![7KV 7KV](https://data.pdbj.org/pdbjplus/data/cc/svg/7KV.svg) | 7KV | Name: | 1-[(3aR,7aR)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)octahydro-6H-pyrrolo[2,3-c]pyridin-6-yl]propan-1-one | Formula: | C16 H21 N5 O | SMILES: | n2c1ncnc(c1cc2)N3CCC4C3CN(C(=O)CC)CC4 | InChi: | InChI=1S/C16H21N5O/c1-2-14(22)20-7-4-11-5-8-21(13(11)9-20)16-12-3-6-17-15(12)18-10-19-16/h3,6,10-11,13H,2,4-5,7-9H2,1H3,(H,17,18,19)/t11-,13-/m0/s1 | Definition date: | 2016-11-07 | Last modified: | 2017-02-17 | Release date: | 2017-02-22 | Identifier: | 1-[(3aR,7aR)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)octahydro-6H-pyrrolo[2,3-c]pyridin-6-yl]propan-1-one |
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![86M 86M](https://data.pdbj.org/pdbjplus/data/cc/svg/86M.svg) | 86M | Name: | 5-[(imidazo[1,2-a]pyridin-8-yl)methoxy]-2-methoxypyridine-4-carbaldehyde | Formula: | C15 H13 N3 O3 | SMILES: | c2cn3ccnc3c(COc1cnc(OC)cc1C=O)c2 | InChi: | InChI=1S/C15H13N3O3/c1-20-14-7-12(9-19)13(8-17-14)21-10-11-3-2-5-18-6-4-16-15(11)18/h2-9H,10H2,1H3 | Definition date: | 2017-01-09 | Last modified: | 2017-02-17 | Release date: | 2017-02-22 | Identifier: | 5-[(imidazo[1,2-a]pyridin-8-yl)methoxy]-2-methoxypyridine-4-carbaldehyde |
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![7OG 7OG](https://data.pdbj.org/pdbjplus/data/cc/svg/7OG.svg) | 7OG | Name: | [(3S)-3-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl](naphthalen-2-yl)methanone | Formula: | C22 H21 N5 O | SMILES: | c51ncnn1c(C4CN(C(c3ccc2c(cccc2)c3)=O)CCC4)cc(C)n5 | InChi: | InChI=1S/C22H21N5O/c1-15-11-20(27-22(25-15)23-14-24-27)19-7-4-10-26(13-19)21(28)18-9-8-16-5-2-3-6-17(16)12-18/h2-3,5-6,8-9,11-12,14,19H,4,7,10,13H2,1H3/t19-/m0/s1 | Definition date: | 2016-11-25 | Last modified: | 2017-02-17 | Release date: | 2017-02-22 | Identifier: | [(3S)-3-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl](naphthalen-2-yl)methanone |
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![7OJ 7OJ](https://data.pdbj.org/pdbjplus/data/cc/svg/7OJ.svg) | 7OJ | Name: | (3-bromo-4-fluorophenyl)[(5S)-3,3-difluoro-5-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl]methanone | Formula: | C18 H15 Br F3 N5 O | SMILES: | n2c1ncnn1c(cc2C)C4CC(F)(CN(C(c3cc(Br)c(cc3)F)=O)C4)F | InChi: | InChI=1S/C18H15BrF3N5O/c1-10-4-15(27-17(25-10)23-9-24-27)12-6-18(21,22)8-26(7-12)16(28)11-2-3-14(20)13(19)5-11/h2-5,9,12H,6-8H2,1H3/t12-/m0/s1 | Definition date: | 2016-11-25 | Last modified: | 2017-02-17 | Release date: | 2017-02-22 | Identifier: | (3-bromo-4-fluorophenyl)[(5S)-3,3-difluoro-5-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl]methanone |
