15 2982768.51 13756584.06 6144156.81 3024818.15 1300205.24
Dimethyl octanediimidate
1835050.98 1932343.66 1859046.78 3745236.36 47372.14 2143143.48
Dimetridazole
5591703.61 6632390.92 6831206.98 16834508.76 398219.44 6099635.34
Dinobuton
4647143.73 2710134.98 5023603.01 5721489.34 35427.36 2204666.83
dioncophylline C
679516.27 658888.27 640340.66 1433109.83 33659.52 308722.01
Dipivefrin
581606.45 771540.13 677044.20 6553704.05 58847.45 427753.03
Dipropylene glycol
9212238.63 5123495.36 8370657.51 5528865.16 238191.02 1656187.27
Dipropylene glycol dimethyl ether
8975559524.20 4873317925.10 12950440947.90 8438834222.80 74992811.64 215358674.14
DL-2,6-Diaminopimelic acid
23450268.95 24376585.17 25153926.73 14954290.52 127231.00 18040189.23
DL-a-Aminocaprylic acid
2537557.14 2104462.19 2672479.41 9632272.82 41751.71 1512430.66
D-Lactose monohydrate
12449323963.50 11377227771.00 13000468073.40 8332679910.20 20680770.88 8315326891.80
DL-Ala-DL-Phe
20659960.95 15293652.96 22972084.70 19433661.85 122700.22 14702203.08
DL-Carbidopa
339034741.49 306148926.82 345560737.60 973368207.31 707761.18 233408216.08
DL-Cerulenin
5463628.40 4204583.65 5225261.60 17811017.70 59834.81 4841800.16
DL-Citrulline
3431013.94 1259296.37 3280449.34 117435723.15 497102.76 25724784.63
DL-Glutamic acid
7538630.07 6352185.54 8650777.74 28939960.55 285920.41 5309329.01
DL-Glutamine
9594749.56 6413322.04 10176668.86 28731591.86 359714.95 16515164.89
DL-Histidine
1935245.12 3958594.62 2309337.64 6073667.26 763538.54 8253385.36
DL-Homocysteine
33940230.57 34848224.99 43489135.37 64489902.69 290220.46 22503855.88
DLK
20954729.43 15838190.58 24392215.15 62635137.47 148832.94 21763405.09
DL-Lysine
84758073.55 77683684.65 155026014.40 149178892.92 4493123.99 148298108.10
DL-Mevalonic acid
37599160.80 29859834.15 30835078.18 157616645.57 1279344.60 34682474.42
DL-Phenylalanine
11653543.41 12350846.17 11529115.11 44855233.85 251708.61 10845384.74
DL-Tryptophan
2868919143.00 2460905261.00 2533839178.16 4102550316.50 672343.85 1930304231.00
DL-TYROSINE
14483460.49 13410442.71 8447746.11 38073297.81 99122.15 8351064.22
D-lysopine
28498212.16 26638608.39 28611518.30 41602591.26 314200.03 13582984.11
Docosahexaenoic acid ethyl ester
2417453.95 263378.32 818189.80 216088.31 103359.40 865001.55
Dolichotheline
2842340.64 1367308.57 2032068.93 2888524.99 31336.72 813058.30
dopamine
5977786.13 2985847.19 8126197.90 21432251.56 166229.32 5901923.73
Dopamine
36082908.34 53241225.12 42176318.22 58565835.25 372765.87 3960850.09
D-PANTOTHENIC ACID
1963165534.30 1897411480.00 1700351226.30 4138483424.80 821675.80 1318792355.60
D-(+)-Pipecolinic acid
58849180.39 44345399.86 73688928.47 124018475.38 2618339.95 41652119.57
DPK
1135174.71 1127420.39 1286824.47 5741137.08 54024.58 1016618.52
D-(+)-Proline
8906256.72 6896967.46 9427933.03 24982281.71 1537952.10 5424245.60
D-(+)-Pyroglutamic Acid
2436849.73 1076947.33 2608373.38 32562836.53 589277.16 4448378.71
D-Raffinose
32000771.65 25977460.29 31887132.64 73661604.25 96315.46 36354056.81
Droxidopa
18055287.67 18043030.07 20996705.69 77811425.08 127336.46 13332634.33
DSF
1647629.75 1296687.50 2160571.27 1177456.04 1774508.27 2290563.77
D-Sphingosine
365887.22 433823.61 462727.67 948687.71 154712.85 84101493.13
d-Valerolactam
27569383.70 29630757.77 30495147.50 276976576.93 990153.28 43893328.29
(E)-2-Butenyl-4-methyl-threonine
4044827.61 3511408.37 3871890.07 11033122.24 145358.03 2405248.37
(E)-2-Decene-4,6,8-triyn-1-ol
7171801.31 6841326.87 8737745.13 14746233.17 59454.63 18644974.79
(E)-6-(methylsulfanyl)hexanal oxime
1309251.12 196577.41 697873.62 600158.27 161645.03 355669.59
(E)-Aconitic Acid
167521283.00 159937403.75 169395185.23 123868655.50 396948.45 90195207.97
ecgonone methyl ester
9327310.90 10111097.91 13553650.34 89432571.35 1387058.65 14263592.68
Edoxudine
119294593.85 122648193.47 113513700.36 355710958.82 184987.98 86259549.63
EJ4025000
1387043.19 910228.55 3988549.95 34702623.59 66719.55 3788227.70
EL9600000
739780.27 1247363.63 798898.62 3238137.82 209475.61 607978.48
ELK
257261.97 194573.11 559818.24 1410390.32 63838.48 1808934.01
Eluxadoline
2323331.92 2413106.48 3406296.74 3060141.99 63282.36 895616.13
Enicoflavine
14758677.04 12781173.68 15196731.77 41759145.34 44855.79 9791839.63
(E)-p-coumaric acid
884999220.40 717116493.91 1027075798.29 1306409024.82 1618174.56 1258896350.00
EPH
12353621.30 14323997.10 19857531.12 21954266.59 167917.12 7254900.11
Epitestosterone
897731.58 1710391.57 1120681.67 1309297.34 46922.60 597372.46
epi-Tulipinolide
1906409.52 3036121.94 1326606.60 1007997.02 167051.64 517480.40
epsilon-Caprolactone
53547533.32 41522674.84 59799685.60 528293681.81 18235506.10 61875296.80
(±)-Equol
782324.29 707345.01 424239.46 2192780.86 60074.96 295204.80
Erbstatin Analog
1731873.91 1869073.53 1815598.44 1807021.89 144836.09 1402397.73
Ergine
945214.56 13064599.92 1019289.35 93671895.30 30531.95 5800313.03
Ethanal tetramer
17366923.92 16373646.14 16823962.21 20698055.53 1147759.81 8670818.16
Ethinylestradiol
1573349.90 2033856.31 1077565.06 461764.80 62474.05 704356.98
Ethosuximide
11900971.14 10941739.67 12634283.78 41941002.56 338207.13 9511668.03
Ethyl 2-methyl-3,4-pentadienoate
3716348.94 6647032.97 4331311.87 9483737.53 2895060.45 866950.71
Ethyl 3-hydroxybutyrate
144389574.58 135204165.08 149410519.69 323615900.13 2548949.59 99032667.19
Ethyl-3-thiopropionate
4840731.40 4731075.27 6009020.84 2952863.06 71033.90 8991375.58
ethylbenzoate
3002650.26 2405611.58 3247631.29 2492751.66 637311.46 1184434.57
Ethyl furfurylacetate
9415593.71 5019878.06 11807090.41 5503432.22 1740754.50 2616436.72
Ethyl lactate
60177997.90 48325785.46 68826362.11 136443720.57 1668487.91 45877608.26
Ethyl methylphenylglycidate
27432065.07 27060166.86 20489755.20 47280503.67 573780.46 16104958.18
Ethyl N-[(2-isopropyl-5-methylcyclohexyl)carbonyl]glycinate
2132448.76 1743777.36 1659382.64 6333106.28 56896.76 1221600.42
Ethylparaben
4340664.05 3833780.66 3707938.20 4086257.15 420499.80 1472903.28
Etretinate
91798.10 91387.17 162522.78 1481971.13 78388.92 613211.50
Eucalyptol
1757443.66 3344195.87 1234094.42 668536.81 101490.80 860265.36
eucommiol
7066875.36 6469662.52 8146835.63 24822028.20 151039.11 5588904.59
EUROPINE
2844770.74 2783888.54 2603545.63 7591505.37 45075.41 1740490.57
Exemestane
1711270.76 722232.51 2188842.27 2908046.71 717455.32 1142920.56
fagaramide
1056126.04 537049.90 803294.03 22465176.35 132046.47 2228652.00
Fasoracetam
1179190.59 1286457.18 976414.74 7593777.01 170744.21 3570892.16
FG7175000
13021800.82 12669622.34 13374111.70 19142554.42 137295.56 12099078.78
flamenol
4679972.05 3535120.67 3969652.02 4435366.19 384732.99 2329644.51
Flavin mononucleotide
343596.13 329546.75 353243.46 504253.60 37061.66 3854635.42
Flossonol
2429456.06 2147874.78 1823976.90 7433215.09 232987.24 1310456.41
fMet
3603220.88 2869984.61 3664484.33 2748177.29 29459.91 2473545.04
Folic acid
4699995.71 4088153.32 5045599.14 4818633.81 61902.15 2814097.46
folinic acid
258480.55 738049.39 1085374.24 1077827.61 29046.80 675278.73
Formiminoglutamic Acid
28192662.45 25327595.39 29340357.57 33870868.57 1397125.85 37515906.27
Formyl-5-hydroxykynurenamine
1535374.57 1422110.84 1675038.29 9234322.36 41811.83 1341588.31
Formylanthranilic acid
2111257.33 2064930.32 2156361.52 3917505.66 179054.37 2094228.36
Formylkynurenine
4407718.87 3972668.92 4448287.33 7447359.73 218979.71 5499007.62
Fructoselysine
2393724.84 2010000.13 2583767.46 12015173.09 337365.05 4012059.75
Furaneol
1873177.10 1796035.45 2271315.94 6813658.51 965740.50 1627141.84
Furfuranol
3304862.40 1762603.35 4448364.08 1882149.49 2237132.77 2181828.14
Ga
908408.15 598411.04 384698.41 11358670.34 114269.48 598902.50
Gabapentin
42121989.06 43790033.60 39595158.37 25959403.95 5105499.82 19129171.47
Gabexate
1140682.06 1299100.65 1269921.17 12734679.95 83732.43 1111497.12
g-Aminobutyryl-lysine
13305685.96 8733746.40 13206719.68 2974113.61 86741.55 3306289.10
gamma-Aminobutyric acid
190424694.02 111632159.16 186705601.22 148570427.19 10887917.98 317889617.50
gamma-Glutamyl-3-[(1E)-1-propen-1-ylsulfinyl]alanine
16307176.16 12397885.02 16181428.14 29371878.62 58075.66 8706723.39
gamma-Glutamyl-S-allylcysteine
8231459.56 16746201.10 9255282.82 65585443.05 120310.00 13553981.64
gamma-Heptalactone
9721479.54 2660745.37 12791358.10 3178857.83 2568005.88 5400906.28
Genistein
660185.65 677529.54 968447.58 7082368.70 48003.18 953933.82
Gingerdione
9492792.72 17614993.84 5384222.75 13155088.87 174846.29 5243266.05
Ginkgotoxin
15834413.22 18484592.04 15413692.16 29851089.21 140773.22 10053677.12
gln-lys
8773030.34 5806537.44 13431318.07 15804970.69 91184.03 8404042.87
gln-phe
11588839.47 17731970.73 14587375.50 47376049.28 33545.98 9962050.60
Glucose 1-phosphate
7674631.57 7356141.97 7917929.38 4274131.72 3310951.05 18520221.39
glu-leu
202880789.67 214548779.96 232278141.66 1086153390.56 172504.74 225093991.72
glutaral
8656678.34 7149871.90 7705705.36 52130687.79 866903.32 4809303.35
Glutaric acid
55844110.70 54760340.02 60530908.35 28595339.22 2843998.45 52574132.95
