 | | 0KH | | 表記: | (2-{2-[(2,3-dichlorophenyl)amino]-2-oxoethoxy}phenyl)phosphonic acid | | 組成式: | C14 H12 Cl2 N O5 P | | SMILES: | Clc2c(NC(=O)COc1ccccc1P(=O)(O)O)cccc2Cl | | InChi: | InChI=1S/C14H12Cl2NO5P/c15-9-4-3-5-10(14(9)16)17-13(18)8-22-11-6-1-2-7-12(11)23(19,20)21/h1-7H,8H2,(H,17,18)(H2,19,20,21) | | 定義日: | 2012-02-02 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | (2-{2-[(2,3-dichlorophenyl)amino]-2-oxoethoxy}phenyl)phosphonic acid |
|
 | | 0LQ | | 表記: | (4aS,7aS)-1,4-bis(diphenylmethyl)hexahydro-1H-pyrrolo[3,4-b]pyrazine-2,3-dione | | 組成式: | C32 H29 N3 O2 | | SMILES: | O=C1C(=O)N(C4CNCC4N1C(c2ccccc2)c3ccccc3)C(c5ccccc5)c6ccccc6 | | InChi: | InChI=1S/C32H29N3O2/c36-31-32(37)35(30(25-17-9-3-10-18-25)26-19-11-4-12-20-26)28-22-33-21-27(28)34(31)29(23-13-5-1-6-14-23)24-15-7-2-8-16-24/h1-20,27-30,33H,21-22H2/t27-,28-/m0/s1 | | 定義日: | 2012-08-16 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | (4aS,7aS)-1,4-bis(diphenylmethyl)hexahydro-1H-pyrrolo[3,4-b]pyrazine-2,3-dione |
|
 | | 2X9 | | 表記: | {2,6-dimethyl-5-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]pyridin-3-yl}acetic acid | | 組成式: | C17 H13 F3 N2 O2 S | | SMILES: | O=C(O)Cc1cc(c(nc1C)C)Cc2nc3c(F)c(F)cc(F)c3s2 | | InChi: | InChI=1S/C17H13F3N2O2S/c1-7-9(3-10(5-14(23)24)8(2)21-7)4-13-22-16-15(20)11(18)6-12(19)17(16)25-13/h3,6H,4-5H2,1-2H3,(H,23,24) | | 定義日: | 2012-08-14 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | {2,6-dimethyl-5-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]pyridin-3-yl}acetic acid |
|
 | | LA6 | | 表記: | (2E)-2-fluoro-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate | | 組成式: | C10 H19 F O7 P2 | | SMILES: | O=P(O)(O)OP(=O)(OCC(/F)=C(/C)CCC=C(/C)C)O | | InChi: | InChI=1S/C10H19FO7P2/c1-8(2)5-4-6-9(3)10(11)7-17-20(15,16)18-19(12,13)14/h5H,4,6-7H2,1-3H3,(H,15,16)(H2,12,13,14)/b10-9+ | | 定義日: | 2013-06-27 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | (2E)-2-fluoro-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate |
|
 | | 17O | | 表記: | (7R)-6-formyl-7-(4H-pyrazolo[1,5-c][1,3]thiazol-2-yl)-4,7-dihydro-1,4-thiazepine-3-carboxylic acid | | 組成式: | C12 H11 N3 O3 S2 | | SMILES: | O=C(O)C3=CSC(c1nn2c(c1)CSC2)C(=CN3)C=O | | InChi: | InChI=1S/C12H11N3O3S2/c16-3-7-2-13-10(12(17)18)5-20-11(7)9-1-8-4-19-6-15(8)14-9/h1-3,5,11,13H,4,6H2,(H,17,18)/t11-/m1/s1 | | 定義日: | 2012-10-26 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | (7R)-6-formyl-7-(4H-pyrazolo[1,5-c][1,3]thiazol-2-yl)-4,7-dihydro-1,4-thiazepine-3-carboxylic acid |
|
 | | 1HZ | | 表記: | 5'-deoxy-5'-({[2-(2,3-dihydroxyphenyl)ethyl]sulfonyl}amino)adenosine | | 組成式: | C18 H22 N6 O7 S | | SMILES: | O=S(=O)(NCC3OC(n2cnc1c(ncnc12)N)C(O)C3O)CCc4cccc(O)c4O | | InChi: | InChI=1S/C18H22N6O7S/c19-16-12-17(21-7-20-16)24(8-22-12)18-15(28)14(27)11(31-18)6-23-32(29,30)5-4-9-2-1-3-10(25)13(9)26/h1-3,7-8,11,14-15,18,23,25-28H,4-6H2,(H2,19,20,21)/t11-,14-,15-,18-/m1/s1 | | 定義日: | 2013-02-09 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | 5'-deoxy-5'-({[2-(2,3-dihydroxyphenyl)ethyl]sulfonyl}amino)adenosine |
