 | | MRX | | Name: | 5-bromo-3-(pyrrolidin-1-ylsulfonyl)-1H-indole-2-carboxamide | | Formula: | C13 H14 Br N3 O3 S | | SMILES: | O=S(=O)(c2c1cc(Br)ccc1nc2C(=O)N)N3CCCC3 | | InChi: | InChI=1S/C13H14BrN3O3S/c14-8-3-4-10-9(7-8)12(11(16-10)13(15)18)21(19,20)17-5-1-2-6-17/h3-4,7,16H,1-2,5-6H2,(H2,15,18) | | Definition date: | 2007-11-08 | | Last modified: | 2011-06-04 | | Identifier: | 5-bromo-3-(pyrrolidin-1-ylsulfonyl)-1H-indole-2-carboxamide |
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 | | MSG | | Name: | 7-METHYL-6-THIO-GUANOSINE | | Formula: | C11 H15 N5 O4 S | | SMILES: | [S-]c3nc(nc1c3[n+](cn1C2OC(C(O)C2O)CO)C)N | | InChi: | InChI=1S/C11H15N5O4S/c1-15-3-16(8-5(15)9(21)14-11(12)13-8)10-7(19)6(18)4(2-17)20-10/h3-4,6-7,10,17-19H,2H2,1H3,(H2-,12,13,14,21)/t4-,6-,7-,10-/m1/s1 | | Definition date: | 2005-02-10 | | Last modified: | 2011-06-04 | | Identifier: | 2-amino-7-methyl-9-beta-D-ribofuranosyl-9H-purin-7-ium-6-thiolate |
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 | | MSM | | Name: | (METHYLSULFANYL)METHANE | | Formula: | C2 H6 S | | SMILES: | sulfanediyldimethane | | InChi: | InChI=1S/C2H6S/c1-3-2/h1-2H3 | | Definition date: | 2004-11-02 | | Last modified: | 2011-06-04 | | Identifier: | dimethyl sulfide |
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 | | MSN | | Name: | (1R,2R,3R,4S,5R)-4-AMINO-5-(METHYLTHIO)CYCLOPENTANE-1,2,3-TRIOL | | Formula: | C6 H13 N O3 S | | SMILES: | OC1C(O)C(N)C(SC)C1O | | InChi: | InChI=1S/C6H13NO3S/c1-11-6-2(7)3(8)4(9)5(6)10/h2-6,8-10H,7H2,1H3/t2-,3+,4+,5+,6+/m0/s1 | | Definition date: | 2005-12-28 | | Last modified: | 2011-06-04 | | Identifier: | (1R,2R,3R,4S,5R)-4-amino-5-(methylsulfanyl)cyclopentane-1,2,3-triol |
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 | | MSP | | Name: | 5'-O-[(L-METHIONYL)-SULPHAMOYL]ADENOSINE | | Formula: | C15 H25 N7 O7 S2 | | SMILES: | O=C(NS(=O)(=O)OCC3OC(N2C=NC1=C(N)NC=NC12)C(O)C3O)C(N)CCSC | | InChi: | InChI=1S/C15H25N7O7S2/c1-30-3-2-7(16)14(25)21-31(26,27)28-4-8-10(23)11(24)15(29-8)22-6-20-9-12(17)18-5-19-13(9)22/h5-8,10-11,13,15,23-24H,2-4,16-17H2,1H3,(H,18,19)(H,21,25)/t7-,8+,10+,11+,13?,15+/m0/s1 | | Definition date: | 2003-05-30 | | Last modified: | 2011-06-04 | | Identifier: | 5'-O-(L-methionylsulfamoyl)adenosine |
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 | | MSR | | Name: | 4-(1H-IMIDAZOL-1-YL)PHENOL | | Formula: | C9 H8 N2 O | | SMILES: | n2ccn(c1ccc(O)cc1)c2 | | InChi: | InChI=1S/C9H8N2O/c12-9-3-1-8(2-4-9)11-6-5-10-7-11/h1-7,12H | | Definition date: | 2007-02-06 | | Last modified: | 2011-06-04 | | Identifier: | 4-(1H-imidazol-1-yl)phenol |