glutethimide
619013.68 1052828.07 689971.27 20064569.11 30641.57 2262742.35
Glycerol 5-hydroxydecanoate
4122528.27 3941622.95 5603893.05 18808877.29 480028.27 2621239.74
Glycerophospho-N-palmitoyl ethanolamine
90724.00 81402.85 82427.38 188658.34 86566.13 5817778.13
Glycidyl methacrylate
51107759.33 50597135.64 63832614.31 68387232.87 181537.85 129901410.70
Glycitein
199051.59 166480.12 263509.66 2668423.02 38196.99 304830.29
Glycocyamine
77655835.45 95390093.34 81780351.49 61949917.31 201190.52 119104360.92
Glycylglutamine
3196967.27 2696929.78 2638141.69 20213522.74 140400.92 1386064.31
Glycyl-L-asparaginyl-D-leucine
576955.64 627072.49 679732.23 7853960.71 71038.74 593178.47
Gly-His
7156095.00 5777931.46 7540508.47 23707226.52 218048.64 4305166.76
Gly-Leu
19062977.88 19738151.68 21848342.32 29740951.83 60623.01 16099768.52
Gly-Lys
41441600.18 39450734.69 52831107.17 51413114.08 137915.36 33480300.32
Gly-Phe
5808097.89 6313217.89 6095655.03 6892267.07 118052.35 5537526.48
Gly-thr
19546849.38 19682929.46 18773467.72 34983862.75 553370.11 12280603.10
GNH
2185277.32 2103207.63 3126120.10 6392419.37 207822.87 1914354.86
Guaiacol
12613050.38 10905507.26 11849134.45 24116734.83 1653918.33 9595984.33
Guaifenesin
83133222.70 41522757.34 115281358.39 67668811.36 634583.15 91951357.93
Guaifenesin Metabolite
5865250.98 6333199.87 5772389.71 2769863.27 312616.87 2228668.13
Guanine
14221499.53 13101568.61 15682432.13 51663163.19 146898.47 45063572.60
Harmalane
5798498.72 5404355.59 6713773.13 11717464.27 462766.76 17336802.58
Harmalol
41895862.55 58144523.73 35542576.48 145676299.03 179875.25 6846889.09
HC Blue 1
3060746.87 2267831.92 3184358.27 9836107.79 36257.81 1864647.08
HC blue 2
3880685.58 4309458.68 3974541.11 7502046.71 157189.15 2770555.43
H-DL-MET-DL-MET-OH
11697639.27 7698552.20 13392710.91 506484.84 122338.83 5315711.82
Heptadec-1,7,9-trien-11,13,15-triyne
3542363.58 3820576.70 2644325.29 5250705.16 53047.37 1495509.56
heptaminol
2404681.76 2430887.47 3018680.31 17108900.36 60289.45 1846102.38
hexahydro-2-oxo-1h-thieno(3,4-d)imidazole-4-pentanoic acid
9806037.92 8224688.94 9172873.33 24793049.07 140631.72 5804276.99
Hexanal
213526536.81 114557737.80 271996044.99 304553341.35 486090.87 7720648.60
Hexyl 2-furoate
1174555.49 1846650.78 1829315.18 3870714.46 673701.53 1184001.53
Hexylamine
35421059.95 35118156.53 26689186.84 20710124.17 164800.37 106754423.52
Hexyl Isothiocyanate
734172.23 888441.22 945364.00 2236125.25 50282.67 601253.86
Hexylresorcinol
19609076.99 11260711.05 22747288.93 1417805.51 11686730.26 18889461.11
HIAA
38356715.44 40687872.76 45019676.98 107704924.37 152027.83 29129447.20
Hippuric acid
5664944452.60 5652877687.90 6755043676.80 15817552366.00 1943782.65 5262807187.80
His-pro
71574228.66 64549144.18 78220577.06 110915017.33 17121562.55 60470586.84
Histamine
22242859.74 4146941.33 37007731.85 3258268.53 4353730.54 4581827.25
histidinol
153796158.81 207157572.26 188170064.71 733971506.41 881363.60 191286278.78
Histidylglycine
3480784.51 8790942.27 3747135.25 12805231.48 137168.73 477076.50
his-val
4926198.29 2913948.04 6237065.14 12346140.56 41966.64 2885867.18
HMBA
680676.50 947294.57 466069.30 944926.10 52997.81 256177.91
Homocitrulline
11216489.96 7769631.26 6693881.48 60011394.19 63101.42 5097241.92
Homoisovanillic acid
3865574.87 3207547.71 3718608.79 3844803.10 189409.77 1834193.07
Homo-L-arginine
24080698.57 20724033.89 31857135.97 193690186.48 88821.55 31239362.90
Hopantenic acid
21970119.14 22705208.73 25350047.71 104297783.63 256014.94 20962843.28
Hydroconiferyl Alcohol
13219492.30 12782574.53 12295246.51 58717290.93 2157363.44 9363068.66
Hydroferulic acid
2724866.90 3743346.04 3521894.30 2946791.16 347104.73 1888733.22
Hydroxy-1,4-benzoquinone
2149046.83 1569568.52 3493743.46 1444772.43 279176.41 2807680.19
Hydroxyamphetamine
1120461.86 1087211.23 2075821.27 1252321.90 49122.76 602811.11
Hydroxycitronellal diethyl acetal
7826978.24 2524875.47 10365007.55 2638020.67 3351805.16 8452661.24
(Hydroxyethyl)methacrylate
40663905.38 39065498.83 42771042.87 51402505.00 2688672.81 36990711.64
Hydroxylysine
20693803.32 22873728.89 10580247.31 59800629.90 2603318.80 21446755.69
Hydroxyprogesterone
708066.66 1293422.84 1355102.29 736762.80 35831.32 118384.36
Hydroxytyrosol
33342621.19 32866270.38 34858720.58 98055751.27 915869.77 28099136.75
hymecromone
434946.69 332207.38 562430.28 1252303.26 101610.45 271375.05
Hypoxanthine
336180794.81 434226267.55 394074944.87 841768630.58 219629.85 1293383825.60
β-Methyl-γ-decalactone
3022195.53 4779198.88 2364219.55 1843814.30 362969.69 1447099.73
IBMX
5696681.86 4404778.50 8162501.74 25627723.18 257622.64 4378176.14
ibufenac
4012264.58 4847692.74 5750446.76 18082749.78 85508.88 4245550.30
Ichthyotherol
5075545.42 5919623.15 5476226.89 22028347.34 213248.83 4280659.57
Idanpramine
998541.51 799406.67 1025798.50 5200959.04 47519.01 1052166.01
ile-phe
79479396.59 62441581.33 77477592.90 201802180.94 44185.34 58248085.14
ILK
1091509.52 1072217.82 681533.68 715756.64 43288.52 666235.92
ilomastat
3729950.89 3561384.12 2902159.43 5391603.41 62459.06 1675381.64
Imagabalin
17329669.89 1011523.82 15070883.68 1283926.93 441806.60 3109580.43
Imidazol-4-one-5-propionic acid
259232260.15 258913845.66 246201601.08 270964076.67 1102983.67 370468920.26
Imidazoleacetic acid
39104691.12 32620047.84 42156716.65 80770191.77 207695.62 35990195.10
IN00105
46418930.46 44441352.41 49086867.77 164267384.17 63781.71 35292003.56
IN00260
43322901.69 23141162.47 68568626.21 69616007.51 138949.26 23858910.42
α-N-Acetylcitrulline
93368720.40 78056311.94 105511852.54 139447576.64 250849.40 82627524.01
Indirubin
216859.08 255180.83 660084.95 1105365.83 275042.62 2939672.66
indol-2-one
59433057.73 53267297.20 69784511.01 204650350.50 881627.65 74876351.03
Indole-3-acetic acid
390840242.72 482824917.78 362732805.06 912519273.50 121973.02 249147075.36
Indole-3-acetic-acid-O-glucuronide
1719211.32 2684154.48 1601512.38 7964223.99 72912.14 1586463.74
Indole-3-acryloylglycine
32406929.30 24226767.99 34917804.53 71281986.81 101000.44 32398763.03
Indole-3-glyoxal
2970500.82 3022880.87 4249488.48 8671752.66 163666.57 1973025.02
Indole-3-lactic acid
28720624.21 35033023.20 30888608.85 93439677.29 95257.02 23105410.77
INDOLEACETYL GLUTAMIC ACID
4647384.57 4523062.71 4482634.17 11791936.60 118609.29 2636360.68
indoline-2-carboxylic acid
1670064.45 2039338.01 1464090.89 6835734.68 75948.52 1369010.90
Indomethacin Related Compound A
272982.72 238446.88 367818.91 1846542.18 39119.98 250499.10
indospicine
76620075.87 125009679.66 130169655.52 255121317.05 128500.07 133801767.40
Indoxyl-ß-D-glucuronide
18659470.90 14424054.41 22965745.90 34142206.08 87193.61 13409091.77
Inosine
430342446.31 444864899.20 426610108.90 1014000031.04 531045.77 1492661560.00
Inspra
1785151.54 1461645.88 1912496.46 8089014.34 35731.21 1561930.45
Iprofenin
916570.88 525855.07 968368.53 5723303.68 95022.47 890680.98
Isobornyl methacrylate
2398077.92 1746456.38 2119169.37 6215179.48 122909.96 1127634.88
Isobutyric acid
124930690.41 62748162.32 196089586.79 119039074.87 916013.53 3238171.36
isometheptene
1837292.13 1349268.30 1492013.18 1710170.62 51671.27 789378.54
isonixin
12794622.55 9532338.17 13061803.35 26306860.81 34618.32 8801369.61
(-)-isopiperitenone
9704548.24 9969655.83 10193104.80 26001827.91 398024.41 8090513.65
Isoprenaline
795009919.33 801155537.99 640740900.93 3248337764.10 680240.93 525358272.98
Isopropyl beta-D-galactopyranoside
17923739.07 18733535.14 17023643.55 47249805.36 163014.10 21672636.45
Isopropyl catechol
23660879.34 10517273.66 19567444.17 9264096.41 6324856.79 9025296.35
Isopropyl methoxy pyrazine
346947.86 321483.32 331785.56 1909362.49 42046.85 242241.97
Isoproturon
1803969.29 1229530.32 2660997.52 14343476.10 72410.67 1071272.04
Isoputreanine
28202516.79 27157000.63 37952689.72 133208509.97 388700.35 96263364.69
Isotretinoin
4850966.65 4407358.02 2659949.07 495434.38 101005.89 2436420.27
Isovalerylglutamic acid
186835718.33 194864953.37 193727517.11 467290612.71 137394.89 104044716.79
ISOXYL
6213811.89 5275238.30 4108507.75 5387277.58 106428.82 97724407.71
Istamycin C1
13050632.09 10896264.58 18299940.76 76071477.27 3880847.49 14063879.48
JUVENILE HORMONE II
1704101.77 3049464.93 1982073.40 10193913.30 99677.70 1944334.47
Kanosamine
52179021.09 58445367.14 64782044.19 91124482.20 16330514.33 1190356377.40
Ketamine
22875691.68 29894626.80 69182469.67 43883851.39 53898.83 15295393.50
Kynurenic acid
1616495617.20 1533233556.50 1855197247.27 7355350664.50 439666.60 1467932736.80
Kynurenine
2174869.49 2235140.55 2675359.93 9226151.22 86912.54 1535918.46
L-3-hydroxykynurenine
4087513.58 4236060.67 4384853.88 15548001.94 298639.00 2950939.98
L-3-nitrotyrosine
60350681.77 63230858.89 54011177.71 101910554.90 263341.50 46147586.39
Lactaroviolin
1871695.03 555214.91 1594786.77 2403879.53 54908.19 625405.97
Lagochilin
2266987.47 1268495.76 2520766.71 2571233.77 60688.88 730900.96
L-Alanyl-3-{[(3-carbamoyl-2-oxiranyl)carbonyl]amino}-L-alani...
