![8KO 8KO](https://data.pdbj.org/pdbjplus/data/cc/svg/8KO.svg) | 8KO | Name: | (2S)-2-[[(2S,3R)-3-azanyl-2-oxidanyl-4-phenyl-butanoyl]amino]-4-methyl-N-oxidanyl-pentanamide | Formula: | C16 H25 N3 O4 | SMILES: | CC(C)C[CH](NC(=O)[CH](O)[CH](N)Cc1ccccc1)C(=O)NO | InChi: | InChI=1S/C16H25N3O4/c1-10(2)8-13(15(21)19-23)18-16(22)14(20)12(17)9-11-6-4-3-5-7-11/h3-7,10,12-14,20,23H,8-9,17H2,1-2H3,(H,18,22)(H,19,21)/t12-,13+,14+/m1/s1 | Definition date: | 2017-07-26 | Last modified: | 2018-07-27 | Release date: | 2018-08-01 | Identifier: | (2~{S})-2-[[(2~{S},3~{R})-3-azanyl-2-oxidanyl-4-phenyl-butanoyl]amino]-4-methyl-~{N}-oxidanyl-pentanamide |
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![8KR 8KR](https://data.pdbj.org/pdbjplus/data/cc/svg/8KR.svg) | 8KR | Name: | (2R)-4-methyl-2-[(2-methylphenyl)carbamoylamino]-N-oxidanyl-pentanamide | Formula: | C14 H21 N3 O3 | SMILES: | CC(C)C[CH](NC(=O)Nc1ccccc1C)C(=O)NO | InChi: | InChI=1S/C14H21N3O3/c1-9(2)8-12(13(18)17-20)16-14(19)15-11-7-5-4-6-10(11)3/h4-7,9,12,20H,8H2,1-3H3,(H,17,18)(H2,15,16,19)/t12-/m1/s1 | Definition date: | 2017-07-26 | Last modified: | 2018-07-27 | Release date: | 2018-08-01 | Identifier: | (2~{R})-4-methyl-2-[(2-methylphenyl)carbamoylamino]-~{N}-oxidanyl-pentanamide |
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![8L0 8L0](https://data.pdbj.org/pdbjplus/data/cc/svg/8L0.svg) | 8L0 | Name: | (2S)-2-[(3-chlorophenyl)methylcarbamoylamino]-4-methyl-N-oxidanyl-pentanamide | Formula: | C14 H20 Cl N3 O3 | SMILES: | CC(C)C[CH](NC(=O)NCc1cccc(Cl)c1)C(=O)NO | InChi: | InChI=1S/C14H20ClN3O3/c1-9(2)6-12(13(19)18-21)17-14(20)16-8-10-4-3-5-11(15)7-10/h3-5,7,9,12,21H,6,8H2,1-2H3,(H,18,19)(H2,16,17,20)/t12-/m0/s1 | Definition date: | 2017-07-27 | Last modified: | 2018-07-27 | Release date: | 2018-08-01 | Identifier: | (2~{S})-2-[(3-chlorophenyl)methylcarbamoylamino]-4-methyl-~{N}-oxidanyl-pentanamide |
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![8LO 8LO](https://data.pdbj.org/pdbjplus/data/cc/svg/8LO.svg) | 8LO | Name: | (2R)-2-[(2,6-diethylphenyl)carbamoylamino]-4-methyl-N-oxidanyl-pentanamide | Formula: | C17 H27 N3 O3 | SMILES: | CCc1cccc(CC)c1NC(=O)N[CH](CC(C)C)C(=O)NO | InChi: | InChI=1S/C17H27N3O3/c1-5-12-8-7-9-13(6-2)15(12)19-17(22)18-14(10-11(3)4)16(21)20-23/h7-9,11,14,23H,5-6,10H2,1-4H3,(H,20,21)(H2,18,19,22)/t14-/m1/s1 | Definition date: | 2017-08-02 | Last modified: | 2018-07-27 | Release date: | 2018-08-01 | Identifier: | (2~{R})-2-[(2,6-diethylphenyl)carbamoylamino]-4-methyl-~{N}-oxidanyl-pentanamide |
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![VA7 VA7](https://data.pdbj.org/pdbjplus/data/cc/svg/VA7.svg) | VA7 | Name: | 2'-deoxy-5'-O-[(R)-{[(R)-[dichloro(phosphono)methyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine | Formula: | C11 H16 Cl2 N5 O11 P3 | SMILES: | n1c(c2c(nc1)n(cn2)C3OC(C(C3)O)COP(=O)(O)OP(O)(C(P(O)(O)=O)(Cl)Cl)=O)N | InChi: | InChI=1S/C11H16Cl2N5O11P3/c12-11(13,30(20,21)22)31(23,24)29-32(25,26)27-2-6-5(19)1-7(28-6)18-4-17-8-9(14)15-3-16-10(8)18/h3-7,19H,1-2H2,(H,23,24)(H,25,26)(H2,14,15,16)(H2,20,21,22)/t5-,6+,7+/m0/s1 | Definition date: | 2018-03-22 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | 2'-deoxy-5'-O-[(R)-{[(R)-[dichloro(phosphono)methyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine |
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![GBG GBG](https://data.pdbj.org/pdbjplus/data/cc/svg/GBG.svg) | GBG | Name: | N~6~-[(1E)-2-chloroethanimidoyl]-L-lysine | Formula: | C8 H16 Cl N3 O2 | SMILES: | C(CC(N)C(O)=O)CCN/C(CCl)=N | InChi: | InChI=1S/C8H16ClN3O2/c9-5-7(11)12-4-2-1-3-6(10)8(13)14/h6H,1-5,10H2,(H2,11,12)(H,13,14)/t6-/m0/s1 | Definition date: | 2018-05-18 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | N~6~-[(1E)-2-chloroethanimidoyl]-L-lysine |
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![9LL 9LL](https://data.pdbj.org/pdbjplus/data/cc/svg/9LL.svg) | 9LL | Name: | (2R)-2-(5-fluoro-2-hydroxyphenyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-N-(1,3-thiazol-2-yl)acetamide | Formula: | C19 H14 F N3 O3 S | SMILES: | C(=O)(C(c1c(ccc(c1)F)O)N3Cc2c(cccc2)C3=O)Nc4nccs4 | InChi: | InChI=1S/C19H14FN3O3S/c20-12-5-6-15(24)14(9-12)16(17(25)22-19-21-7-8-27-19)23-10-11-3-1-2-4-13(11)18(23)26/h1-9,16,24H,10H2,(H,21,22,25)/t16-/m1/s1 | Definition date: | 2018-05-24 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | (2R)-2-(5-fluoro-2-hydroxyphenyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-N-(1,3-thiazol-2-yl)acetamide |
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![CF6 CF6](https://data.pdbj.org/pdbjplus/data/cc/svg/CF6.svg) | CF6 | Name: | N,N'-(decane-1,10-diyl)bis{2-[(6S)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetamide} | Formula: | C48 H54 Cl2 N10 O2 S2 | SMILES: | Clc1ccc(cc1)C=2c8c(n7c(C(N=2)CC(=O)NCCCCCCCCCCNC(=O)CC3N=C(c5c(n4c3nnc4C)sc(c5C)C)c6ccc(cc6)Cl)nnc7C)sc(c8C)C | InChi: | InChI=1S/C48H54Cl2N10O2S2/c1-27-29(3)63-47-41(27)43(33-15-19-35(49)20-16-33)53-37(45-57-55-31(5)59(45)47)25-39(61)51-23-13-11-9-7-8-10-12-14-24-52-40(62)26-38-46-58-56-32(6)60(46)48-42(28(2)30(4)64-48)44(54-38)34-17-21-36(50)22-18-34/h15-22,37-38H,7-14,23-26H2,1-6H3,(H,51,61)(H,52,62)/t37-,38-/m0/s1 | Definition date: | 2018-05-25 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | N,N'-(decane-1,10-diyl)bis{2-[(6S)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetamide} |
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![F6Q F6Q](https://data.pdbj.org/pdbjplus/data/cc/svg/F6Q.svg) | F6Q | Name: | N,N-pyridylbenzimidazole derivative-Pd complex | Formula: | C15 H15 Cl2 N3 O3 Pd S | SMILES: | O[S](=O)(=O)CCCn1c2ccccc2[n+]3c1c4cccc[n+]4[Pd]3(Cl)Cl | InChi: | InChI=1S/C15H15N3O3S.2ClH.Pd/c19-22(20,21)11-5-10-18-14-8-2-1-6-12(14)17-15(18)13-7-3-4-9-16-13 | Definition date: | 2018-06-04 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 |