|
 | | 1LM | | 表記: | quinolin-4-amine | | 組成式: | C9 H8 N2 | | SMILES: | n1ccc(c2ccccc12)N | | InChi: | InChI=1S/C9H8N2/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-6H,(H2,10,11) | | 定義日: | 2013-03-21 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | quinolin-4-amine |
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 | | 1LN | | 表記: | 2-(2-aminopyridin-1-ium-1-yl)ethanol | | 組成式: | C7 H11 N2 O | | SMILES: | Nc1ccccn1CCO | | InChi: | InChI=1S/C7H11N2O/c8-7-3-1-2-4-9(7)5-6-10/h1-4,10H,5-6,8H2 | | 定義日: | 2013-03-21 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | 2-(2-azanylpyridin-1-yl)ethanol |
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 | | 1LQ | | 表記: | quinazolin-4-amine | | 組成式: | C8 H7 N3 | | SMILES: | n2c1c(cccc1)c(nc2)N | | InChi: | InChI=1S/C8H7N3/c9-8-6-3-1-2-4-7(6)10-5-11-8/h1-5H,(H2,9,10,11) | | 定義日: | 2013-03-21 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | quinazolin-4-amine |
|
 | | 1WT | | 表記: | 11-ethyl-5-methyl-8-[2-(1-oxidanylquinolin-4-yl)oxyethyl]dipyrido[3,2-[1,4]diazepin-6-one | | 組成式: | C25 H24 N5 O3 | | SMILES: | CCN1c2ncccc2N(C)C(=O)c3cc(CCOc4ccn(O)c5ccccc45)cnc13 | | InChi: | InChI=1S/C25H24N5O3/c1-3-29-23-19(25(31)28(2)21-9-6-12-26-24(21)29)15-17(16-27-23)11-14-33-22-10-13-30(32)20-8-5-4-7-18(20)22/h4-10,12-13,15-16,32H,3,11,14H2,1-2H3 | | 定義日: | 2013-07-12 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | 11-ethyl-5-methyl-8-[2-(1-oxidanylquinolin-4-yl)oxyethyl]dipyrido[3,2-[1,4]diazepin-6-one |
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 | | 1XE | | 表記: | [5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)furan-2-yl]methyl (3R)-4-{[3-({(E)-2-[(2,2-dihydroxyethyl)sulfanyl]ethenyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl dihydrogen diphosphate | | 組成式: | C23 H34 N7 O18 P3 S | | SMILES: | O=C(NC=CSCC(O)O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCc3oc(n2cnc1c(ncnc12)N)c(O)c3OP(=O)(O)O | | InChi: | InChI=1S/C23H34N7O18P3S/c1-23(2,18(35)21(36)26-4-3-13(31)25-5-6-52-8-14(32)33)9-45-51(42,43)48-50(40,41)44-7-12-17(47-49(37,38)39)16(34)22(46-12)30-11-29-15-19(24)27-10-28-20(15)30/h5-6,10-11,14,18,32-35H,3-4,7-9H2,1-2H3,(H,25,31)(H,26,36)(H,40,41)(H,42,43)(H2,24,27,28)(H2,37,38,39)/b6-5+/t18-/m0/s1 | | 定義日: | 2013-07-25 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | [5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)furan-2-yl]methyl (3R)-4-{[3-({(E)-2-[(2,2-dihydroxyethyl)sulfanyl]ethenyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl dihydrogen diphosphate |
|