8290007.24 34609124.49 11471669.12 12968119.09 103317.83 6887349.31
L-Alanyl-L-glutamine
1225226.74 1126110.64 1307078.10 5375815.65 45689.60 810826.95
L-allysine
7248340.59 6133150.12 8341433.55 33615661.99 1342018.42 16410535.10
Lapachol
426391.60 334548.91 245512.44 712123.18 102809.81 187628.38
L-(+)-Arginine
17871761.14 16156962.11 18670902.53 20686542.45 83323.63 24987777.98
Lathodoratin
10367954.89 7226165.04 10678675.90 12168269.06 39902.88 4873153.43
L-Cladinpyranose
6151842.63 5092855.52 6939741.50 16330644.17 464042.80 3963272.87
L-coprine
25645465.44 27350673.68 26886686.39 29420790.19 397387.82 24929587.01
L-Cysteinylglycine disulfide
4677370.37 2902854.61 3863978.52 4503853.46 31194.31 1849647.34
L-decyline
654316.00 858077.52 107092.36 187420.62 33367.12 117207.75
lentiginosine
1449592.10 889452.98 3763159.62 36799855.48 142349.04 6652414.27
Leonurine
539606.87 468931.99 537798.57 3006380.79 207776.82 514136.73
L-Ethionine
584243.55 352619.50 500080.77 1569770.30 55119.89 7405812.02
leucyl-4-hydroxyproline
43797699.36 35855025.41 32540148.03 101453671.15 299435.06 40934530.45
Leucylasparagine
12019894.69 12078893.52 13589902.21 25233404.75 92502.45 10861243.00
Leucylproline
583251113.81 580768870.65 735069241.30 1572413665.70 104174.91 355038558.30
Leucyltryptophan
36319530.56 28060826.71 54584579.21 44181752.62 34178.18 16395732.25
Leucyltyrosine
8703326.47 7203593.32 11097149.33 4433667.10 38232.19 5889229.66
Leu-Gly-Pro
3974589.30 2381271.57 4064322.20 1293876.42 31789.83 439770.74
Leu-Leu
4794982.21 2896986.32 5940355.26 19262711.41 134609.70 1688909.03
Leu-pro
2809185.70 2742197.70 3307425.15 4064819.33 44562.26 2398709.47
Levetiracetam
4071512.05 3774749.89 5397676.31 27874999.37 149165.51 4881226.70
L-gamma-Glutamyl-L-leucine
36780656.95 32361596.11 44248040.88 125982065.36 99972.65 30909575.18
L-Glutamic acid
110135338.20 97131320.74 92238854.33 47427004.91 3076820.89 432980161.30
L-Glutaminyl-L-Leucine
126896493.02 118566740.95 136282000.48 537544792.02 144414.86 107654790.22
L-Glutathione oxidized
1369489.38 1228763.35 1595502.46 2524748.83 95591.83 200589103.56
L-Glutathione (reduced)
1656620.62 1283392.85 1464830.86 2623506.02 108890.72 165952969.14
L-Histidine
2881783.71 2694433.56 3562215.26 17301371.80 931486.54 18271527.63
libenzapril
1308125.59 1590838.51 1347668.41 5242933.08 113574.54 1363245.52
lidamidine
8069570.91 8081448.03 8507974.91 11946640.67 85602.64 4916317.31
Linamarin
11140806.60 10996965.43 10923239.83 28472323.39 47969.82 8437912.85
Lindenenone
1132071.96 972052.05 860691.86 4415367.80 68762.62 775701.01
Lipoamide
13434385.91 11265597.17 11102906.21 20294613.53 237132.58 7984367.27
liquiritigenin
258687.47 264985.01 393409.10 1930427.56 34802.12 328680.10
Lisofylline
7048088.65 6223183.06 7858458.55 28572096.63 306706.56 6027494.49
L-Isoleucine
1501672191.54 1231156989.91 1566216178.01 2040199126.73 915189.55 1166345715.16
L-Kynurenine
97975718.66 69317817.15 105434880.39 207804740.10 226141.60 63669205.44
L-(-)-Methionine
11479523359.80 8332999589.40 11624955623.50 13233158259.00 2332023.60 7397010300.20
LN
8962809.20 9647599.69 10568243.47 4533763.93 251863.99 13613858.08
LNK
394368600.76 390143455.65 401281718.74 537036563.39 760659.91 446918120.16
L-(+)-norleucine
45011615.73 41445850.39 41691969.11 75885180.54 1192234.03 32043182.76
Lophocerine
5174479.65 8941260.23 5920365.17 3417755.15 2157577.04 13878594.27
Lotaustralin
54071227.13 52371603.48 43836978.26 213100522.83 45753.59 43233613.10
L-Phenylalanine
4764833140.60 4290877942.60 4076249011.00 10267051009.50 1886995.59 3493071839.00
L-Prolinamide
45787933.09 38518142.85 43777653.08 157151934.90 1556122.90 36890209.18
L-Pyroglutamic acid
3382520.65 3157545.92 3885789.64 11837668.66 922566.21 2691729.95
LQ1825000
307120793.89 181716498.61 375224377.49 234179822.62 7544724.82 35792368.21
LT9970000
889541.69 1161379.76 841272.09 5632619.30 55290.99 897632.84
L-Theanine
32161634.82 35325960.85 35136455.34 80407019.18 154528.16 26289430.34
L-(-)-Threonine
53758595.94 57830621.33 56621284.55 51360833.17 2204134.85 87675016.67
L-topaquinone
2747772.78 2932441.26 2514065.97 8047364.46 51647.27 1819614.12
L-Tyrosine
892374192.98 724168712.23 1034449525.85 1317595129.50 1433193.58 1252637105.00
LU3453000
43980343.97 31885495.91 68654537.02 42793990.08 2599555.83 116768746.57
Lunarine
11051530.32 9364457.18 10509039.14 29653704.28 320795.32 5974462.10
(-)-Lupinine
917505.66 471938.42 1578652.38 1139008.98 128709.49 628570.16
lycopsamine
4939071.05 544314.61 4892069.29 1210302.93 51273.51 645099.20
lys-leu
1586746.25 2524247.19 1606145.78 2284111.69 80068.20 338341.26
Lys-Pro
470171542.32 314162769.07 590497319.75 505793818.05 279090.93 218627545.63
lys-thr
1226503.52 815469.19 1486104.04 7737325.37 98404.92 898364.80
MA4000000
7044683.32 7716979.57 8738707.58 12709895.32 2111734.85 8945681.38
Macelignan
5399878.52 5447884.21 5609256.66 21866558.22 105170.28 4027327.09
Maculosin
5487637.42 5003123.95 5905085.73 19677646.42 106233.43 4656659.44
Mansonone C
8603113.98 8806546.96 13152093.49 20854036.32 99485.30 6339068.98
Maraniol
1406917.09 3813053.52 395984.11 340502.43 62699.34 522237.73
Matairesinol
3346231.64 1935783.09 1374000.07 3207507.68 49304.93 562540.56
mebutamate
20595055.16 22423112.34 26219410.20 38330941.68 97233.50 13307350.02
mefexamide
192690.90 177336.66 164664.81 1333266.19 29868.17 157380.27
Meglutol
302091671.09 284225075.52 354545695.32 241960940.69 21434636.45 530465071.62
Melezitose
227486944.32 183556713.29 229828034.81 239084959.64 582961.74 171767750.24
mephenesin
18020993.50 17155500.11 19436686.62 26546117.13 2091027.47 6961117.46
meprobamate
5631110.12 6624020.12 6285797.42 24503655.62 56953.09 2902071.61
Mesalazine
971987.93 823201.40 1072599.33 3251631.98 173798.27 925719.54
Meseclazone
3641872.28 2040082.94 4767349.59 10968049.16 75466.29 1932722.80
Metalaxyl
17944761.13 49423061.69 14429484.32 228097193.92 129752.54 22996393.18
(+/-)-Metanephrine
25987950.14 23448687.61 21615311.24 46291905.62 83534.04 13253455.96
met-arg
23727719.16 13187037.71 18128672.67 22971170.82 31809.20 8033104.50
Metaxalone
6136343.78 16539666.35 9363550.24 45006120.02 113803.31 16356780.73
Methantheline
10214221.37 8478127.26 7076953.52 14818995.29 37428.60 5334510.09
methaphenilene
4574306.70 4121337.12 5037369.81 10031642.87 90248.71 8879752.15
metharbital
7657080.45 6858751.60 8710767.48 40880339.79 112751.98 7507776.40
Methionyl-4-hydroxyproline
138873.81 107297.25 144868.14 268271.95 37856.13 3380303.79
Methoxamine
2644056.21 3941821.04 3874490.60 36039276.28 419456.75 4016501.70
methoxyresorcinol
16612222.29 14356516.17 18040652.07 35905916.41 632836.41 13267900.14
Methyl 11-(6-oxabicyclo[3.1.0]hex-2-yl)undecanoate
1407314.53 726495.46 1105338.74 2682321.96 221138.09 4231240.70
Methyl 2-[(2-methoxy-2-oxoethyl)amino]acetate
152415956.81 152225010.54 170493703.56 143045947.59 4217435.33 186882172.52
Methyl 2,3-dihydro-3-hydroxy-2-oxo-1H-indole-3-acetate
195545022.10 797149.24 115704316.75 20562254.31 54121.76 628207.66
Methyl (2R,3S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-...
9366517.59 7912455.49 10667710.37 31316802.64 208718.46 5683356.37
Methyl 3-[(2,2-dimethylbutanoyl)thio]propanoate
1030255.94 963117.72 967337.43 3407311.36 29038.59 719470.45
Methyl (3,5-dihydroxy-2-oxo-2,3-dihydro-1H-indol-3-yl)acetat...
11403512.80 10553925.49 11662613.57 21263234.93 153359.28 8682368.13
methyl 3,5-ditert-butyl-4-hydroxybenzoate
5509876.31 6792745.50 4669666.71 11133612.50 331474.49 2496339.36
Methyl (3aR,5Z,9E,11aS)-10-methyl-3-methylene-2-oxo-2,3,3a,4...