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 | | 7L4 | | Name: | 2-PHENYLQUINOLIN-4-OL | | Formula: | C15 H11 N O | | SMILES: | Oc1cc(nc2ccccc12)c3ccccc3 | | InChi: | InChI=1S/C15H11NO/c17-15-10-14(11-6-2-1-3-7-11)16-13-9-5-4-8-12(13)15/h1-10H,(H,16,17) | | Definition date: | 2010-11-16 | | Last modified: | 2011-06-04 | | Identifier: | 2-phenylquinolin-4-ol |
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 | | MT5 | | Name: | N-[(3E,5R,6R,7S,8R,8AR)-5,6,7,8-TETRAHYDROXYHEXAHYDROIMIDAZO[1,5-A]PYRIDIN-3(2H)-YLIDENE]OCTAN-1-AMINIUM | | Formula: | C15 H30 N3 O4 | | SMILES: | OC2C1N(C(/NC1)=[NH+]CCCCCCCC)C(O)C(O)C2O | | InChi: | InChI=1S/C15H29N3O4/c1-2-3-4-5-6-7-8-16-15-17-9-10-11(19)12(20)13(21)14(22)18(10)15/h10-14,19-22H,2-9H2,1H3,(H,16,17)/p+1/t10-,11-,12+,13-,14-/m1/s1 | | Definition date: | 2009-03-23 | | Last modified: | 2011-06-04 | | Identifier: | N-[(3E,5R,6R,7S,8R,8aR)-5,6,7,8-tetrahydroxyhexahydroimidazo[1,5-a]pyridin-3(2H)-ylidene]octan-1-aminium |
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 | | MTA | | Name: | 5'-DEOXY-5'-METHYLTHIOADENOSINE | | Formula: | C11 H15 N5 O3 S | | SMILES: | n2c1c(ncnc1n(c2)C3OC(C(O)C3O)CSC)N | | InChi: | InChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2011-06-04 | | Identifier: | 5'-S-methyl-5'-thioadenosine |
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 | | MTE | | Name: | PHOSPHONIC ACIDMONO-(2-AMINO-5,6-DIMERCAPTO-4-OXO-3,7,8A,9,10,10A-HEXAHYDRO-4H-8-OXA-1,3,9,10-TETRAAZA-ANTHRACEN-7-YLMETHYL)ESTER | | Formula: | C10 H14 N5 O6 P S2 | | SMILES: | O=P(O)(O)OCC2OC3NC=1N=C(NC(=O)C=1NC3C(S)=C2S)N | | InChi: | InChI=1S/C10H14N5O6PS2/c11-10-14-7-4(8(16)15-10)12-3-6(24)5(23)2(21-9(3)13-7)1-20-22(17,18)19/h2-3,9,12,23-24H,1H2,(H2,17,18,19)(H4,11,13,14,15,16)/t2-,3+,9-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2011-06-04 | | Identifier: | [(5aR,8R,9aR)-2-amino-4-oxo-6,7-disulfanyl-3,5,5a,8,9a,10-hexahydro-4H-pyrano[3,2-g]pteridin-8-yl]methyl dihydrogen phosphate |
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 | | MTR | | Name: | (5-METHYL-6-OXO-1,6-DIHYDRO-PYRIDIN-3-YL)-1,2-DIDEOXY-RIBOFURANOSE-5-MONOPHOSPHATE | | Formula: | C11 H16 N O7 P | | SMILES: | O=P(OCC2OC(C=1C=C(C(=O)NC=1)C)CC2O)(O)O | | InChi: | InChI=1S/C11H16NO7P/c1-6-2-7(4-12-11(6)14)9-3-8(13)10(19-9)5-18-20(15,16)17/h2,4,8-10,13H,3,5H2,1H3,(H,12,14)(H2,15,16,17)/t8-,9+,10+/m0/s1 | | Definition date: | 2003-01-09 | | Last modified: | 2011-06-04 | | Identifier: | (1R)-1,4-anhydro-2-deoxy-1-(5-methyl-6-oxo-1,6-dihydropyridin-3-yl)-5-O-phosphono-D-erythro-pentitol |