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![F7T F7T](https://data.pdbj.org/pdbjplus/data/cc/svg/F7T.svg) | F7T | Name: | alkylated sulphonate-N,N-pyridylbenzimidazole-Pt complex | Formula: | C15 H15 Cl2 N3 O3 Pt S | SMILES: | O[S](=O)(=O)CCCn1c2ccccc2[n+]3c1c4cccc[n+]4[Pt]3(Cl)Cl | InChi: | InChI=1S/C15H15N3O3S.2ClH.Pt/c19-22(20,21)11-5-10-18-14-8-2-1-6-12(14)17-15(18)13-7-3-4-9-16-13 | Definition date: | 2018-06-07 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 |
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![GH7 GH7](https://data.pdbj.org/pdbjplus/data/cc/svg/GH7.svg) | GH7 | Name: | (3S,3aR,6aS)-hexahydrofuro[3,2-d][1,2]oxazole-3-carboxylic acid | Formula: | C6 H9 N O4 | SMILES: | N1C(C2C(O1)OCC2)C(O)=O | InChi: | InChI=1S/C6H9NO4/c8-5(9)4-3-1-2-10-6(3)11-7-4/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4+,6+/m1/s1 | Definition date: | 2018-05-21 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | (3S,3aR,6aS)-hexahydrofuro[3,2-d][1,2]oxazole-3-carboxylic acid |
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![GHJ GHJ](https://data.pdbj.org/pdbjplus/data/cc/svg/GHJ.svg) | GHJ | Name: | (3R,3aR,6aS)-N-[(4R,7S,8S,10R,13S)-8-hydroxy-10,17-dimethyl-7-(2-methylpropyl)-5,11,14-trioxo-13-(propan-2-yl)-2-thia-6,12,15-triazaoctadecan-4-yl]hexahydrofuro[3,2-d][1,2]oxazole-3-carboxamide | Formula: | C29 H53 N5 O7 S | SMILES: | N1C(C2C(O1)OCC2)C(=O)NC(CSC)C(=O)NC(CC(C)C)C(CC(C(=O)NC(C(=O)NCC(C)C)C(C)C)C)O | InChi: | InChI=1S/C29H53N5O7S/c1-15(2)11-20(22(35)12-18(7)25(36)33-23(17(5)6)27(38)30-13-16(3)4)31-26(37)21(14-42-8)32-28(39)24-19-9-10-40-29(19)41-34-24/h15-24,29,34-35H,9-14H2,1-8H3,(H,30,38)(H,31,37)(H,32,39)(H,33,36)/t18-,19-,20+,21+,22+,23+,24-,29+/m1/s1 | Definition date: | 2018-05-22 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | (3R,3aR,6aS)-N-[(4R,7S,8S,10R,13S)-8-hydroxy-10,17-dimethyl-7-(2-methylpropyl)-5,11,14-trioxo-13-(propan-2-yl)-2-thia-6,12,15-triazaoctadecan-4-yl]hexahydrofuro[3,2-d][1,2]oxazole-3-carboxamide |
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![8U3 8U3](https://data.pdbj.org/pdbjplus/data/cc/svg/8U3.svg) | 8U3 | Name: | N-[3,4-bis(fluoranyl)phenyl]methanesulfonamide | Formula: | C7 H7 F2 N O2 S | SMILES: | C[S](=O)(=O)Nc1ccc(F)c(F)c1 | InChi: | InChI=1S/C7H7F2NO2S/c1-13(11,12)10-5-2-3-6(8)7(9)4-5/h2-4,10H,1H3 | Definition date: | 2017-09-26 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | ~{N}-[3,4-bis(fluoranyl)phenyl]methanesulfonamide |
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![8U6 8U6](https://data.pdbj.org/pdbjplus/data/cc/svg/8U6.svg) | 8U6 | Name: | N-[4-[(3-cyano-4-naphthalen-2-yloxy-phenyl)sulfamoyl]phenyl]ethanamide | Formula: | C25 H19 N3 O4 S | SMILES: | CC(=O)Nc1ccc(cc1)[S](=O)(=O)Nc2ccc(Oc3ccc4ccccc4c3)c(c2)C#N | InChi: | InChI=1S/C25H19N3O4S/c1-17(29)27-21-7-11-24(12-8-21)33(30,31)28-22-9-13-25(20(14-22)16-26)32-23-10-6-18-4-2-3-5-19(18)15-23/h2-15,28H,1H3,(H,27,29) | Definition date: | 2017-09-26 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | ~{N}-[4-[(3-cyano-4-naphthalen-2-yloxy-phenyl)sulfamoyl]phenyl]ethanamide |