10514659.39 2141402.63 8701232.37 2760184.39 108504.82 2466552.50
Methyl 3-hydroxyhexanoate
15381791.09 3082495.23 20367248.48 3572443.30 12883707.57 8348935.09
Methyl 5-(hydroxymethyl)-3-pyrrolidinecarboxylate
25488409.39 21188114.78 23256599.47 101238161.98 645808.10 12290350.31
Methyl 9-oxononanoate
4276914.87 3351896.39 3670731.73 2352030.08 392030.24 1913123.30
Methyl alpha-aspartylphenylalaninate
2521699.31 2642296.48 2884693.71 7417373.78 106985.05 10091895.82
Methyl bisnorbiotinyl ketone
23026582.84 17130634.37 21451948.25 38440380.26 29992.92 12433293.59
Methylimidazoleacetic acid
32378901.75 32222384.43 27996525.76 85739925.10 2571095.26 25703669.22
Methylone
19715018.41 18670078.43 18876198.50 59101177.01 55655.53 12742998.44
Methyl O-sulfo-L-tyrosinate
3830989.51 3120966.86 3967844.58 8207462.86 39790.62 2510912.44
Methylphenobarbital
1451407.43 2210722.26 1218104.70 7037837.85 41491.62 1631001.66
Methyl tyrosinate
2212192.86 1621980.85 2144787.39 15909750.37 79226.21 11963473.60
methyprylon
2465933.60 2479410.19 2943921.31 11393924.68 39742.08 2023379.38
METIPRANOLOL
636023.16 848837.41 709955.10 5379731.75 40305.83 3809148.43
met-pro
67408174.85 50295324.10 82110360.18 110894524.81 200410.33 30616486.31
Metronidazole
6677657.28 5715604.32 5609921.23 28035690.55 142307.77 6873573.92
Mevalonolactone
39867380.90 36814303.89 48785767.79 265574955.55 1681625.50 11393758.56
MFCD00025555
71926603.06 78836508.92 84023228.85 285381489.44 54217.40 80854812.89
MFCD00046108
8085638.90 6551404.71 7645845.51 13840939.31 1533126.83 4858978.34
MFCD00048696
538066.67 586226.23 752692.13 1916873.13 190097.98 356573.51
MFCD00053704
14677044.42 13873039.62 15159593.25 30660143.05 368194.16 9949077.32
MFCD00055957
3486850.60 2595533.03 3984120.33 6942901.41 35051.98 3127227.26
MFCD00056023
249940.25 837829.69 317576.98 3452581.31 53724.74 565546.87
MFCD00065806
10993154.49 25663101.17 5766354.01 2867167.20 119098.11 5057770.48
MFCD00066435
44901698.44 63196699.40 50279267.02 48124848.84 2618340.48 16627100.27
MFCD00130070
747460.55 494094.38 757786.28 2780329.92 29304.17 250575.00
MFCD00272697
12376485.53 11671686.33 11738704.49 32232468.81 32296.38 9151228.69
MFCD01182773
2242379.82 1357128.83 3107974.09 2550431.71 44766.33 380824.81
MFCD01318772
2230543.15 2646232.67 2394448.23 21186710.35 285601.06 1433234.42
MFCD02728197
7765069.57 6932452.53 7664386.78 20429096.07 38916.26 4402709.35
MFCD07778083
1343316.72 928423.82 2519437.30 2533141.35 29679.82 890244.06
MFCD08277025
12252285.96 5980127.98 10223203.92 23536624.32 76472.12 2165889.93
MFCD10024834
58699336.83 52389234.42 62430040.36 240109466.94 145683.69 54368020.99
MFCD27967839
1589056.71 2012449.73 1739412.80 978602.75 47128.92 332023.68
MI5550000
302478.89 456930.83 531082.45 2405029.63 86607.77 470112.88
miglustat
6185239.85 4944226.74 6894593.15 27154975.73 40479.37 4573293.56
milipertine
6641421.93 1599123.82 4138322.10 2210984.16 28271.00 765998.48
ML-236C
783796.07 2442669.72 528272.97 288872.42 68194.48 236530.00
Monobutyl phthalate
5587855.30 4389275.13 6896659.50 9478270.10 2162688.46 4355827.37
Monoethyl malonic acid
80321337.25 73177966.23 88513712.28 103130916.96 3405234.17 64760981.67
Monomethyl adipate
22746466.51 29005355.34 20641558.71 52625423.34 294688.74 14050647.94
moroxydine
24062583.58 23906617.53 19627571.26 22955776.70 360743.00 12889175.31
Mucronine B
2338848.66 1538469.08 2088511.30 1770342.54 144305.42 962419.84
Myrmicacin
17023364.90 15013180.10 13746255.07 23858321.14 279491.25 8289825.77
N1-(2-amino-2-oxoethyl)-2-phenoxyacetamide
1328378.52 1289432.88 1092682.37 4917229.63 54137.74 669089.54
N~1~-(5-Aminopentyl)-N~2~-(1H-indol-3-ylacetyl)-L-aspartamid...
7289976.96 9127200.89 5690187.49 11992321.78 36931.41 4787246.60
N(1)-acetylspermidine
3057231.61 2644367.64 3243607.28 20061522.91 602536.84 4409648.58
N-(1H-Indol-3-ylcarbonyl)glycine
3658106.94 3137706.12 3883092.04 14133037.67 92650.46 3165100.14
N-(1H-Pyrrol-2-ylcarbonyl)glycine
45495489.01 29872004.01 42892421.56 78435583.51 212498.80 41125273.18
N-[(1R,5S)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl]-2-oxo-2,3-d...
6483281.57 7355159.00 3981917.87 4837208.95 247993.35 1994941.40
N-[(1S)-1-Carboxy-2-methylpropyl]-D-glutamic acid
3163570.65 7165808.17 4547507.84 21445344.64 75017.93 2921410.64
N-(2,3,4-Trimethoxybenzoyl)glycine
301072.07 394364.51 700115.51 2440469.04 26997.71 173927.11
N-[2-(4,6-Dihydroxy-5-methoxy-1H-indol-3-yl)ethyl]acetamide
648859.35 625571.94 585512.17 4948943.50 260893.36 375850.47
N-(2,4-Dihydroxy-5-methoxybenzoyl)glycine
7591006.16 5964600.22 7334237.56 8064346.90 58935.47 3875045.03
N-(2,6-Diaminohexanoyl)glutamine
13287720.31 20424111.26 6988415.80 666180.47 33384.50 4027856.10
N-(2-Acetylphenyl)formamide
5328756.22 4491926.56 4779161.65 10651071.03 153135.50 3387590.78
N~2~-(Carboxymethyl)arginine
11550458.83 11591773.41 9331460.95 39800285.85 58521.54 5933943.37
N2-Dimethylguanosine
83776930.53 83533018.55 90848231.47 336755359.34 36482.25 67075261.89
N-(2-Methoxybenzoyl)glycine
11061877.53 14442364.00 12276107.56 41649757.06 57308.51 9401674.36
N-[(2S)-2-Hydroxypropanoyl]-L-leucine
9937452.85 9101007.69 9233533.09 26785286.15 340926.60 7385130.97
N-[(2S)-2-Hydroxypropanoyl]-L-tryptophan
2313374.45 2016982.16 2627120.30 8729121.21 35153.22 1474329.02
N-[(2S)-2-Hydroxypropanoyl]methionine
40239519.95 37016355.32 34666136.83 110411702.80 92402.95 23971274.77
N(2)-succinyl-L-glutamic acid
4082802.70 3828431.48 3952725.03 2979526.91 45468.36 3914255.42
N2-Succinyl-L-glutamic acid 5-semialdehyde
24735861.24 25102766.29 21460633.07 20554032.58 200928.42 18552283.01
N-{3-[(4-Acetamidobutyl)amino]propyl}acetamide
35140211.26 28432608.68 29969953.29 96657824.61 88929.77 16883357.01
N-(3-acetamidopropyl)pyrrolidin-2-one
2759590.11 2253264.55 1997609.08 8128249.21 390460.80 1397266.94
N-(3-Aminopropyl)-3-(3,4-dihydroxyphenyl)propanamide
1542580.38 1379848.21 1127656.96 2586367.09 64103.90 393929.55
N-[3-Carboxy-2-(carboxymethyl)-2-hydroxypropanoyl]glutamic a...
6247791.07 6196973.02 8526548.07 10768463.26 126732.00 8614299.77
N-(3-Carboxypropanoyl)-5-hydroxynorvaline
6270852.95 5031798.13 4790177.63 12953854.37 43884.74 3488805.04
N-(3-Carboxypropyl)glutamine
76523817.88 53242156.26 41329061.37 151001688.65 62313.29 20618177.99
N-[(3E)-3-Nonenoyl]glycine
3499831.21 5559599.39 3764899.16 13499962.17 131878.51 3332252.78
N-[(3-Hydroxy-4,7,7-trimethylbicyclo[2.2.1]hept-2-yl)carbamo...
1196529.97 779752.04 1154529.17 3239751.00 34382.90 534012.95
N-(3-Hydroxy-4-methoxybenzoyl)glycine
1707566.42 1677272.56 1887089.15 10332802.50 178147.21 2698879.53
N-(3-Hydroxyhexanoyl)glycine
9962325.89 11628486.87 10719592.30 18307349.93 124920.81 7673609.12
N-(3-Methoxybenzoyl)glycine
9478974.36 7768211.85 8939321.87 32236933.99 113980.41 4832720.71
N3,N4-Dimethyl-L-arginine
70391544.17 60941733.88 86740343.44 228823102.28 99568.44 79225936.52
N-[(3S,3aS,8S,9S,9aS,9bS)-3,5a,9-Trimethyl-2-oxododecahydron...
5427505.92 6446547.12 5468142.67 24101991.32 187382.33 3444623.89
N4-Acetylcytidine
206984767.98 205894786.37 242490459.78 946414584.09 135184.25 184332090.62
N-(4-Aminobutyl)-3-(4-hydroxy-3-methoxyphenyl)-2-oxiranecarb...
3645301.42 3616258.97 3970868.60 18212581.05 30804.57 2873726.62
N-4-hydroxyphenylacetylglutamic acid
6083162.72 6158766.16 5954257.88 17098630.94 28847.90 4570228.00
N-(4-Methoxybenzyl)-3-{[5-(2-methyl-2-propanyl)-1,2-oxazol-3...
20770144.83 12949426.66 22429083.93 43407508.83 37969.13 9560260.85
N-(4-Methyl-5-oxo-4,5-dihydro[1,2]dithiolo[4,3-b]pyrrol-6-yl...
735374.41 1412875.09 1090678.91 19893602.40 29751.15 1144974.18
N-(4-Oxobutyl)-L-glutamine
775911.68 583665.55 900119.76 3732697.47 160777.10 467618.61
N5-(4-chlorobenzoyl)-4-methyl-4,5,6,7-tetrahydrothieno[3,2-c...
2299985.00 2326539.84 2526602.11 2042691.47 4091054.93 23080445.44
N-[(5E)-2-Hydroxy-5-octenoyl]glycine
10315867.06 7043002.22 8561150.71 33460704.89 206124.75 5840094.93
N-[(5E)-5-Nonenoyl]glycine
3152466.89 3783805.59 2632953.59 21429889.83 151411.44 3332252.78
N-[(5-Hydroxy-1H-indol-3-yl)acetyl]glycine
5616606.66 13864375.49 6510904.29 51969482.44 146888.47 10380141.99
N-[(5S)-5-Amino-5-carboxypentanoyl]cysteinyl-D-valine
5319930.44 4181374.90 5487966.78 18583731.16 38447.85 4128032.00
N6-(2-(1H-imidazol-4-yl)ethyl)lysine
1866985.34 1194822.03 1254356.93 745179.80 33061.46 374510.57
N~6~-Acetyl-5-hydroxylysine
8395425.38 11913117.21 7178310.15 29117807.55 127754.84 1923459.07
N6-Dimethyladenosine
2835591.96 2581179.51 2939320.18 6323710.61 27192.61 1756676.18
N6-Me-Adenosine
552299155.64 453978426.46 519116664.86 1629885818.70 227924.82 408213414.56
N~6~,N~6~-Dimethyllysine
2345465.29 2259281.35 2293784.31 10769163.72 90097.80 1493591.28
N6-threonylcarbamoyladenosine
224889258.53 214928558.11 225214894.17 734471961.90 94795.86 174902027.96
N8-Acetylspermidine
117399212.46 92586457.10 124004307.38 313882516.24 45573.58 128635670.40
Na-{[(2R)-1-(4-morpholinylcarbonyl)-2-piperazinyl]carbonyl}-...