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 | | MTU | | Name: | 9-BETA-D-RIBOFURANOSYL-9H-PURIN-2-AMINE | | Formula: | C10 H14 N5 O7 P | | SMILES: | O=P(O)(O)OCC3OC(n2cnc1cnc(nc12)N)C(O)C3O | | InChi: | InChI=1S/C10H14N5O7P/c11-10-12-1-4-8(14-10)15(3-13-4)9-7(17)6(16)5(22-9)2-21-23(18,19)20/h1,3,5-7,9,16-17H,2H2,(H2,11,12,14)(H2,18,19,20)/t5-,6-,7-,9-/m1/s1 | | Definition date: | 2004-04-09 | | Last modified: | 2011-06-04 | | Identifier: | 9-(5-O-phosphono-beta-D-ribofuranosyl)-9H-purin-2-amine |
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 | | 7MC | | Name: | 5'-O-[(R)-[(N-acetyl-L-alpha-aspartyl)amino](3-aminopropoxy)phosphoryl]adenosine | | Formula: | C19 H29 N8 O10 P | | SMILES: | O=C(O)CC(NC(=O)C)C(=O)NP(=O)(OCCCN)OCC3OC(n2cnc1c(ncnc12)N)C(O)C3O | | InChi: | InChI=1S/C19H29N8O10P/c1-9(28)25-10(5-12(29)30)18(33)26-38(34,35-4-2-3-20)36-6-11-14(31)15(32)19(37-11)27-8-24-13-16(21)22-7-23-17(13)27/h7-8,10-11,14-15,19,31-32H,2-6,20H2,1H3,(H,25,28)(H,29,30)(H2,21,22,23)(H,26,33,34)/t10-,11+,14+,15+,19+,38+/m0/s1 | | Definition date: | 2011-04-18 | | Last modified: | 2011-06-04 | | Identifier: | 5'-O-[(R)-[(N-acetyl-L-alpha-aspartyl)amino](3-aminopropoxy)phosphoryl]adenosine |
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 | | 7MG | | Name: | 7N-METHYL-8-HYDROGUANOSINE-5'-MONOPHOSPHATE | | Formula: | C11 H18 N5 O8 P | | SMILES: | O=C1C=2N(CN(C=2N=C(N)N1)C3OC(C(O)C3O)COP(=O)(O)O)C | | InChi: | InChI=1S/C11H18N5O8P/c1-15-3-16(8-5(15)9(19)14-11(12)13-8)10-7(18)6(17)4(24-10)2-23-25(20,21)22/h4,6-7,10,17-18H,2-3H2,1H3,(H2,20,21,22)(H3,12,13,14,19)/t4-,6-,7-,10-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2011-06-04 | | Identifier: | 7-methylguanosine 5'-(dihydrogen phosphate) |
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 | | MUF | | Name: | (8alpha,10alpha,13alpha,17beta)-17-[(4-hydroxyphenyl)carbonyl]androsta-3,5-diene-3-carboxylic acid | | Formula: | C27 H32 O4 | | SMILES: | O=C(O)C5=CC4=CCC2C(CCC3(C(C(=O)c1ccc(O)cc1)CCC23)C)C4(C)CC5 | | InChi: | InChI=1S/C27H32O4/c1-26-13-11-17(25(30)31)15-18(26)5-8-20-21-9-10-23(27(21,2)14-12-22(20)26)24(29)16-3-6-19(28)7-4-16/h3-7,15,20-23,28H,8-14H2,1-2H3,(H,30,31)/t20-,21-,22-,23+,26-,27-/m0/s1 | | Definition date: | 2007-11-27 | | Last modified: | 2011-06-04 | | Identifier: | (8alpha,10alpha,13alpha,17beta)-17-[(4-hydroxyphenyl)carbonyl]androsta-3,5-diene-3-carboxylic acid |