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![7OP 7OP](https://data.pdbj.org/pdbjplus/data/cc/svg/7OP.svg) | 7OP | Name: | [(5S)-3,3-difluoro-5-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl](4-fluorophenyl)methanone | Formula: | C18 H16 F3 N5 O | SMILES: | n2c1ncnn1c(cc2C)C4CC(F)(CN(C(c3ccc(cc3)F)=O)C4)F | InChi: | InChI=1S/C18H16F3N5O/c1-11-6-15(26-17(24-11)22-10-23-26)13-7-18(20,21)9-25(8-13)16(27)12-2-4-14(19)5-3-12/h2-6,10,13H,7-9H2,1H3/t13-/m0/s1 | Definition date: | 2016-11-25 | Last modified: | 2017-02-17 | Release date: | 2017-02-22 | Identifier: | [(5S)-3,3-difluoro-5-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl](4-fluorophenyl)methanone |
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![7OV 7OV](https://data.pdbj.org/pdbjplus/data/cc/svg/7OV.svg) | 7OV | Name: | [(5S)-3,3-difluoro-5-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl](4-fluoro-3-iodophenyl)methanone | Formula: | C18 H15 F3 I N5 O | SMILES: | n4c1ncnn1c(C3CC(F)(CN(C(c2cc(c(F)cc2)I)=O)C3)F)cc4C | InChi: | InChI=1S/C18H15F3IN5O/c1-10-4-15(27-17(25-10)23-9-24-27)12-6-18(20,21)8-26(7-12)16(28)11-2-3-13(19)14(22)5-11/h2-5,9,12H,6-8H2,1H3/t12-/m0/s1 | Definition date: | 2016-11-28 | Last modified: | 2017-02-17 | Release date: | 2017-02-22 | Identifier: | [(5S)-3,3-difluoro-5-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl](4-fluoro-3-iodophenyl)methanone |
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![7OY 7OY](https://data.pdbj.org/pdbjplus/data/cc/svg/7OY.svg) | 7OY | Name: | (3-chloro-4-fluorophenyl)[(5S)-3,3-difluoro-5-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl]methanone | Formula: | C18 H15 Cl F3 N5 O | SMILES: | n2c1ncnn1c(cc2C)C4CC(F)(CN(C(c3cc(Cl)c(cc3)F)=O)C4)F | InChi: | InChI=1S/C18H15ClF3N5O/c1-10-4-15(27-17(25-10)23-9-24-27)12-6-18(21,22)8-26(7-12)16(28)11-2-3-14(20)13(19)5-11/h2-5,9,12H,6-8H2,1H3/t12-/m0/s1 | Definition date: | 2016-11-28 | Last modified: | 2017-02-17 | Release date: | 2017-02-22 | Identifier: | (3-chloro-4-fluorophenyl)[(5S)-3,3-difluoro-5-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl]methanone |
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![7P4 7P4](https://data.pdbj.org/pdbjplus/data/cc/svg/7P4.svg) | 7P4 | Name: | [(5S)-3,3-difluoro-5-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl](3,4-difluorophenyl)methanone | Formula: | C18 H15 F4 N5 O | SMILES: | n2c1ncnn1c(cc2C)C4CC(F)(CN(C(c3cc(F)c(cc3)F)=O)C4)F | InChi: | InChI=1S/C18H15F4N5O/c1-10-4-15(27-17(25-10)23-9-24-27)12-6-18(21,22)8-26(7-12)16(28)11-2-3-13(19)14(20)5-11/h2-5,9,12H,6-8H2,1H3/t12-/m0/s1 | Definition date: | 2016-11-28 | Last modified: | 2017-02-17 | Release date: | 2017-02-22 | Identifier: | [(5S)-3,3-difluoro-5-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl](3,4-difluorophenyl)methanone |