2037681.01 2131602.50 2526165.42 13032270.55 1260144.46 3381900.57
N-Acetyl-5-aminosalicylic acid
13034481.36 9984382.71 12520166.54 21116453.14 27525.66 7369560.54
N-Acetyl-6-oxo-L-norleucine
300738917.53 285184041.63 319649806.52 380971938.91 1092459.36 379439746.08
N-acetyl-9-O-acetylneuraminic acid
3626599.56 5538194.29 3603450.24 5583901.59 51634.73 5044264.45
N-Acetyl-ala-ala-ala-methylester
58162556.24 66299068.39 54222238.59 76195411.02 163936.76 33327863.72
N-Acetyl-D-quinovosamine
12009407.80 10053943.47 14512960.76 20088080.36 114267.59 10625148.07
N-Acetylhistamine
283796718.85 221789411.63 307377585.80 673416637.13 421958.26 215537929.18
N-Acetylimidoquinone
92563367.19 79882224.54 107705771.60 305181643.15 341206.68 109613569.06
N-Acetyl-L-aspartic acid
26874947.93 28249609.81 28510405.07 23572338.28 1071375.46 22846729.37
N-Acetyl-L-carnosine
154430895.14 129592359.01 164172727.30 471263087.76 203535.20 151746702.50
N-Acetyl-L-cysteine
3153418.46 2117230.62 3521128.32 10539647.01 60879.19 1894184.09
N-Acetylleucylleucine
3928685.19 3415857.82 3475662.60 20193207.98 32937.78 2979879.70
N-Acetyl-L-glutamic acid
24245965.40 22187256.29 25195119.62 20534754.54 114021.22 26932378.42
N-Acetyl-L-histidine
159207735.40 167382360.84 180671132.78 253135789.03 398968.96 164025703.78
N-acetyl-LL-2,6-diaminopimelic acid
169990859.81 134069763.79 190001415.31 127491115.39 230890.37 180521347.98
N-Acetyl-L-leucine
537317370.53 486882388.54 520061957.41 1468803378.21 626599.59 341466041.52
N-Acetyl-L-phenylalanine
1179716.84 1187616.92 1016759.49 5020333.84 82591.09 989586.81
N-Acetyl-L-tyrosine
8381361.37 7793120.55 8807560.67 18186027.51 222880.67 5857448.23
N-acetyl-N-hydroxy-L-ornithine
409221651.72 695833546.48 318769723.51 585984794.49 615349.06 339595344.68
N-Acetylnorvaline
294592187.52 231970232.62 347292208.74 1285649335.29 1027026.91 249826387.84
N-Acetyl-S-2-hydroxyethyl-L-cysteine
109542186.83 118108833.84 150928834.42 303051533.86 185749.03 94672594.86
N-Acetylserotonin
2517719.95 2220402.24 2797501.97 7048771.01 78126.22 5656078.32
N-Acetyl-serotonin glucuronide
30515886.86 30761526.11 28436868.80 90311626.78 32282.14 19096616.28
N-Acetyl-Trp-OH
6937863.91 6900831.87 6417727.86 14323666.53 104775.76 4911594.07
N-Acetyltyramine
49407822.11 30076023.48 41253785.39 363926109.08 136561.51 66151578.95
N-Acetylvaline
436580863.48 351971242.92 493492990.01 1406942345.94 866054.95 325136387.58
N-Acetylvanilalanine
6854511.28 6101529.79 6711628.42 19650533.86 68933.13 4868574.24
N-adenylyl-L-phenylalanine
1844906.93 1985901.35 1741645.52 6100521.00 39349.04 1211388.39
Nadolol
19542468.68 23840295.93 21031132.49 115558642.94 37981.30 17950485.66
Naltrexone
811872.90 600140.62 1576446.65 4210377.50 157607.98 592716.51
N-Amidino-L-glutamate
67713871.98 63759005.60 69451099.52 98414839.60 547863.33 81423531.48
n-Amylbenzene
5463272.36 5487752.38 3880347.98 5475028.57 169988.89 2454860.57
Nandrolone
749015.54 823982.90 795915.46 2984530.48 105490.99 516300.01
napropamide-M
6856555.23 6270300.87 6521569.73 16619853.27 104931.83 3634875.63
Naringenin
659911.75 1366661.57 400918.81 425874.43 39619.96 252611.36
N-(Carboxyacetyl)phenylalanine
25820198.68 25123177.82 31973692.29 110044005.33 62448.36 24225699.77
N-(Carboxymethyl)norleucine
17955345.59 14487226.22 18863954.36 42571954.73 109185.61 9840256.72
Ne-Acetyllysine
22911602.74 19979157.28 30986590.84 102464414.74 184737.03 21572771.93
nequinate
11603486.89 8844138.54 11186444.04 21658933.27 75488.52 7177625.64
N-glycoloyl-D-mannosaminolactone
7894175.42 7832335.81 8703763.30 58912919.69 33298.05 8979607.83
N-Glycolylneuraminic acid
14132765.47 14029258.74 14559122.00 53099267.68 30393.68 12394970.65
n-heptanoic acid
32428469.39 25989678.46 25468838.24 85855055.34 6360596.32 16201106.03
n-Hexanamide
103158667.52 92868407.86 95827585.14 218642538.58 623181.50 73847361.65
N-Hexanoyl-1-(2,3,4,5,6-pentahydroxycyclohexyl)tryptophan
749318.39 679033.43 777375.12 4995340.13 28112.18 686706.29
N-Hydroxy-8-(methylsulfanyl)octanethioamide
3088827.04 2633736.05 3524865.09 25594706.88 36571.40 2203817.06
NI3400000
23923629.21 17162651.07 17929865.45 50508168.81 618453.96 17111193.52
nicotianamine
15585058.63 14052299.88 16037361.49 60011464.21 66752.58 15073360.78
Nicotinamide
297790514.45 236160600.61 343701916.50 628712855.01 3924999.45 747451025.46
Nicotinic acid
92816404.45 100326800.21 155285912.06 112710263.72 474560.31 85967084.45
Nicotinuric acid
1861327843.50 1958972623.60 1720455061.70 5679907356.10 1246160.02 1282271069.40
N-(indol-3-ylacetyl)glutamine
10554187.96 13564416.14 8880112.34 46122974.86 65661.24 8765111.26
Nitrendipine
1544378.11 1660387.16 1590876.25 4462934.79 30520.53 1558831.24
nitrilotriacetic acid
10821240.86 7634750.08 11550835.63 4354056.30 69794.70 9984544.98
Nitrosoguvacoline
69127213.18 39706995.19 55541800.69 73228705.31 2251334.69 22486322.23
NJ5000000
6600834.18 8233833.29 6879386.66 111503823.14 302662.61 30295021.13
NL8513000
9328376.92 557205.91 10047808.03 769677.17 233383.49 596686.00
N-Methylcaprolactam
12842175.94 4506852.19 15050798.21 3080185.53 5473242.57 12766979.75
N-Methylglutamine
16106672.61 15119318.25 17640220.32 96197408.01 620294.37 30306771.70
N-Methylhexanamide
18519206.92 26763541.23 11943937.13 21840640.95 83141.10 5051027.26
N-Methylhistamine
138038634.18 88717615.69 143368459.78 186307598.64 1766969.63 138848205.96
N-Methylmescaline
5606347.64 5643894.05 7046284.32 51611114.14 423447.68 6414414.91
N-Methylpyrrolidone
3103551.46 3102847.33 5733879.65 62154041.99 727106.87 10937099.57
N,N-Bis(2-hydroxyethyl)dodecanamide
1258404.17 1001847.38 1155024.19 5234525.26 44423.83 795377.44
N,N^-Di(2,3-butadien-1-yl)-1,4-butanediamine
5242482.43 4500350.31 4218250.58 14737217.80 33872.70 1347658.58
N,N-Diethyl-4-methyl-1-piperazinecarboxamide 4-oxide
1509925.79 2860681.18 782630.53 799285.19 34004.33 345722.41
N,N-Diethylethanolamine
1856805371.30 1620737133.00 2021614284.59 2124483586.87 1642756.61 1094586267.00
N,N^-Diethylthiourea
45105062.34 22369488.93 129105034.55 54919129.91 78378.55 7337500.83
N,N-Diisopropylethylamine (DIPEA)
44922186.73 48865991.97 44322575.35 6221356.25 830219.39 23752221.92
N,N-dimethylarginine
18828623.77 14146532.39 16016549.39 40775550.33 667894.96 11123087.21
N,N-Dimethylglycine
339525194.56 316857060.17 287350111.37 161870892.23 8604181.27 402358250.00
N-Nonanoylglycine
4523266.07 3572157.43 5503751.28 2991345.22 1496772.44 3388819.75
Nopaline
12493901.11 10222798.47 5868931.04 76791340.80 211463.46 12272458.35
noradrenaline
4212467.15 3084970.98 4241310.76 13850106.06 377453.29 2624879.27
Nordefrin
11916580.74 12847321.45 11930388.72 46133056.00 292859.41 11164247.00
norketamine
19289276.70 38401285.67 88767118.31 396899605.03 41503.07 43015121.38
NP-000124
10858794.60 9382396.87 12929124.49 29637285.42 363742.85 6344085.28
NP-001346
36061370.89 29204454.12 39102986.66 149119314.96 33823.04 35879302.57
NP-001445
2011090.09 2589981.70 1119784.88 1088659.71 97897.78 423686.69
NP-001501
1094233.61 1625116.99 1094763.68 5547046.93 31381.00 1018508.70
NP-002854
9383961.03 8858622.07 10357213.20 15183098.34 7044328.63 10302061.21
NP-002855
7539511.63 7332923.69 10204234.40 5749993.24 3230837.38 9417203.21
NP-003399
20624002.71 10788246.46 15570416.31 13773367.54 71012.93 6873929.65
NP-003459
24425999.69 18057531.47 32524525.49 12201435.86 9477703.81 11681515.62
NP-003672
27737979.72 21106505.84 13518047.10 13932143.39 88726.11 14744000.72
NP-004036
4437763.00 5271231.99 3388708.56 8069750.07 157971.51 2108446.12
NP-004038
4134431.51 3984758.09 2553761.62 1403625.06 313002.51 1191152.76
NP-005397
3856258.27 4922396.60 2828090.01 1827891.78 218465.19 979980.44
NP-005519
7878278.52 3829172.45 6695910.58 10880927.84 483057.10 1885758.27
NP-005982
8267844.88 10266874.69 7823860.19 9234832.09 74057.39 4419942.40
NP-006656
5971069.90 4711953.41 3267841.22 12378016.31 315472.30 2490415.69
NP-006862
14164388.96 14994949.11 8987264.43 2886698.86 112484.35 8620110.62
NP-007065
6806008.45 4969234.76 5297575.81 11040521.22 2543689.87 4085802.89
NP-008095
8882526.72 4830965.90 12094558.86 2786119.63 3866345.19 7485212.09
NP-008952
3449494.76 2806943.38 3020438.03 8376667.47 478479.53 2234531.83
NP-008993
3202225.44 1277534.70 4457549.55 1272858.16 1166598.10 1516185.97
NP-011220
8068580.58 8150519.61 8017667.28 13138913.66 54243.39 4395672.41
NP-011223
19206726.16 18267931.57 15323319.37 28734102.76 790817.96 9652416.32
NP-011878
4098535.66 4485789.15 4402977.53 8627753.57 393774.10 2938371.33
NP-013210