 | | EP6 | | 表記: | 5'-[{cis-3-[2-(5-tert-butyl-1H-benzimidazol-2-yl)ethyl]cyclobutyl}(propan-2-yl)amino]-5'-deoxyadenosine | | 組成式: | C30 H42 N8 O3 | | SMILES: | n2c1c(ncnc1n(c2)C3OC(C(O)C3O)CN(C(C)C)C6CC(CCc5nc4cc(ccc4n5)C(C)(C)C)C6)N | | InChi: | InChI=1S/C30H42N8O3/c1-16(2)37(13-22-25(39)26(40)29(41-22)38-15-34-24-27(31)32-14-33-28(24)38)19-10-17(11-19)6-9-23-35-20-8-7-18(30(3,4)5)12-21(20)36-23/h7-8,12,14-17,19,22,25-26,29,39-40H,6,9-11,13H2,1-5H3,(H,35,36)(H2,31,32,33)/t17-,19+,22-,25-,26-,29-/m1/s1 | | 定義日: | 2012-11-08 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | 5'-[{cis-3-[2-(5-tert-butyl-1H-benzimidazol-2-yl)ethyl]cyclobutyl}(propan-2-yl)amino]-5'-deoxyadenosine |
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 | | DWV | | 表記: | (5Z)-5-(3,4-dichlorobenzylidene)-2-(4-methylpiperazin-1-yl)-1,3-thiazol-4(5H)-one | | 組成式: | C15 H15 Cl2 N3 O S | | SMILES: | Clc1ccc(cc1Cl)C=C2/SC(=NC2=O)N3CCN(C)CC3 | | InChi: | InChI=1S/C15H15Cl2N3OS/c1-19-4-6-20(7-5-19)15-18-14(21)13(22-15)9-10-2-3-11(16)12(17)8-10/h2-3,8-9H,4-7H2,1H3/b13-9- | | 定義日: | 2013-05-16 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | (5Z)-5-(3,4-dichlorobenzylidene)-2-(4-methylpiperazin-1-yl)-1,3-thiazol-4(5H)-one |
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 | | DWW | | 表記: | [2-({4-[(5Z)-5-(3,4-dichlorobenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}methyl)phenyl]boronic acid | | 組成式: | C21 H20 B Cl2 N3 O3 S | | SMILES: | Clc1ccc(cc1Cl)C=C2/SC(=NC2=O)N4CCN(Cc3ccccc3B(O)O)CC4 | | InChi: | InChI=1S/C21H20BCl2N3O3S/c23-17-6-5-14(11-18(17)24)12-19-20(28)25-21(31-19)27-9-7-26(8-10-27)13-15-3-1-2-4-16(15)22(29)30/h1-6,11-12,29-30H,7-10,13H2/b19-12- | | 定義日: | 2013-05-16 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | [2-({4-[(5Z)-5-(3,4-dichlorobenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}methyl)phenyl]boronic acid |
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 | | DWX | | 表記: | [3-({4-[(5Z)-5-(3,4-dichlorobenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}methyl)phenyl]boronic acid | | 組成式: | C21 H20 B Cl2 N3 O3 S | | SMILES: | Clc1ccc(cc1Cl)C=C2/SC(=NC2=O)N4CCN(Cc3cccc(B(O)O)c3)CC4 | | InChi: | InChI=1S/C21H20BCl2N3O3S/c23-17-5-4-14(11-18(17)24)12-19-20(28)25-21(31-19)27-8-6-26(7-9-27)13-15-2-1-3-16(10-15)22(29)30/h1-5,10-12,29-30H,6-9,13H2/b19-12- | | 定義日: | 2013-05-16 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | [3-({4-[(5Z)-5-(3,4-dichlorobenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}methyl)phenyl]boronic acid |
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 | | DWY | | 表記: | [4-({4-[(5Z)-5-(3,4-dichlorobenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}methyl)phenyl]boronic acid | | 組成式: | C21 H20 B Cl2 N3 O3 S | | SMILES: | Clc1ccc(cc1Cl)C=C2/SC(=NC2=O)N4CCN(Cc3ccc(B(O)O)cc3)CC4 | | InChi: | InChI=1S/C21H20BCl2N3O3S/c23-17-6-3-15(11-18(17)24)12-19-20(28)25-21(31-19)27-9-7-26(8-10-27)13-14-1-4-16(5-2-14)22(29)30/h1-6,11-12,29-30H,7-10,13H2/b19-12- | | 定義日: | 2013-05-16 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | [4-({4-[(5Z)-5-(3,4-dichlorobenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}methyl)phenyl]boronic acid |