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![I73 I73](https://data.pdbj.org/pdbjplus/data/cc/svg/I73.svg) | I73 | Name: | (3S,4S)-4-[[[7-[(phenylmethyl)amino]-3-propan-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl]amino]methyl]piperidin-3-ol | Formula: | C22 H30 N6 O | SMILES: | n2c(cc(NCc1ccccc1)n3ncc(c23)C(C)C)NCC4CCNCC4O | InChi: | InChI=1S/C22H30N6O/c1-15(2)18-13-26-28-21(25-11-16-6-4-3-5-7-16)10-20(27-22(18)28)24-12-17-8-9-23-14-19(17)29/h3-7,10,13,15,17,19,23,25,29H,8-9,11-12,14H2,1-2H3,(H,24,27)/t17-,19+/m0/s1 | Definition date: | 2014-02-28 | Last modified: | 2017-02-03 | Release date: | 2017-02-08 | Identifier: | (3S,4S)-4-({[7-(benzylamino)-3-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]amino}methyl)piperidin-3-ol |
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![I74 I74](https://data.pdbj.org/pdbjplus/data/cc/svg/I74.svg) | I74 | Name: | (3R,4R)-4-[[[7-[(phenylmethyl)amino]-3-propan-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl]amino]methyl]piperidin-3-ol | Formula: | C22 H30 N6 O | SMILES: | n2c(cc(NCc1ccccc1)n3ncc(c23)C(C)C)NCC4CCNCC4O | InChi: | InChI=1S/C22H30N6O/c1-15(2)18-13-26-28-21(25-11-16-6-4-3-5-7-16)10-20(27-22(18)28)24-12-17-8-9-23-14-19(17)29/h3-7,10,13,15,17,19,23,25,29H,8-9,11-12,14H2,1-2H3,(H,24,27)/t17-,19+/m1/s1 | Definition date: | 2014-02-28 | Last modified: | 2017-02-03 | Release date: | 2017-02-08 | Identifier: | (3R,4R)-4-({[7-(benzylamino)-3-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]amino}methyl)piperidin-3-ol |
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![86J 86J](https://data.pdbj.org/pdbjplus/data/cc/svg/86J.svg) | 86J | Name: | 6-fluoro-2-methylimidazo[1,2-a]pyridin-3-amine | Formula: | C8 H8 F N3 | SMILES: | c1(n2c(nc1C)ccc(F)c2)N | InChi: | InChI=1S/C8H8FN3/c1-5-8(10)12-4-6(9)2-3-7(12)11-5/h2-4H,10H2,1H3 | Definition date: | 2017-01-09 | Last modified: | 2017-01-26 | Release date: | 2017-02-01 | Identifier: | 6-fluoro-2-methylimidazo[1,2-a]pyridin-3-amine |
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![7W4 7W4](https://data.pdbj.org/pdbjplus/data/cc/svg/7W4.svg) | 7W4 | Name: | 2-methylimidazo[1,2-a]pyridin-3-amine | Formula: | C8 H9 N3 | SMILES: | Cc1c(n2c(n1)cccc2)N | InChi: | InChI=1S/C8H9N3/c1-6-8(9)11-5-3-2-4-7(11)10-6/h2-5H,9H2,1H3 | Definition date: | 2016-12-08 | Last modified: | 2017-01-26 | Release date: | 2017-02-01 | Identifier: | 2-methylimidazo[1,2-a]pyridin-3-amine |
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![6ZK 6ZK](https://data.pdbj.org/pdbjplus/data/cc/svg/6ZK.svg) | 6ZK | Name: | 4-[4-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]benzamide | Formula: | C25 H19 Br N6 O | SMILES: | NC(=O)c1ccc(cc1)c2ccc(cc2)c3cc(NCc4cccnc4)n5ncc(Br)c5n3 | InChi: | InChI=1S/C25H19BrN6O/c26-21-15-30-32-23(29-14-16-2-1-11-28-13-16)12-22(31-25(21)32)19-7-3-17(4-8-19)18-5-9-20(10-6-18)24(27)33/h1-13,15,29H,14H2,(H2,27,33) | Definition date: | 2016-08-01 | Last modified: | 2017-01-20 | Release date: | 2017-01-25 | Identifier: | 4-[4-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]benzamide |