1532662.90 1505031.19 1612941.18 5645119.96 48566.15 872997.04
NP-013538
18864065.81 16817950.77 22112266.40 21300459.37 1416965.85 31357243.82
NP-013663
26367798.18 27903937.60 20213269.43 26757677.74 225668.85 11115427.79
NP-014175
2995021.65 2339147.47 2450539.48 553060.67 193492.59 1667409.02
NP-014287
2002702.93 667386.57 2503862.14 9790955.73 264099.79 4435404.44
NP-016101
9660645.99 15007890.43 8756606.44 10214069.05 36410.82 5547866.97
NP-016455
35505131.11 27888809.60 44065252.19 79167163.85 402352.63 26778299.20
NP-016714
3997551.59 3231553.75 5255024.47 6526621.59 108826.43 1918598.59
NP-017061
693835.63 1729612.30 574893.21 1450905.84 34467.38 293224.72
NP-017379
332251.20 657116.77 986752.26 1555253.86 38625.01 194916.89
NP-018348
146403.14 131620.36 151566.04 2925273.89 30091.48 173347.21
NP-018661
74178601.84 54299227.14 53064053.04 50745514.39 671089.36 23509015.98
NP-019360
18173747.91 16487104.35 20028930.47 36291571.98 1123483.32 11723592.49
NP-019374
296794822.09 239306966.28 253733949.76 202584684.82 1499665.04 174030992.74
NP-019722
32503965.14 41688708.10 33525686.50 47095535.24 425041.62 35916474.10
NP-019811
12224042.42 10610018.63 14124146.34 36943534.29 293456.29 8027286.01
NP-020014
4632022.04 3996074.31 5506694.82 11462925.82 83666.24 3764209.11
NP-020082
84281437.38 70034447.69 97231208.99 159511075.35 2246423.10 63226091.04
NP-020155
10043523.74 7644357.37 10537536.17 32257022.43 214680.65 2385724.70
NP-020214
3754252.20 1165289.26 3917621.18 1702089.35 1473804.76 3182522.91
NP-020515
8983694.62 5222056.90 10900545.35 7618815.40 1595915.85 3214373.15
NP-020632
122821.75 124770.72 159193.42 1457748.51 58118.41 200923.43
NP-021018
5123797.19 4821393.70 4269398.84 20241500.02 950118.18 3635154.81
NP-021844
6728343.24 6787443.80 2570930.49 5906890.65 700658.37 2072941.33
NP-022531
5501251.83 7552830.60 5348908.33 6459711.61 70028.02 3061472.96
N-Pentacosanoylglycine
102412.89 106789.77 106436.16 103597.94 116661.11 9990329.20
N-pentylpantothenamide
3389508.01 2291434.21 3152906.99 4583821.25 90438.00 717435.23
N-Phenylacetylglutamic acid
11014164.44 10541203.51 10636680.08 22668817.23 32164.05 7221654.17
N-Phenylacetylglutamine
74993777.77 83457417.52 77381086.89 409618073.63 435851.64 91974346.71
N-Phenyl-beta-D-glucopyranosylamine
6117448.81 6104921.05 6681031.25 12450219.39 62726.26 3274924.87
N-Propanoylimidazole
6780697.61 5129247.68 6146309.24 22761389.94 1155021.40 4712765.17
N-Propionylmethionine
5824413.67 5539243.58 5344109.03 16174171.85 85447.97 3169745.42
n-Ribosylhistidine
17455771.86 18586221.39 17874834.11 29263924.38 171728.26 20306285.58
NS1800000
16855358.17 23612122.93 9653956.42 47361795.60 888117.58 4760217.04
N-Stearoyltyrosine
1097962.19 868149.21 889659.58 1369489.85 377095.20 161064880.96
N-Sulfanilyl-3,4-xylamide
746907.34 585913.58 1039283.97 1149504.61 54182.18 303086.56
N(tau)-Methyl-L-histidine
161371939.15 143641886.38 178073488.98 1116871523.25 739589.07 115842398.10
N-(tert-Butoxycarbonyl)-L-leucine
346795889.22 413122251.64 438687517.60 3398109574.70 182707.65 615681668.14
nylon cyclic dimer
5044070.59 4845348.05 1625315.11 4117905.40 1432335.63 2104552.17
Obliquine
1835890.92 1415550.01 1003148.16 1867704.28 1070378.02 549911.62
octadiene
6758823.09 5175993.61 7447142.25 3848875.25 6002938.80 8785691.40
ophthalmic acid
4899324.27 3321531.66 3475536.84 9945135.15 201595.96 3198112.79
ornithinoalanine
506611637.14 481270167.41 599457675.10 2390103394.10 734644.74 456513766.48
Osthol
1213099.18 2926409.00 2418452.93 14553060.41 53911.72 3996042.80
ostruthin
3632322.20 5721959.51 2884210.29 683701.46 52502.81 1291337.49
Otonecine
72455498.96 79405653.53 91096704.04 288359880.37 106480.61 81486805.30
Oxaceprol
3359201.90 3679557.40 3208977.13 23004301.70 149529.68 4160683.28
Oxalosuccinic acid
39751370.54 27973883.12 38855303.16 10094450.80 96061.12 13578195.19
oxamniquine
45972417.62 37576952.97 34798052.94 91217553.11 137211.37 14964919.18
Oxepanone
123497309.75 116719477.91 128467323.36 280393570.07 3141811.60 86113133.05
Oxindole
3434686.63 4219411.52 3030638.12 20528441.01 1091289.39 8731753.70
Oxohongdenafil
3676571.88 3109935.46 5462679.23 11251491.27 1030735.67 3166462.93
Palmitoleic acid
9358572.27 4233256.59 12076519.64 3973230.09 5214017.39 9867503.69
Panthenol
10057707.60 5434691.27 9317224.77 13055634.75 2167350.20 5021709.23
Panthenyl ethyl ether
130770422.25 93327553.01 195988195.91 144671198.17 357362.71 1255543.11
Paprazine
2561100.46 2436212.36 2814665.97 8947934.07 61830.00 2230324.82
Paracetamol
15876635.76 14402390.39 13075392.11 41744490.38 170220.43 12978168.44
p-Benzoquinone, methoxy
3316193.61 2574702.61 2869440.36 2884463.87 107545.05 1352814.37
PEG-4
105153976.04 68030879.86 95884778.66 147459068.80 47730700.13 156961079.44
PEG n10
7782205.72 6628893.45 9705441.01 48441434.35 2738510.11 8298139.75
PEG n11
4390742.91 3788606.92 5040372.38 23765241.52 1809197.03 4330138.78
PEG n12
6717438.91 5350392.66 6815270.45 21284624.95 1881170.29 5867046.47
PEG n13
1521786.89 1288234.47 1551247.63 6611221.27 670797.68 1560725.88
PEG n6
75041654.75 42139852.82 63362217.00 178406681.60 18011779.16 57391083.61
PEG n7
54108855.66 39806093.21 60619066.15 201063445.61 14174376.83 49792737.01
PEG n8
43025770.55 35047710.37 55806407.71 175280957.75 10661184.42 39780932.72
Pelubiprofen
1275693.68 1154075.63 1514321.54 3004821.17 65015.54 575722.12
PENICILLIC ACID
18082077.85 16957686.64 19896149.35 50112256.85 910057.52 12776118.34
pentabamate
25297779.14 27514710.83 44395355.47 43172365.40 247856.28 25342302.36
Pentifylline
20996057.00 16614742.18 23910667.83 118252741.24 476919.55 18914039.33
pentobarbital
1848303.17 1614707.07 2115181.96 5447557.45 60377.46 1382752.06
pentoxyl
177870066.72 169574156.79 184976990.16 229780163.83 1577639.81 167648780.98
Perazine
4910774.19 3455746.66 2387957.75 575891.26 1739362.48 650999.36
perlolyrine
18558894.20 18548353.19 19591546.60 33513934.98 81161.14 11177427.82
phe-asn
3147993.03 2932079.29 3599126.91 5931603.69 42185.22 3731220.69
phe-asp
16549401.87 17337344.45 20176696.16 29185874.16 54963.83 15105912.82
phe-cys
2055579.26 1469734.19 2214493.62 5145257.80 28761.30 1573983.49
phe-lys
68053071.25 54794414.23 52509224.98 110650233.36 36427.90 26609872.64
phenacemide
9736156.49 4714659.42 8520290.93 87862816.57 72960.23 16273849.58
Phenethylamine
23806900.79 110177878.22 22020629.06 188050128.44 83798.35 14970568.80
Pheneturide
4045494.36 3316675.33 5006564.10 17067785.12 82745.38 3371991.64
Phenothrin
1245193.09 947349.04 803895.94 642849.10 29499.72 382994.55
Phenylacetylglycine
8113857713.80 8384613167.80 8816387961.50 30131045425.70 4118953.50 9184440432.40
PHENYLBUTYRIC ACID
7248241.01 5317603.65 7421466.11 17625157.08 854950.47 5516856.92
Phenylisocyanate
228421339.84 183561475.07 211756556.10 695551894.98 177234.13 156577760.64
phenylpropiolic acid
3861291.07 4996109.29 6975846.80 1938579.01 5859805.79 16729551.01
Phenytoin
7826535.22 35731128.43 9693050.96 49880598.81 27030.15 642746.33
Phosphoric acid
47101801.91 47033461.54 54414810.22 108066184.60 8159167.81 218437863.10
Phthaldialdehyde
4571667.19 3856405.68 4236251.91 2575824.26 2105219.64 2470741.35
Phthalic acid
76132526.73 84463311.17 78921385.44 105037941.51 2947502.59 210395841.32
p-Hydroxybenzalacetone
4705006.23 4019583.26 5712259.38 13715763.20 218627.34 2809819.37
Phytosphingosine
328264.27 213068.44 118918.32 784314.14 142456.56 17833009.48
Piceid
312640.78 489699.59 864765.07 2656611.04 74313.30 414353.79
Picolinamide
36869769.36 22191230.47 52018171.54 177452042.81 2363573.71 46383615.71
Picolinic acid
13114368.90 13603899.41 11924857.17 37937694.51 594888.92 8651873.01
pilocarpidine
5579068.55 5449787.72 6594199.78 3949106.59 2921321.10 11436911.89
Pinocembrin
52126137.35 11011538.98 18223720.72 53599308.69 65467.75 15333511.43
Pipecolic acid
2084525363.60 2230901519.90 2314240100.50 6710681490.50 3516059.35 2211463136.40
Piperidione
1872116.49 1657182.02 2462559.65 9068542.52 89786.34 1429948.82
Piperonylonitrile
603521.17 1160923.39 875895.63 17697412.06 667338.41 3094724.65
Piracetam
141693174.40 120785078.84 153249758.31 362070074.79 3046380.04 159739415.40
Pivagabine
15799072.53 14704339.80 18612000.58 18937832.31 11729663.80 15131942.44
PIVOPRIL
4277386.24 4490049.85 4337966.98 22123712.31 185244.98 3449583.75
Plantamajoside
5109657.04 4418686.37 4910736.76 10111483.08 37474.74 3257523.22
Pleuromutilin
111815.58 107069.75 290325.49 2737207.09 69848.52 1266389.53
PLH
8996862.94 5920053.25 7953498.80 5075772.91 77471.90 2345327.31