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 | | 4JP | | 表記: | 1H-pyrrolo[3,2-b]pyridine | | 組成式: | C7 H6 N2 | | SMILES: | n1cccc2c1ccn2 | | InChi: | InChI=1S/C7H6N2/c1-2-6-7(8-4-1)3-5-9-6/h1-5,9H | | 定義日: | 2013-03-21 | | 最終更新日: | 2013-07-26 | | 公開日: | 2013-07-31 | | 識別子（ID）: | 1H-pyrrolo[3,2-b]pyridine |
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 | | VFV | | 表記: | N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide | | 組成式: | C32 H23 F2 N5 O2 | | SMILES: | Fc1ccc(cc1)c2ccc(c(F)c2)C(NC(=O)c5ccc(c3nnc(o3)c4ccccc4)cc5)Cn6ccnc6 | | InChi: | InChI=1S/C32H23F2N5O2/c33-26-13-10-21(11-14-26)25-12-15-27(28(34)18-25)29(19-39-17-16-35-20-39)36-30(40)22-6-8-24(9-7-22)32-38-37-31(41-32)23-4-2-1-3-5-23/h1-18,20,29H,19H2,(H,36,40)/t29-/m0/s1 | | 定義日: | 2012-08-01 | | 最終更新日: | 2013-07-19 | | 公開日: | 2013-07-24 | | 識別子（ID）: | N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide |
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 | | PBX | | 表記: | 4-bromobenzene-1,2,3-triol | | 組成式: | C6 H5 Br O3 | | SMILES: | Brc1ccc(O)c(O)c1O | | InChi: | InChI=1S/C6H5BrO3/c7-3-1-2-4(8)6(10)5(3)9/h1-2,8-10H | | 定義日: | 2012-07-30 | | 最終更新日: | 2013-07-19 | | 公開日: | 2013-07-24 | | 識別子（ID）: | 4-bromobenzene-1,2,3-triol |
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 | | N75 | | 表記: | 3-[(3-chlorophenyl)ethynyl]-2-{4-[2-(cyclopropylamino)-2-oxoethoxy]phenyl}-6-hydroxy-1-benzofuran-5-carboxylic acid | | 組成式: | C28 H20 Cl N O6 | | SMILES: | O=C(O)c5cc2c(oc(c2C#Cc1cccc(Cl)c1)c4ccc(OCC(=O)NC3CC3)cc4)cc5O | | InChi: | InChI=1S/C28H20ClNO6/c29-18-3-1-2-16(12-18)4-11-21-22-13-23(28(33)34)24(31)14-25(22)36-27(21)17-5-9-20(10-6-17)35-15-26(32)30-19-7-8-19/h1-3,5-6,9-10,12-14,19,31H,7-8,15H2,(H,30,32)(H,33,34) | | 定義日: | 2013-02-20 | | 最終更新日: | 2013-07-19 | | 公開日: | 2013-07-24 | | 識別子（ID）: | 3-[(3-chlorophenyl)ethynyl]-2-{4-[2-(cyclopropylamino)-2-oxoethoxy]phenyl}-6-hydroxy-1-benzofuran-5-carboxylic acid |
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 | | 0UX | | 表記: | 6-amino-2-(methylamino)-4-(2-{[(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl]amino}ethyl)-1,7-dihydro-8H-imidazo[4,5-g]quinazolin-8-one | | 組成式: | C23 H31 N7 O | | SMILES: | O=C2c3cc1nc(nc1c(c3N=C(N)N2)CCNCC46CC5CC(C4)CC(C5)C6)NC | | InChi: | InChI=1S/C23H31N7O/c1-25-22-27-17-7-16-18(28-21(24)30-20(16)31)15(19(17)29-22)2-3-26-11-23-8-12-4-13(9-23)6-14(5-12)10-23/h7,12-14,26H,2-6,8-11H2,1H3,(H2,25,27,29)(H3,24,28,30,31)/t12-,13+,14-,23- | | 定義日: | 2012-06-25 | | 最終更新日: | 2013-07-19 | | 公開日: | 2013-07-24 | | 識別子（ID）: | 6-amino-2-(methylamino)-4-(2-{[(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl]amino}ethyl)-1,7-dihydro-8H-imidazo[4,5-g]quinazolin-8-one |