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![64Q 64Q](https://data.pdbj.org/pdbjplus/data/cc/svg/64Q.svg) | 64Q | Name: | 7-methyl-N-(o-tolyl)-[1,2,4]triazolo[4,3-a]pyrimidin-5-amine | Formula: | C13 H13 N5 | SMILES: | c3c(c(Nc1cc(C)nc2n1cnn2)ccc3)C | InChi: | InChI=1S/C13H13N5/c1-9-5-3-4-6-11(9)16-12-7-10(2)15-13-17-14-8-18(12)13/h3-8,16H,1-2H3 | Definition date: | 2016-01-26 | Last modified: | 2017-01-20 | Release date: | 2017-01-25 | Identifier: | 7-methyl-N-(2-methylphenyl)[1,2,4]triazolo[4,3-a]pyrimidin-5-amine |
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![LQA LQA](https://data.pdbj.org/pdbjplus/data/cc/svg/LQA.svg) | LQA | Name: | 4-azanylidene-2-(3-methoxy-4-propan-2-yloxy-phenyl)-6,7-dihydro-[1,3]benzodioxolo[6,5-a]quinolizine-3-carbonitrile | Formula: | C25 H23 N3 O4 | SMILES: | COc1cc(ccc1OC(C)C)C2=C(C#N)C(=N)N3CCc4cc5OCOc5cc4C3=C2 | InChi: | InChI=1S/C25H23N3O4/c1-14(2)32-21-5-4-15(8-22(21)29-3)17-10-20-18-11-24-23(30-13-31-24)9-16(18)6-7-28(20)25(27)19(17)12-26/h4-5,8-11,14,27H,6-7,13H2,1-3H3/b27-25- | Definition date: | 2016-10-17 | Last modified: | 2017-01-20 | Release date: | 2017-01-25 | Identifier: | 4-azanylidene-2-(3-methoxy-4-propan-2-yloxy-phenyl)-6,7-dihydro-[1,3]benzodioxolo[6,5-a]quinolizine-3-carbonitrile |
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![LQE LQE](https://data.pdbj.org/pdbjplus/data/cc/svg/LQE.svg) | LQE | Name: | (3R,4aS,10aS)-6-methoxy-3-[(3-methoxyphenyl)methyl]-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinoline | Formula: | C23 H29 N O2 | SMILES: | COc1cccc(C[CH]2C[CH]3Cc4c(C[CH]3N(C)C2)cccc4OC)c1 | InChi: | InChI=1S/C23H29NO2/c1-24-15-17(10-16-6-4-8-20(12-16)25-2)11-19-13-21-18(14-22(19)24)7-5-9-23(21)26-3/h4-9,12,17,19,22H,10-11,13-15H2,1-3H3/t17-,19-,22-/m0/s1 | Definition date: | 2016-10-17 | Last modified: | 2017-01-20 | Release date: | 2017-01-25 | Identifier: | (3~{R},4~{a}~{S},10~{a}~{S})-6-methoxy-3-[(3-methoxyphenyl)methyl]-1-methyl-3,4,4~{a},5,10,10~{a}-hexahydro-2~{H}-benzo[g]quinoline |
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![LQF LQF](https://data.pdbj.org/pdbjplus/data/cc/svg/LQF.svg) | LQF | Name: | 5-(furan-2-ylmethylamino)-9-(phenylmethyl)-8,10-dihydro-7H-[1,2,4]triazolo[3,4-a][2,7]naphthyridine-6-carbonitrile | Formula: | C22 H20 N6 O | SMILES: | N#Cc1c2CCN(Cc3ccccc3)Cc2c4nncn4c1NCc5occc5 | InChi: | InChI=1S/C22H20N6O/c23-11-19-18-8-9-27(13-16-5-2-1-3-6-16)14-20(18)22-26-25-15-28(22)21(19)24-12-17-7-4-10-29-17/h1-7,10,15,24H,8-9,12-14H2 | Definition date: | 2016-10-17 | Last modified: | 2017-01-20 | Release date: | 2017-01-25 | Identifier: | 5-(furan-2-ylmethylamino)-9-(phenylmethyl)-8,10-dihydro-7~{H}-[1,2,4]triazolo[3,4-a][2,7]naphthyridine-6-carbonitrile |