porfiromycin
2590281.54 2119350.43 1963378.58 5024701.12 31042.47 1309374.07
Portulacaxanthin III
50146171.44 47762119.30 54921034.61 76269281.79 41969.83 32364141.63
PPG n4
3739216.42 3632887.45 3733677.20 7933875.17 2056515.39 4804966.16
PPK
3326199.93 2288130.20 4207917.34 880450.15 36103.29 630192.99
Pramiracetam
3734671.78 11992945.21 4346866.31 5002994.59 76432.12 1460520.53
Pregabalin
1939391.25 2809169.31 957633.23 4867783.62 34854.30 1011316.05
Prenisteine
1890662.68 1648843.14 1805858.16 3472309.95 75826.55 1065133.87
pretyrosine
9544106.76 9861221.41 8804139.49 19012235.13 105933.47 9799536.57
pro-asn
5281367.20 5104427.55 6214646.02 17414289.96 86301.05 4980290.17
Proclavaminic acid
37805206.62 37725351.34 44021307.42 43052833.10 311092.90 30688228.67
pro-gln
11343364.99 12758211.13 15539157.30 18134650.68 112348.56 13387268.76
Pro-Hyp
296894722.10 286339162.09 321993363.11 395619592.78 690674.53 382658908.04
Prolylglycine
392142412.77 380194455.96 482356270.20 576113566.63 667539.94 403788407.64
Prolylleucine
556459335.09 654613016.36 581064500.14 508440548.25 340073.33 561541508.70
pro-phe
566797560.32 553147936.56 545810910.46 1679687385.70 236843.18 469132990.46
Pro-Pro
54933984.32 40092287.75 59744642.93 215254312.78 74927.44 39562984.02
Propylparaben
3819243.47 3565497.81 4011671.04 9137459.39 312619.94 1944264.39
pro-trp
110823287.92 103667205.83 103695561.46 450129121.46 1274461.65 67984929.22
Pro-tyr
539286136.30 511274837.60 603422408.33 2406078959.20 67728.98 408795255.80
Proxyphylline
6615244.13 2890956.57 6849905.63 48188325.00 108938.86 8447411.47
Prunin
2880978.02 6067266.82 1390465.19 365904.56 37386.33 969484.86
Pseudoconhydrine
1611352.79 1511425.41 927036.99 629826.89 66552.49 389803.05
Purinol
4937361.92 4209481.86 5657641.59 12335583.23 36817.03 2801994.74
Putrescine
48255887.82 44531845.18 43696405.45 44272872.88 25265246.04 29334128.65
Pyridoxal
12881159.47 25800352.66 20303142.60 59808447.18 300138.76 26043128.48
PYRIDOXAMINE
3111988.90 2463343.11 2710845.47 6582428.39 194309.11 1347968.13
Pyridoxine
152026264.62 134596024.75 140563494.78 288161004.85 432989.14 85674419.89
Pyroglutamic acid
15473265.56 14891411.99 15086936.52 43473349.38 775559.33 12573302.08
pyroglutamine
12996659.73 19050842.58 14102829.11 8565721.53 969397.38 13450818.89
pyroglutamylglycine
85449134.31 56180379.68 77302332.40 189123496.38 392782.56 70201400.14
Pyrrole-2-carboxylic acid
13532020.60 11741898.54 14330245.42 24359238.40 257288.83 10193988.23
QLH
970964.28 1586282.77 673306.15 12115771.99 52448.49 1531174.12
Quinaprilat
775786.86 620722.00 677242.81 2609884.96 31922.14 476820.45
quinbolone
2183258.58 926051.01 2472459.00 20021030.32 101962.01 3391617.44
Quinolacetic acid
3183681.37 3782341.59 3757175.80 2491223.86 190087.07 1328574.89
Quinolinic acid
19932131.24 21931037.55 22932723.63 36935659.43 151148.56 32501915.70
QV1MVO1R
315096124.70 331858468.37 317744937.56 1127986516.02 221097.34 330783247.42
Resacetophenone
3162667.11 2874576.80 3207638.19 11867163.91 528089.65 1766962.27
Resorcinol diglycidyl ether
5158584.17 2035813.04 5633805.67 6689007.16 191916.56 1753596.17
RG5927903
272441.43 270560.50 231641.43 2238588.32 73318.37 582519.67
RG7900000
4223336.54 2609364.62 4825529.96 2521526.49 2525205.66 16189540.76
RI2735000
30577078.32 35042186.25 21252244.05 12669239.71 9827603.00 8707148.27
(+)-Riboflavin
66855637.70 32803516.26 74735784.67 50169768.39 98587.69 51238129.02
riboprine
889991.32 621822.37 795977.25 5455221.76 207656.96 493324.85
Rilmenidine
3728358.67 3144048.26 3098428.89 8776666.49 111890.57 1352544.67
Ritodrine
1709282.00 2080442.57 2222016.30 3968220.65 141660.31 1095719.55
(R)-(+)-Kavain
25735652.84 14683840.96 39439099.01 45375289.75 84643.77 14763602.90
RLK
3684152.39 2382056.86 4118442.16 15865967.85 56326.24 3703244.79
Ro 20-1724
3473308.64 3747911.89 3692407.59 10847082.54 47035.01 6209973.07
(R)-Salsolinol
18140540.21 17203849.03 18243377.58 52787868.86 103477.05 36449018.73
R-Soterenol
763713.59 1046257.36 752566.54 6364627.54 32187.36 820468.14
S-3-oxodecanoyl cysteamine
8661027.83 8266826.25 8921331.55 48551194.48 112445.98 6233039.24
S-Adenosylhomocysteine
924472.56 960202.37 1015766.03 2537276.25 213552.08 157339139.32
Sakuranetin
2805847.94 7666985.54 2383684.93 6657107.75 71090.73 2182413.13
Salbutamol
407831.86 405226.96 406035.39 2260788.13 38791.67 181184.30
Salicylaldoxime
20857294.76 27482312.84 22945707.86 35821776.34 377273.56 25898319.27
Salicylic acid
13422389.18 12176686.58 13068732.60 25156326.60 163479.69 7703682.60
(-)-salinosporamide A
209965.30 227973.36 415620.73 4359170.88 61219.41 279429.14
(+)-Saxitoxin
7367751.01 7314703.01 6268831.79 11836548.54 57868.75 4613171.56
S-Benzyl-D-cysteine
5206977.94 4849673.15 5726474.58 21189906.93 92128.50 3940816.33
Sebacic acid
86735226.80 79789019.24 89674992.89 125795779.70 6279247.57 40634795.28
SECONAL
18557927.94 20041129.86 18721339.62 50922632.71 41635.94 12122096.95
Sedanolide
35452577.05 30811617.25 29663136.77 32773234.52 3849016.12 16571523.86
Senkyunolide A
5836305.44 5461329.43 6124628.98 14799167.21 660582.46 2473550.83
senkyunolide B
1843858.43 1988883.62 1354453.03 4189576.50 58738.75 1152640.46
Sepiapterin
6890089.45 4367472.57 9809178.51 33236493.47 28692.97 6453949.86
(S)-Equol
348445.64 415353.69 437722.68 4469522.12 48801.10 758416.71
ser-gln
949196.89 691801.96 1113550.41 1776235.09 25211.25 620592.06
Serotonin
78949521.69 62829854.69 70282819.77 444114744.58 1398248.29 49554041.94
ser-trp
4225235.56 4709903.25 4397989.19 5392350.64 62472.94 10797459.21
Seryl-4-hydroxyproline
26181022.14 23081640.92 32619895.14 61427533.24 288046.83 30296189.46
Seryllysine
17444412.89 16847596.08 17443526.09 54462280.35 47495.21 10435221.47
(-)-Shikimic acid
4732901.02 4575534.47 5085341.01 2846644.24 221302.67 3049120.76
Shogaol
6325453.22 10860295.07 4155969.00 3766071.62 66698.46 2442961.82
S-methyl D-thioglycerate
25719917.32 26372143.88 26467542.06 59316100.20 24042314.28 22555896.37
S-methylglutathione
621370.49 451358.77 520718.36 1332880.04 108604.84 12564909.34
Sodium [dodecanoyl(methyl)amino]acetate
376355.81 530976.97 1779381.63 866318.09 1817032.07 865928.45
SOLERONE
4068871.71 4572003.94 6667231.45 22578994.50 1009130.68 5622693.76
Sorbaldehyde
2518034.02 2329407.25 1461944.69 1235939.46 520111.10 915722.39
Sorbic acid
5086120.38 7312526.48 8565501.21 14211206.19 346399.57 8743669.94
Spermic acid
7299444.59 10498944.08 5918258.43 1512307.71 57728.31 4478908.70
spermidine
30175934.00 39940122.45 23804047.81 89653963.79 297023.17 6745839.59
sphinganine
223547.96 259234.92 200386.34 500378.59 283602.50 12135665.85
spinacine
5623313.34 4913380.78 5227739.14 4830010.81 143439.64 3002827.66
ß,ß-Dimethyl-?-methylene-?-butyrolactone
18596319.93 18591239.37 19100512.97 57600315.92 882580.24 16335490.78
Stearidonic acid
468267.73 226203.16 487272.82 2057971.30 131259.88 612837.74
Streptamine
10117785.86 8732372.10 10146789.18 34342012.98 546407.21 7435465.12
Styrene
13054154.35 7293223.21 11085911.81 7146594.44 2288368.30 6393235.86
Suberic acid
12653465.25 12104976.29 10525680.89 14345161.50 2632806.64 7491990.55
Succinic anhydride
39839914.33 27126228.91 31491924.39 14005407.76 2394499.04 42985242.42
Succinylacetone
38328468.50 31439454.48 40335861.80 75915475.43 641778.72 31437199.36
Succinyladenosine
289787237.15 247040656.25 282735886.54 738937367.72 55490.44 227096448.64
Sulcatol
99959714.85 44008876.82 121086009.86 43522794.85 82367374.30 306885916.10
Sulfacytine
4358683.54 4519389.24 4440769.17 16867474.90 41843.81 3011682.85
Sulfurol propionate
1531244.48 943265.09 1786216.15 5244539.14 188598.82 1059898.24
Supinine
2597621.03 5536175.21 3318786.04 27279861.33 46775.58 4246439.46
Syringaldehyde
500225.29 371095.25 774590.64 4530862.75 161084.74 356509.99
(+)-syringaresinol
18592600.82 9034315.25 16690201.42 7555629.64 5278940.77 7887153.33
Talarozole
507223.98 475276.19 570170.38 6042799.80 47068.24 419390.10
Taurine
182306053.59 175550059.14 147863515.84 223141714.04 833267.34 133202767.90
Taurocholic acid
4423155.13 1610939.75 7650344.63 30134988.49 272701.85 7919891.89
Tauropine
4826960.36 4612290.71 3951766.33 20767688.58 27117.85 3832254.20
Taxifolin
1245964.37 2119764.87 296041.13 215388.01 33016.13 294188.52
Tazanolast
30802030.25 24669590.87 33621786.44 56051311.28 38566.81 19695129.76
TCMDC-131928
2469817.95 1494756.03 2720160.05 9176662.19 40645.24 3535349.70
TCMDC-132036
1512662.78 135270.85 2332640.64 1014903.18 57900.76 111445.14
Tegaserod
15473079.89 12454297.55 15038959.38 5883081.03 5952458.36 11557932.67