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 | | 0V3 | | 表記: | 6-amino-2-(methylamino)-4-[2-({[trans-4-(pyridin-3-ylethynyl)cyclohexyl]methyl}amino)ethyl]-1,7-dihydro-8H-imidazo[4,5-g]quinazolin-8-one | | 組成式: | C26 H30 N8 O | | SMILES: | O=C2c3cc1nc(nc1c(c3N=C(N)N2)CCNCC5CCC(C#Cc4cccnc4)CC5)NC | | InChi: | InChI=1S/C26H30N8O/c1-28-26-31-21-13-20-22(32-25(27)34-24(20)35)19(23(21)33-26)10-12-30-15-18-8-5-16(6-9-18)4-7-17-3-2-11-29-14-17/h2-3,11,13-14,16,18,30H,5-6,8-10,12,15H2,1H3,(H2,28,31,33)(H3,27,32,34,35)/t16-,18- | | 定義日: | 2012-06-28 | | 最終更新日: | 2013-07-19 | | 公開日: | 2013-07-24 | | 識別子（ID）: | 6-amino-2-(methylamino)-4-[2-({[trans-4-(pyridin-3-ylethynyl)cyclohexyl]methyl}amino)ethyl]-1,7-dihydro-8H-imidazo[4,5-g]quinazolin-8-one |
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 | | 1OJ | | 表記: | (2R)-2-[3-ethoxy-4-(propan-2-yloxy)phenyl]-2-(isoquinolin-6-ylamino)-N-[(3-sulfamoylphenyl)sulfonyl]ethanamide | | 組成式: | C28 H30 N4 O7 S2 | | SMILES: | O=S(=O)(N)c1cccc(c1)S(=O)(=O)NC(=O)C(c2ccc(OC(C)C)c(OCC)c2)Nc3ccc4c(c3)ccnc4 | | InChi: | InChI=1S/C28H30N4O7S2/c1-4-38-26-15-20(9-11-25(26)39-18(2)3)27(31-22-10-8-21-17-30-13-12-19(21)14-22)28(33)32-41(36,37)24-7-5-6-23(16-24)40(29,34)35/h5-18,27,31H,4H2,1-3H3,(H,32,33)(H2,29,34,35)/t27-/m1/s1 | | 定義日: | 2013-04-11 | | 最終更新日: | 2013-07-19 | | 公開日: | 2013-07-24 | | 識別子（ID）: | (2R)-2-[3-ethoxy-4-(propan-2-yloxy)phenyl]-2-(isoquinolin-6-ylamino)-N-[(3-sulfamoylphenyl)sulfonyl]ethanamide |
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 | | 1OK | | 表記: | (2R)-2-[(1-aminoisoquinolin-6-yl)amino]-2-[3-ethoxy-4-(propan-2-yloxy)phenyl]-N-(phenylsulfonyl)ethanamide | | 組成式: | C28 H30 N4 O5 S | | SMILES: | O=S(=O)(c1ccccc1)NC(=O)C(c2ccc(OC(C)C)c(OCC)c2)Nc4cc3ccnc(c3cc4)N | | InChi: | InChI=1S/C28H30N4O5S/c1-4-36-25-17-20(10-13-24(25)37-18(2)3)26(28(33)32-38(34,35)22-8-6-5-7-9-22)31-21-11-12-23-19(16-21)14-15-30-27(23)29/h5-18,26,31H,4H2,1-3H3,(H2,29,30)(H,32,33)/t26-/m1/s1 | | 定義日: | 2013-04-11 | | 最終更新日: | 2013-07-19 | | 公開日: | 2013-07-24 | | 識別子（ID）: | (2R)-2-[(1-aminoisoquinolin-6-yl)amino]-2-[3-ethoxy-4-(propan-2-yloxy)phenyl]-N-(phenylsulfonyl)ethanamide |
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 | | 1OY | | 表記: | (3S,4R,5S)-3-(3-chloro-2-fluorophenyl)-4-(4-chloro-2-fluorophenyl)-4-cyano-N-[(3S)-3,4-dihydroxybutyl]-5-(2,2-dimethylpropyl)-D-prolinamide | | 組成式: | C27 H31 Cl2 F2 N3 O3 | | SMILES: | Clc1cccc(c1F)C3C(C(=O)NCCC(O)CO)NC(CC(C)(C)C)C3(C#N)c2ccc(Cl)cc2F | | InChi: | InChI=1S/C27H31Cl2F2N3O3/c1-26(2,3)12-21-27(14-32,18-8-7-15(28)11-20(18)30)22(17-5-4-6-19(29)23(17)31)24(34-21)25(37)33-10-9-16(36)13-35/h4-8,11,16,21-22,24,34-36H,9-10,12-13H2,1-3H3,(H,33,37)/t16-,21-,22-,24+,27-/m0/s1 | | 定義日: | 2013-04-16 | | 最終更新日: | 2013-07-19 | | 公開日: | 2013-07-24 | | 識別子（ID）: | (3S,4R,5S)-3-(3-chloro-2-fluorophenyl)-4-(4-chloro-2-fluorophenyl)-4-cyano-N-[(3S)-3,4-dihydroxybutyl]-5-(2,2-dimethylpropyl)-D-prolinamide |
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