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![LQG LQG](https://data.pdbj.org/pdbjplus/data/cc/svg/LQG.svg) | LQG | Name: | 5-(furan-2-ylmethylamino)-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile | Formula: | C12 H9 N5 O | SMILES: | N#Cc1ccc2nncn2c1NCc3occc3 | InChi: | InChI=1S/C12H9N5O/c13-6-9-3-4-11-16-15-8-17(11)12(9)14-7-10-2-1-5-18-10/h1-5,8,14H,7H2 | Definition date: | 2016-10-17 | Last modified: | 2017-01-20 | Release date: | 2017-01-25 | Identifier: | 5-(furan-2-ylmethylamino)-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile |
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![LQH LQH](https://data.pdbj.org/pdbjplus/data/cc/svg/LQH.svg) | LQH | Name: | 5-(2-fluorophenyl)-2,3-dihydroimidazo[2,1-a]isoquinoline | Formula: | C17 H13 F N2 | SMILES: | Fc1ccccc1C2=Cc3ccccc3C4=NCCN24 | InChi: | InChI=1S/C17H13FN2/c18-15-8-4-3-7-14(15)16-11-12-5-1-2-6-13(12)17-19-9-10-20(16)17/h1-8,11H,9-10H2 | Definition date: | 2016-10-17 | Last modified: | 2017-01-20 | Release date: | 2017-01-25 | Identifier: | 5-(2-fluorophenyl)-2,3-dihydroimidazo[2,1-a]isoquinoline |
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![XNP XNP](https://data.pdbj.org/pdbjplus/data/cc/svg/XNP.svg) | XNP | Name: | Tricyclic NADPH | Formula: | C21 H30 N7 O17 P3 | SMILES: | NC(=O)C1=CN2[CH](CC1)O[CH]3[CH](O)[CH](CO[P](O)(=O)O[P](O)(=O)OC[CH]4O[CH]([CH](O[P](O)(O)=O)[CH]4O)n5cnc6c(N)ncnc56)O[CH]23 | InChi: | InChI=1S/C21H30N7O17P3/c22-17-12-19(25-6-24-17)28(7-26-12)21-16(44-46(32,33)34)14(30)10(42-21)5-40-48(37,38)45-47(35,36)39-4-9-13(29)15-20(41-9)27-3-8(18(23)31)1-2-11(27)43-15/h3,6-7,9-11,13-16,20-21,29-30H,1-2,4-5H2,(H2,23,31)(H,35,36)(H,37,38)(H2,22,24,25)(H2,32,33,34)/t9-,10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 | Definition date: | 2016-01-07 | Last modified: | 2017-01-13 | Release date: | 2017-01-18 | Identifier: | [[(2~{R},3~{R},3~{a}~{R},4~{a}~{R},9~{a}~{R})-7-aminocarbonyl-3-oxidanyl-3,3~{a},4~{a},5,6,9~{a}-hexahydro-2~{H}-furo[1,2][1,3]oxazolo[3,4-~{a}]pyridin-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{R},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3-oxidanyl-4-phosphonooxy-oxolan-2-yl]methyl hydrogen phosphate |
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![6WM 6WM](https://data.pdbj.org/pdbjplus/data/cc/svg/6WM.svg) | 6WM | Name: | (8~{R},9~{S},13~{S},14~{S},16~{R},17~{S})-13-methyl-16-(phenylmethyl)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol | Formula: | C25 H30 O2 | SMILES: | C[C]12CC[CH]3[CH](CCc4cc(O)ccc34)[CH]1C[CH](Cc5ccccc5)[CH]2O | InChi: | InChI=1S/C25H30O2/c1-25-12-11-21-20-10-8-19(26)14-17(20)7-9-22(21)23(25)15-18(24(25)27)13-16-5-3-2-4-6-16/h2-6,8,10,14,18,21-24,26-27H,7,9,11-13,15H2,1H3/t18-,21+,22+,23-,24-,25-/m0/s1 | Definition date: | 2016-07-11 | Last modified: | 2017-01-13 | Release date: | 2017-01-18 | Identifier: | (8~{R},9~{S},13~{S},14~{S},16~{R},17~{S})-13-methyl-16-(phenylmethyl)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol |
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![6WR 6WR](https://data.pdbj.org/pdbjplus/data/cc/svg/6WR.svg) | 6WR | Name: | (1~{S},3~{a}~{R},7~{a}~{S})-5-(2-chloranyl-4-oxidanyl-phenyl)-2,3,3~{a},4,7,7~{a}-hexahydro-1~{H}-inden-1-ol | Formula: | C15 H17 Cl O2 | SMILES: | O[CH]1CC[CH]2CC(=CC[CH]12)c3ccc(O)cc3Cl | InChi: | InChI=1S/C15H17ClO2/c16-14-8-11(17)3-5-12(14)9-1-4-13-10(7-9)2-6-15(13)18/h1,3,5,8,10,13,15,17-18H,2,4,6-7H2/t10-,13+,15+/m1/s1 | Definition date: | 2016-07-11 | Last modified: | 2017-01-13 | Release date: | 2017-01-18 | Identifier: | (1~{S},3~{a}~{R},7~{a}~{S})-5-(2-chloranyl-4-oxidanyl-phenyl)-2,3,3~{a},4,7,7~{a}-hexahydro-1~{H}-inden-1-ol |
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![6WU 6WU](https://data.pdbj.org/pdbjplus/data/cc/svg/6WU.svg) | 6WU | Name: | (1~{S},3~{a}~{R},7~{a}~{S})-5-[2,5-bis(fluoranyl)-4-oxidanyl-phenyl]-7~{a}-methyl-1,2,3,3~{a},4,7-hexahydroinden-1-ol | Formula: | C16 H18 F2 O2 | SMILES: | C[C]12CC=C(C[CH]1CC[CH]2O)c3cc(F)c(O)cc3F | InChi: | InChI=1S/C16H18F2O2/c1-16-5-4-9(6-10(16)2-3-15(16)20)11-7-13(18)14(19)8-12(11)17/h4,7-8,10,15,19-20H,2-3,5-6H2,1H3/t10-,15+,16+/m1/s1 | Definition date: | 2016-07-11 | Last modified: | 2017-01-13 | Release date: | 2017-01-18 | Identifier: | (1~{S},3~{a}~{R},7~{a}~{S})-5-[2,5-bis(fluoranyl)-4-oxidanyl-phenyl]-7~{a}-methyl-1,2,3,3~{a},4,7-hexahydroinden-1-ol |
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![6WV 6WV](https://data.pdbj.org/pdbjplus/data/cc/svg/6WV.svg) | 6WV | Name: | (8~{R},9~{S},13~{S},14~{S},17~{S})-13-methyl-17-phenylazanyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-ol | Formula: | C24 H29 N O | SMILES: | C[C]12CC[CH]3[CH](CCc4cc(O)ccc34)[CH]1CC[CH]2Nc5ccccc5 | InChi: | InChI=1S/C24H29NO/c1-24-14-13-20-19-10-8-18(26)15-16(19)7-9-21(20)22(24)11-12-23(24)25-17-5-3-2-4-6-17/h2-6,8,10,15,20-23,25-26H,7,9,11-14H2,1H3/t20-,21-,22+,23+,24+/m1/s1 | Definition date: | 2016-07-11 | Last modified: | 2017-01-13 | Release date: | 2017-01-18 | Identifier: | (8~{R},9~{S},13~{S},14~{S},17~{S})-13-methyl-17-phenylazanyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-ol |
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![6WW 6WW](https://data.pdbj.org/pdbjplus/data/cc/svg/6WW.svg) | 6WW | Name: | (8~{R},9~{S},13~{S},14~{S},17~{S})-13-methyl-17-[methyl(phenyl)amino]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-ol | Formula: | C25 H31 N O | SMILES: | CN([CH]1CC[CH]2[CH]3CCc4cc(O)ccc4[CH]3CC[C]12C)c5ccccc5 | InChi: | InChI=1S/C25H31NO/c1-25-15-14-21-20-11-9-19(27)16-17(20)8-10-22(21)23(25)12-13-24(25)26(2)18-6-4-3-5-7-18/h3-7,9,11,16,21-24,27H,8,10,12-15H2,1-2H3/t21-,22-,23+,24+,25+/m1/s1 | Definition date: | 2016-07-11 | Last modified: | 2017-01-13 | Release date: | 2017-01-18 | Identifier: | (8~{R},9~{S},13~{S},14~{S},17~{S})-13-methyl-17-[methyl(phenyl)amino]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-ol |
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