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 | | MUG | | Name: | 4-METHYLUMBELLIFERYL-ALPHA-D-GLUCOSE | | Formula: | C16 H18 O8 | | SMILES: | O=C2Oc3cc(OC1OC(C(O)C(O)C1O)CO)ccc3C(=C2)C | | InChi: | InChI=1S/C16H18O8/c1-7-4-12(18)23-10-5-8(2-3-9(7)10)22-16-15(21)14(20)13(19)11(6-17)24-16/h2-5,11,13-17,19-21H,6H2,1H3/t11-,13-,14+,15-,16+/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2011-06-04 | | Identifier: | 4-methyl-2-oxo-2H-chromen-7-yl alpha-D-glucopyranoside |
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 | | 7MR | | Name: | (2R)-2-AMINO-3,3,3-TRIFLUORO-N-HYDROXY-2-{[(4-PHENOXYPHENYL)SULFONYL]METHYL}PROPANAMIDE | | Formula: | C16 H15 F3 N2 O5 S | | SMILES: | FC(F)(F)C(C(=O)NO)(N)CS(=O)(=O)c2ccc(Oc1ccccc1)cc2 | | InChi: | InChI=1S/C16H15F3N2O5S/c17-16(18,19)15(20,14(22)21-23)10-27(24,25)13-8-6-12(7-9-13)26-11-4-2-1-3-5-11/h1-9,23H,10,20H2,(H,21,22)/t15-/m1/s1 | | Definition date: | 2007-02-16 | | Last modified: | 2011-06-04 | | Identifier: | (2R)-2-amino-3,3,3-trifluoro-N-hydroxy-2-{[(4-phenoxyphenyl)sulfonyl]methyl}propanamide |
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 | | MUH | | Name: | N-{4-METHYL-3-[(3-PYRIMIDIN-4-YLPYRIDIN-2-YL)AMINO]PHENYL}-3-(TRIFLUOROMETHYL)BENZAMIDE | | Formula: | C24 H18 F3 N5 O | | SMILES: | FC(F)(F)c1cccc(c1)C(=O)Nc2cc(c(cc2)C)Nc3ncccc3c4ncncc4 | | InChi: | InChI=1S/C24H18F3N5O/c1-15-7-8-18(31-23(33)16-4-2-5-17(12-16)24(25,26)27)13-21(15)32-22-19(6-3-10-29-22)20-9-11-28-14-30-20/h2-14H,1H3,(H,29,32)(H,31,33) | | Definition date: | 2007-02-07 | | Last modified: | 2011-06-04 | | Identifier: | N-{4-methyl-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]phenyl}-3-(trifluoromethyl)benzamide |
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 | | MUV | | Name: | N-{(1S,2R)-1-BENZYL-3-[(CYCLOPROPYLMETHYL)(2-FURYLSULFONYL)AMINO]-2-HYDROXYPROPYL}-N'-METHYLSUCCINAMIDE | | Formula: | C23 H31 N3 O6 S | | SMILES: | O=S(=O)(N(CC1CC1)CC(O)C(NC(=O)CCC(=O)NC)Cc2ccccc2)c3occc3 | | InChi: | InChI=1S/C23H31N3O6S/c1-24-21(28)11-12-22(29)25-19(14-17-6-3-2-4-7-17)20(27)16-26(15-18-9-10-18)33(30,31)23-8-5-13-32-23/h2-8,13,18-20,27H,9-12,14-16H2,1H3,(H,24,28)(H,25,29)/t19-,20+/m0/s1 | | Definition date: | 2007-05-08 | | Last modified: | 2011-06-04 | | Identifier: | N-{(1S,2R)-1-benzyl-3-[(cyclopropylmethyl)(furan-2-ylsulfonyl)amino]-2-hydroxypropyl}-N'-methylbutanediamide |