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![8U9 8U9](https://data.pdbj.org/pdbjplus/data/cc/svg/8U9.svg) | 8U9 | Name: | 4-[[4-[4-chloranyl-3-(trifluoromethyl)phenoxy]-3-cyano-phenyl]sulfamoyl]benzoic acid | Formula: | C21 H12 Cl F3 N2 O5 S | SMILES: | OC(=O)c1ccc(cc1)[S](=O)(=O)Nc2ccc(Oc3ccc(Cl)c(c3)C(F)(F)F)c(c2)C#N | InChi: | InChI=1S/C21H12ClF3N2O5S/c22-18-7-4-15(10-17(18)21(23,24)25)32-19-8-3-14(9-13(19)11-26)27-33(30,31)16-5-1-12(2-6-16)20(28)29/h1-10,27H,(H,28,29) | Definition date: | 2017-09-26 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | 4-[[4-[4-chloranyl-3-(trifluoromethyl)phenoxy]-3-cyano-phenyl]sulfamoyl]benzoic acid |
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![E0V E0V](https://data.pdbj.org/pdbjplus/data/cc/svg/E0V.svg) | E0V | Name: | 4-(4-beta-D-glucopyranuronosylpiperazin-1-yl)-2,7-bis(methylamino)pyrido[3',2':4,5]thieno[3,2-d]pyrimidine | Formula: | C21 H27 N7 O6 S | SMILES: | C5(O)C(C(C(N1CCN(CC1)c4c3c(c2ccc(nc2s3)NC)nc(NC)n4)OC5C(=O)O)O)O | InChi: | InChI=1S/C21H27N7O6S/c1-22-10-4-3-9-11-16(35-18(9)24-10)17(26-21(23-2)25-11)27-5-7-28(8-6-27)19-14(31)12(29)13(30)15(34-19)20(32)33/h3-4,12-15,19,29-31H,5-8H2,1-2H3,(H,22,24)(H,32,33)(H,23,25,26)/t12-,13-,14+,15-,19+/m0/s1 | Definition date: | 2017-11-21 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | 4-(4-beta-D-glucopyranuronosylpiperazin-1-yl)-2,7-bis(methylamino)pyrido[3',2':4,5]thieno[3,2-d]pyrimidine |
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![FUV FUV](https://data.pdbj.org/pdbjplus/data/cc/svg/FUV.svg) | FUV | Name: | (5aR,9aR)-2-chloro-11-(4-beta-D-glucopyranuronosylpiperazin-1-yl)-5a,6,9,9a-tetrahydrodibenzo[b,f][1,4]oxazepine | Formula: | C23 H28 Cl N3 O7 | SMILES: | C(C5C(C(C(C(N1CCN(CC1)C=4c2c(ccc(c2)Cl)OC3C(CC=CC3)N=4)O5)O)O)O)(=O)O | InChi: | InChI=1S/C23H28ClN3O7/c24-12-5-6-15-13(11-12)21(25-14-3-1-2-4-16(14)33-15)26-7-9-27(10-8-26)22-19(30)17(28)18(29)20(34-22)23(31)32/h1-2,5-6,11,14,16-20,22,28-30H,3-4,7-10H2,(H,31,32)/t14-,16-,17+,18+,19-,20+,22-/m1/s1 | Definition date: | 2018-04-19 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | (5aR,9aR)-2-chloro-11-(4-beta-D-glucopyranuronosylpiperazin-1-yl)-5a,6,9,9a-tetrahydrodibenzo[b,f][1,4]oxazepine |
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![DWG DWG](https://data.pdbj.org/pdbjplus/data/cc/svg/DWG.svg) | DWG | Name: | (6aS,7S,9S,10aS)-7-methyl-8-oxo-10a-phenyl-2-(phenylamino)-5,6,6a,7,8,9,10,10a-octahydrobenzo[h]quinazoline-9-carbonitrile | Formula: | C26 H24 N4 O | SMILES: | C4(=O)C(C#N)CC5(c1ccccc1)c3c(cnc(Nc2ccccc2)n3)CCC5C4C | InChi: | InChI=1S/C26H24N4O/c1-17-22-13-12-18-16-28-25(29-21-10-6-3-7-11-21)30-24(18)26(22,14-19(15-27)23(17)31)20-8-4-2-5-9-20/h2-11,16-17,19,22H,12-14H2,1H3,(H,28,29,30)/t17-,19?,22-,26+/m0/s1 | Definition date: | 2017-11-10 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | (6aS,7S,9S,10aS)-7-methyl-8-oxo-10a-phenyl-2-(phenylamino)-5,6,6a,7,8,9,10,10a-octahydrobenzo[h]quinazoline-9-carbonitrile |