Teneligliptin
323232.09 416748.58 351344.15 4629705.37 37661.86 500395.04
tert-Butyl N-[1-(aminocarbonyl)-3-methylbutyl]carbamate
2266601.88 1699919.77 2496883.54 26480856.95 39891.48 3488634.39
testolic acid
1876262.88 3319033.36 1329999.63 381604.12 143242.56 584516.12
Testosterone
915880.31 550416.30 307501.58 201959.27 73536.01 213283.50
Tetraacetylethylenediamine
10408658.47 10182823.80 11015467.65 33565774.34 133370.81 8273847.01
(+/-)-Tetrabenazine
750719.97 2898433.71 670439.48 959561.78 29877.72 368357.59
tetrahomomethionine
4390757.60 4087046.67 4587607.31 14464602.41 89446.99 2802574.53
tetrahydro-2,5-dimethyl-2H-pyranmethanol
8063137.85 5453005.72 9908501.22 7997822.77 6472749.23 33835774.03
Tetrahydro-5-oxo-2-furanacetic acid
158205535.12 146171162.26 211537958.57 105741306.83 18691436.88 379118659.40
tetrahydrocortisol
3300061.35 3163033.96 2514188.32 1396823.25 71832.49 599133.24
Tetrahydrocortisone
1852263.86 2101900.58 2253468.03 3986469.58 46354.24 1094110.04
Tetrahydrogestrinone
985084.13 830192.85 2019324.55 1140667.66 58036.25 569231.52
Tetralin
6841850.64 4658325.79 6251637.57 14335723.19 83640.46 4389405.99
Tetramethylpyrazine
32494813.57 29285164.52 28260493.98 53545403.93 90337.09 11873477.14
Tetramethylurea
221774952.95 91840254.36 396483543.55 243713027.17 184023.24 17082478.42
Tetranor-PGDM
6506285.21 7752873.84 5472318.79 19458091.70 759929.87 3478048.69
Theobromine
10706587.54 10368421.06 11291742.53 38067363.72 132516.28 9257220.25
Thiacremonone
49127807.12 40940789.84 51743394.55 55268844.69 444261.40 38113978.25
Thiethylperazine
755779.20 652971.69 799238.41 7082004.88 47012.21 1657992.68
Thiorphan
182605009.34 188295623.32 203043230.94 666427744.29 185562.73 137944722.74
Threonylleucine
139718.27 130282.52 139467.18 406261.66 36174.99 2470480.70
thr-ile
1908925.73 3466290.19 1922172.36 1276270.50 152831.15 441895.44
thr-pro
20934845.24 20200716.44 28010054.68 29944470.94 101061.29 19152437.91
THTA
90762823.76 71259267.79 78463109.01 169362831.45 621860.53 55963139.24
Thymidine
69602792.44 90685942.90 82591621.66 211527215.95 154392.35 67776850.12
Thymine
118929989.09 35414840.54 57268896.51 10681945.90 1358134.14 26930107.14
Timonacic
1632212.02 2299226.13 1951493.60 5781599.09 213361.36 766818.19
TLK
10095457.47 11839474.52 5938417.79 13014703.68 63297.65 6272734.65
TO0127900
3280601.24 2307112.60 2840651.50 6066421.97 255635.49 1387285.81
Tocainide
1019709.73 1048455.09 759341.64 3058130.73 46852.66 850466.21
tranexamic acid
17793356.84 16301726.68 14082404.11 31699584.50 215454.08 6938519.09
trans-3-Indoleacrylic acid
2833021014.70 2432825538.80 2498587091.79 4074688486.40 526366.78 1907836371.40
trans-Zeatin
9554292.57 8869317.82 10523279.18 19722352.05 132419.04 7739750.08
Traumatic Acid
7353112.41 6532277.30 7152264.25 13515756.06 233046.75 3917449.77
Traumatin
37023501.24 22155130.38 42143580.47 20143677.09 26815494.39 35604830.86
Triacetin
59197116.22 69801144.62 85128343.80 318771012.21 297254.81 73350334.15
Tributylamine
29441425.77 22326011.08 23336265.94 28784623.40 119453.38 102835.10
Trideca-1,3,5-triene-7,9,11-triyne
270906.96 1042345.92 1084690.93 5755855.06 36487.98 1002684.90
Triethyl citrate
5985151.70 7667898.60 6701173.07 31769645.69 1801208.85 5633677.78
trihomomethionine
21861346.20 28967105.18 19009655.75 49784973.42 126735.76 10682054.94
Triisopropanolamine
33334967.28 29695724.64 33210287.42 132119519.14 2261156.15 32592109.00
trimetozine
688430.76 816335.33 305695.74 1521856.44 25028.92 325608.95
Tris(2-butoxyethyl) phosphate
57336089.60 8595122.03 20050358.96 10628581.66 5957693.73 15194075.42
(+/-)-Tropinone
26646722.58 7706934.77 27895909.36 5953495.34 9369942.84 11768851.25
Troxipide
742122.42 654055.39 1109063.08 4131754.41 31190.07 538960.18
Tulipalin A
5588296.84 3135487.86 6937865.30 3252957.98 3055204.21 3676560.74
Tyramine
55418255.18 37520469.68 58795279.90 154752292.88 99416.27 31591940.14
tyramine sulfate
10848613.08 10627529.24 9926003.83 22261764.44 98726.64 6641891.55
Tyrosinamide
12437492.60 10086691.60 13270762.71 36650027.64 30779.92 8076658.52
tyr-thr
2878362.91 3778044.51 2681314.39 10294469.77 65794.01 2508892.14
U-69593
8067671.21 783474.94 8121040.53 1053239.67 197964.92 1514716.31
UNII:6S7S02945H
2398256.01 3958086.44 1069074.35 2231308.80 33416.93 523619.32
Uracil
36482325.64 35988884.15 38620246.35 21188812.33 672233.31 183195790.00
Ureidopropionic acid
74657822.85 43665260.14 58429981.91 110652300.26 1433840.73 40385581.14
Uric acid
288609189.24 263565847.48 297057776.89 197751075.47 434318.21 398464255.12
Urocanic acid
369406712.58 247014935.53 362653895.57 753505495.86 2850486.95 338191953.18
Urothion
28948120.26 29260518.07 28200909.28 75881319.53 36693.92 20690006.89
US1840000
142446006.79 91510065.26 147505861.64 118430820.75 1136693.26 142340073.24
Valaciclovir
7919768.79 6931439.73 8808264.57 38750743.84 334183.04 18312306.15
val-asn
487186487.93 738845800.70 543530050.71 1810791993.60 645033.29 290041189.87
Valclavam
6108931.63 4847573.89 6346116.04 25755698.64 107235.96 4741464.48
Valerophenone
1529948.28 1776654.58 1609712.37 2769838.84 165438.76 856463.81
Valine
1119652773.14 1188437695.98 1167964885.12 1253462169.31 9058719.89 3098452302.60
Val-Leu
41464007.46 48573217.38 52767986.01 18196744.74 57373.51 45646848.59
val-phe
817597.93 736342.52 1324244.50 38170283.70 65729.97 3769080.78
Val-pro
52759490.52 50600477.95 52962896.93 181102221.40 89673.34 39588292.92
Valpromide
1812713.38 1069693.61 7044856.97 4236334.15 157895.01 1523537.21
Val-Ser
11426551.19 10561792.91 10454975.54 31215132.67 137351.04 8674634.52
Valyl-4-hydroxyproline
3042186.22 3092347.27 1997141.96 18514959.96 207667.51 1397064.56
Valylglutamine
294127378.89 283888212.64 318603561.22 372487308.06 692621.77 377707894.50
Valylproline
140007103.80 152258652.84 176689594.86 394352066.99 315304.79 94271654.37
Valylvaline
122884372.21 121634466.70 124954634.78 328853598.00 101256.48 98672289.86
Vanillin
10333348.02 11994725.65 12443659.70 12582025.01 1416258.04 9146941.36
Vanillyl alcohol
82647781.58 81348072.96 87805890.22 111969476.92 1568284.82 55722101.40
vanillylamin
16776337.75 14522294.95 20333066.15 27996290.75 114853.90 11503895.19
Verimol J
9410836.04 10372861.51 9125320.47 30654370.97 2137697.02 4721138.78
Veronal
28413903.37 25202607.24 36710970.72 54282106.98 255383.74 26063114.39
Vigabatrin
9740158.56 7932193.67 11332778.17 172181455.93 1143015.64 10489359.92
Vinylbital
10125170.16 11995196.63 11890346.30 34170543.49 82626.53 14781563.60
Vitamin C
5578276.81 5929525.04 6202740.56 24744030.35 130922.50 7606067.57
VLH
10831300.39 6026970.54 5261506.48 352725082.16 16527812.05 11137520.04
Volkenin
34537471.00 31051267.24 34792145.81 89697057.63 105306.10 27736685.15
WKK
219239579.76 286854535.52 145316882.92 1689617620.94 230432.91 157387094.98
WMH
14418533.01 5473009.69 13263883.10 65423387.52 65788.93 11325242.51
Xanthine
61626142.13 60518694.72 68916122.23 53250289.79 111893.47 530088996.84
Xanthosine
4844734.63 4725930.24 5761504.39 4948635.18 101466.82 3370170.54
Xanthurenic acid
1076945704.15 974597504.14 1249990614.84 4682727438.30 164937.04 979713408.66
xanthurenic acid 8-O-sulfate
58633490.13 67340991.41 59088226.66 53167838.50 508428.23 38721612.40
YK6000000
7940476.04 7505894.62 9693737.78 31654408.63 1071807.75 6582780.66
YLK
3491112.47 2776175.17 3343178.63 3560083.79 38146.57 1573544.21
(Z)-1,3-Octadiene
7118878.21 7840782.72 3573209.21 7877786.33 624790.32 1146474.53
Zalcitabine
3496392426.50 3388938349.30 3596107314.40 8967463279.80 3329306.41 3230425689.20
zingerone
22617316.05 42720520.82 43555489.06 38811675.95 511132.12 13298516.49
Z-Maleylacetic acid
1282213.20 1237126.46 1282471.01 4154804.68 226189.26 891071.37
(Z)-N-[(2S)-2-Amino-1-hydroxy-3-(4-hydroxyphenyl)propylidene...
18674815.64 18237140.90 21655251.32 40847130.59 32279.23 17976440.84
(Z)-N-[(2S)-2-{(Z)-[(2S)-2-Amino-1-hydroxy-3-methylbutyliden...
1132719.85 698293.38 1339708.13 9378556.95 30205.31 158102.77
Zolmitriptan
36443398.10 18825018.20 30534959.54 1346976.07 33769.60 8194598.72

Factors:

F1Treatment:HS14 | Source:Urine | CF:Urine
F2Treatment:HS21 | Source:Urine | CF:Urine
F3Treatment:HS7 | Source:Urine | CF:Urine
F4Treatment:LS | Source:Urine | CF:Urine
F5Treatment:n/a | Source:n/a | CF:Cortex
F6Treatment:n/a | Source:n/a | CF:OM
F7Treatment:n/a | Source:n/a | CF:Urine
F8Treatment:n/a | Source:Urine Pool | CF:Urine
F9Treatment:Urine Pool | Source:Urine Pool | CF:Urine
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