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 | | 7NH | | Name: | [2'-HYDROXY-3'-(1H-PYRROLO[3,2-C]PYRIDIN-2-YL)-BIPHENYL-3-YLMETHYL]-UREA | | Formula: | C21 H18 N4 O2 | | SMILES: | O=C(N)NCc1cccc(c1)c4cccc(c3cc2c(ccnc2)n3)c4O | | InChi: | InChI=1S/C21H18N4O2/c22-21(27)24-11-13-3-1-4-14(9-13)16-5-2-6-17(20(16)26)19-10-15-12-23-8-7-18(15)25-19/h1-10,12,25-26H,11H2,(H3,22,24,27) | | Definition date: | 2006-01-17 | | Last modified: | 2011-06-04 | | Identifier: | 1-{[2'-hydroxy-3'-(1H-pyrrolo[3,2-c]pyridin-2-yl)biphenyl-3-yl]methyl}urea |
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 | | 7NI | | Name: | 7-NITROINDAZOLE | | Formula: | C7 H5 N3 O2 | | SMILES: | [O-][N+](=O)c1cccc2c1nnc2 | | InChi: | InChI=1S/C7H5N3O2/c11-10(12)6-3-1-2-5-4-8-9-7(5)6/h1-4H,(H,8,9) | | Definition date: | 1999-09-14 | | Last modified: | 2011-06-04 | | Identifier: | 7-nitro-1H-indazole |
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 | | 7PA | | Name: | PROPANE-1,3-DIYLBIS(PHOSPHONIC ACID) | | Formula: | C3 H10 O6 P2 | | SMILES: | O=P(O)(O)CCCP(=O)(O)O | | InChi: | InChI=1S/C3H10O6P2/c4-10(5,6)2-1-3-11(7,8)9/h1-3H2,(H2,4,5,6)(H2,7,8,9) | | Definition date: | 2007-02-08 | | Last modified: | 2011-06-04 | | Identifier: | propane-1,3-diylbis(phosphonic acid) |
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 | | 7PC | | Name: | 2-[4-(AMINOMETHYL)-2-CHLOROPHENOXY]-5-PYRIDIN-2-YLPHENOL | | Formula: | C18 H15 Cl N2 O2 | | SMILES: | Clc3cc(ccc3Oc2c(O)cc(c1ncccc1)cc2)CN | | InChi: | InChI=1S/C18H15ClN2O2/c19-14-9-12(11-20)4-6-17(14)23-18-7-5-13(10-16(18)22)15-3-1-2-8-21-15/h1-10,22H,11,20H2 | | Definition date: | 2007-04-25 | | Last modified: | 2011-06-04 | | Identifier: | 2-[4-(aminomethyl)-2-chlorophenoxy]-5-pyridin-2-ylphenol |
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 | | MY4 | | Name: | (1-{(3S)-3-HYDROXY-4-OXO-4-[(2-PHENYLETHYL)AMINO]BUTANOYL}HYDRAZINO)ACETIC ACID | | Formula: | C14 H19 N3 O5 | | SMILES: | O=C(O)CN(N)C(=O)CC(O)C(=O)NCCc1ccccc1 | | InChi: | InChI=1S/C14H19N3O5/c15-17(9-13(20)21)12(19)8-11(18)14(22)16-7-6-10-4-2-1-3-5-10/h1-5,11,18H,6-9,15H2,(H,16,22)(H,20,21)/t11-/m0/s1 | | Definition date: | 2006-05-22 | | Last modified: | 2011-06-04 | | Identifier: | (1-{(3S)-3-hydroxy-4-oxo-4-[(2-phenylethyl)amino]butanoyl}hydrazino)acetic acid |
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 | | MY6 | | Name: | 2-amino-7-methyl-1,7-dihydro-6H-purin-6-one | | Formula: | C6 H7 N5 O | | SMILES: | O=C1c2c(N=C(N1)N)ncn2C | | InChi: | InChI=1S/C6H7N5O/c1-11-2-8-4-3(11)5(12)10-6(7)9-4/h2H,1H3,(H3,7,9,10,12) | | Definition date: | 2010-05-12 | | Last modified: | 2011-06-04 | | Identifier: | 2-amino-7-methyl-1,7-dihydro-6H-purin-6-one |
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