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![DWJ DWJ](https://data.pdbj.org/pdbjplus/data/cc/svg/DWJ.svg) | DWJ | Name: | (5aS,6S,8S,9aS)-2-(benzenecarbonyl)-6-methyl-7-oxo-9a-phenyl-4,5,5a,6,7,8,9,9a-octahydro-2H-benzo[g]indazole-8-carbonitrile | Formula: | C26 H23 N3 O2 | SMILES: | C1(C(=O)C(C3C(C1)(c2ccccc2)c5c(CC3)cn(C(c4ccccc4)=O)n5)C)C#N | InChi: | InChI=1S/C26H23N3O2/c1-17-22-13-12-19-16-29(25(31)18-8-4-2-5-9-18)28-24(19)26(22,14-20(15-27)23(17)30)21-10-6-3-7-11-21/h2-11,16-17,20,22H,12-14H2,1H3/t17-,20-,22-,26+/m0/s1 | Definition date: | 2017-11-10 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | (5aS,6S,8S,9aS)-2-(benzenecarbonyl)-6-methyl-7-oxo-9a-phenyl-4,5,5a,6,7,8,9,9a-octahydro-2H-benzo[g]indazole-8-carbonitrile |
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![DWM DWM](https://data.pdbj.org/pdbjplus/data/cc/svg/DWM.svg) | DWM | Name: | (7R)-1-[(4-fluorophenyl)methyl]-N-{3-[(1R)-1-hydroxyethyl]phenyl}-7-methyl-5-(1H-pyrrole-2-carbonyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide | Formula: | C28 H28 F N5 O3 | SMILES: | n4c(C(Nc1cccc(c1)C(C)O)=O)c3CN(C(c2cccn2)=O)CC(c3n4Cc5ccc(F)cc5)C | InChi: | InChI=1S/C28H28FN5O3/c1-17-14-33(28(37)24-7-4-12-30-24)16-23-25(27(36)31-22-6-3-5-20(13-22)18(2)35)32-34(26(17)23)15-19-8-10-21(29)11-9-19/h3-13,17-18,30,35H,14-16H2,1-2H3,(H,31,36)/t17-,18-/m1/s1 | Definition date: | 2017-11-10 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | (7R)-1-[(4-fluorophenyl)methyl]-N-{3-[(1R)-1-hydroxyethyl]phenyl}-7-methyl-5-(1H-pyrrole-2-carbonyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide |
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![DWP DWP](https://data.pdbj.org/pdbjplus/data/cc/svg/DWP.svg) | DWP | Name: | (6aS,7S,9R,10aS)-7,10a-dimethyl-8-oxo-2-(phenylamino)-5,6,6a,7,8,9,10,10a-octahydrobenzo[h]quinazoline-9-carbonitrile | Formula: | C21 H22 N4 O | SMILES: | C2Cc1cnc(nc1C3(CC(C(C(C23)C)=O)C#N)C)Nc4ccccc4 | InChi: | InChI=1S/C21H22N4O/c1-13-17-9-8-14-12-23-20(24-16-6-4-3-5-7-16)25-19(14)21(17,2)10-15(11-22)18(13)26/h3-7,12-13,15,17H,8-10H2,1-2H3,(H,23,24,25)/t13-,15+,17-,21-/m0/s1 | Definition date: | 2017-11-10 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | (6aS,7S,9R,10aS)-7,10a-dimethyl-8-oxo-2-(phenylamino)-5,6,6a,7,8,9,10,10a-octahydrobenzo[h]quinazoline-9-carbonitrile |
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![DWS DWS](https://data.pdbj.org/pdbjplus/data/cc/svg/DWS.svg) | DWS | Name: | 3-[(6aS,7S,9S,10aS)-9-cyano-7-methyl-8-oxo-2-(phenylamino)-6,6a,7,8,9,10-hexahydrobenzo[h]quinazolin-10a(5H)-yl]benzoic acid | Formula: | C27 H24 N4 O3 | SMILES: | c1c(cc(cc1)C45c2c(cnc(n2)Nc3ccccc3)CCC4C(C(C(C5)C#N)=O)C)C(=O)O | InChi: | InChI=1S/C27H24N4O3/c1-16-22-11-10-18-15-29-26(30-21-8-3-2-4-9-21)31-24(18)27(22,13-19(14-28)23(16)32)20-7-5-6-17(12-20)25(33)34/h2-9,12,15-16,19,22H,10-11,13H2,1H3,(H,33,34)(H,29,30,31)/t16-,19-,22-,27+/m0/s1 | Definition date: | 2017-11-10 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | 3-[(6aS,7S,9S,10aS)-9-cyano-7-methyl-8-oxo-2-(phenylamino)-6,6a,7,8,9,10-hexahydrobenzo[h]quinazolin-10a(5H)-yl]benzoic acid |
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![EUS EUS](https://data.pdbj.org/pdbjplus/data/cc/svg/EUS.svg) | EUS | Name: | N-[(1R,2S,3S,4R,5S)-5-amino-4-{[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy}-2-{[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl]oxy}-3-hydroxycyclohexyl]methanesulfonamide | Formula: | C20 H39 N5 O9 S | SMILES: | CS(=O)(NC2CC(N)C(OC1OC(=CCC1N)CN)C(C2OC3C(C(C(C)(CO3)O)NC)O)O)=O | InChi: | InChI=1S/C20H39N5O9S/c1-20(28)8-31-19(14(27)17(20)24-2)34-16-12(25-35(3,29)30)6-11(23)15(13(16)26)33-18-10(22)5-4-9(7-21)32-18/h4,10-19,24-28H,5-8,21-23H2,1-3H3/t10-,11+,12-,13+,14-,15-,16+,17-,18-,19-,20+/m1/s1 | Definition date: | 2018-02-01 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | N-[(1R,2S,3S,4R,5S)-5-amino-4-{[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy}-2-{[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl]oxy}-3-hydroxycyclohexyl]methanesulfonamide |
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![B0K B0K](https://data.pdbj.org/pdbjplus/data/cc/svg/B0K.svg) | B0K | Name: | 3-[4,5,6,7-tetrakis(bromanyl)benzimidazol-1-yl]propan-1-amine | Formula: | C10 H9 Br4 N3 | SMILES: | NCCCn1cnc2c(Br)c(Br)c(Br)c(Br)c12 | InChi: | InChI=1S/C10H9Br4N3/c11-5-6(12)8(14)10-9(7(5)13)16-4-17(10)3-1-2-15/h4H,1-3,15H2 | Definition date: | 2017-09-01 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | 3-[4,5,6,7-tetrakis(bromanyl)benzimidazol-1-yl]propan-1-amine |
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![8J0 8J0](https://data.pdbj.org/pdbjplus/data/cc/svg/8J0.svg) | 8J0 | Name: | (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,6S)-6-(1-adamantyl)-6-oxidanyl-hex-4-yn-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidene-cyclohexane-1,3-diol | Formula: | C35 H50 O3 | SMILES: | C[CH](CC#C[CH](O)C12CC3CC(CC(C3)C1)C2)[CH]4CC[CH]5C(CCC[C]45C)=CC=C6C[CH](O)C[CH](O)C6=C | InChi: | InChI=1S/C35H50O3/c1-22(6-4-8-33(38)35-19-24-14-25(20-35)16-26(15-24)21-35)30-11-12-31-27(7-5-13-34(30,31)3)9-10-28-17-29(36)18-32(37)23(28)2/h9-10,22,24-26,29-33,36-38H,2,5-7,11-21H2,1,3H3/b27-9+,28-10-/t22-,24-,25+,26-,29-,30-,31+,32+,33-,34-,35-/m1/s1 | Definition date: | 2017-07-13 | Last modified: | 2018-07-20 | Release date: | 2018-07-25 | Identifier: | (1~{R},3~{S},5~{Z})-5-[(2~{E})-2-[(1~{R},3~{a}~{S},7~{a}~{R})-1-[(2~{R},6~{S})-6-(1-adamantyl)-6-oxidanyl-hex-4-yn-2-yl]-7~{a}-methyl-2,3,3~{a},5,6,7-hexahydro-1~{H}-inden-4-ylidene]ethylidene]-4-methylidene-cyclohexane-1,3-diol |
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