![GOD GOD](https://data.pdbj.org/pdbjplus/data/cc/svg/GOD.svg) | GOD | Name: | 6-amino-5-{[(3S)-4,4-difluoro-1-{[4-(trifluoromethoxy)phenyl]acetyl}pyrrolidin-3-yl]oxy}-N-methylpyridine-3-carboxamide | Formula: | C20 H19 F5 N4 O4 | SMILES: | c3c(cc(OC2C(F)(CN(C(=O)Cc1ccc(cc1)OC(F)(F)F)C2)F)c(N)n3)C(=O)NC | InChi: | InChI=1S/C20H19F5N4O4/c1-27-18(31)12-7-14(17(26)28-8-12)32-15-9-29(10-19(15,21)22)16(30)6-11-2-4-13(5-3-11)33-20(23,24)25/h2-5,7-8,15H,6,9-10H2,1H3,(H2,26,28)(H,27,31)/t15-/m0/s1 | Definition date: | 2018-05-30 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 6-amino-5-{[(3S)-4,4-difluoro-1-{[4-(trifluoromethoxy)phenyl]acetyl}pyrrolidin-3-yl]oxy}-N-methylpyridine-3-carboxamide |
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![GXA GXA](https://data.pdbj.org/pdbjplus/data/cc/svg/GXA.svg) | GXA | Name: | 5-(1-methyl-1H-imidazol-4-yl)-2-[(1-{[4-(trifluoromethoxy)phenyl]acetyl}piperidin-4-yl)oxy]benzamide | Formula: | C25 H25 F3 N4 O4 | SMILES: | NC(c3c(OC2CCN(C(Cc1ccc(cc1)OC(F)(F)F)=O)CC2)ccc(c3)c4ncn(C)c4)=O | InChi: | InChI=1S/C25H25F3N4O4/c1-31-14-21(30-15-31)17-4-7-22(20(13-17)24(29)34)35-18-8-10-32(11-9-18)23(33)12-16-2-5-19(6-3-16)36-25(26,27)28/h2-7,13-15,18H,8-12H2,1H3,(H2,29,34) | Definition date: | 2018-06-01 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 5-(1-methyl-1H-imidazol-4-yl)-2-[(1-{[4-(trifluoromethoxy)phenyl]acetyl}piperidin-4-yl)oxy]benzamide |
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![8U8 8U8](https://data.pdbj.org/pdbjplus/data/cc/svg/8U8.svg) | 8U8 | Name: | (2~{R},3~{S},4~{S},5~{R},6~{S})-6-(4-methyl-2-oxidanylidene-chromen-7-yl)oxy-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid | Formula: | C16 H16 O9 | SMILES: | CC1=CC(=O)Oc2cc(O[CH]3O[CH]([CH](O)[CH](O)[CH]3O)C(O)=O)ccc12 | InChi: | InChI=1S/C16H16O9/c1-6-4-10(17)24-9-5-7(2-3-8(6)9)23-16-13(20)11(18)12(19)14(25-16)15(21)22/h2-5,11-14,16,18-20H,1H3,(H,21,22)/t11-,12-,13+,14+,16+/m0/s1 | Definition date: | 2017-03-09 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2~{R},3~{S},4~{S},5~{R},6~{S})-6-(4-methyl-2-oxidanylidene-chromen-7-yl)oxy-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid |
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![8V9 8V9](https://data.pdbj.org/pdbjplus/data/cc/svg/8V9.svg) | 8V9 | Name: | (4R)-3-[(2S,3S)-3-[[(2R)-2-[2-(4-hydroxyphenyl)ethanoylamino]-3-methylsulfanyl-propanoyl]amino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-N-[(1S,2R)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]-1,3-thiazolidine-4-carboxamide | Formula: | C37 H44 N4 O7 S2 | SMILES: | CSC[CH](NC(=O)Cc1ccc(O)cc1)C(=O)N[CH](Cc2ccccc2)[CH](O)C(=O)N3CSC(C)(C)[CH]3C(=O)N[CH]4[CH](O)Cc5ccccc45 | InChi: | InChI=1S/C37H44N4O7S2/c1-37(2)33(35(47)40-31-26-12-8-7-11-24(26)19-29(31)43)41(21-50-37)36(48)32(45)27(17-22-9-5-4-6-10-22)39-34(46)28(20-49-3)38-30(44)18-23-13-15-25(42)16-14-23/h4-16,27-29,31-33,42-43,45H,17-21H2,1-3H3,(H,38,44)(H,39,46)(H,40,47)/t27-,28-,29+,31-,32-,33+/m0/s1 | Definition date: | 2017-10-04 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (4~{R})-3-[(2~{S},3~{S})-3-[[(2~{R})-2-[2-(4-hydroxyphenyl)ethanoylamino]-3-methylsulfanyl-propanoyl]amino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-~{N}-[(1~{S},2~{R})-2-oxidanyl-2,3-dihydro-1~{H}-inden-1-yl]-1,3-thiazolidine-4-carboxamide |
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![8VC 8VC](https://data.pdbj.org/pdbjplus/data/cc/svg/8VC.svg) | 8VC | Name: | (4R)-3-[(2S,3S)-3-[2-[4-[2-(dimethylamino)ethyl-methyl-amino]-2,6-dimethyl-phenoxy]ethanoylamino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-N-[(1S,2R)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]-1,3-thiazolidine-4-carboxamide | Formula: | C40 H53 N5 O6 S | SMILES: | CN(C)CCN(C)c1cc(C)c(OCC(=O)N[CH](Cc2ccccc2)[CH](O)C(=O)N3CSC(C)(C)[CH]3C(=O)N[CH]4[CH](O)Cc5ccccc45)c(C)c1 | InChi: | InChI=1S/C40H53N5O6S/c1-25-19-29(44(7)18-17-43(5)6)20-26(2)36(25)51-23-33(47)41-31(21-27-13-9-8-10-14-27)35(48)39(50)45-24-52-40(3,4)37(45)38(49)42-34-30-16-12-11-15-28(30)22-32(34)46/h8-16,19-20,31-32,34-35,37,46,48H,17-18,21-24H2,1-7H3,(H,41,47)(H,42,49)/t31-,32+,34-,35-,37+/m0/s1 | Definition date: | 2017-10-04 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (4~{R})-3-[(2~{S},3~{S})-3-[2-[4-[2-(dimethylamino)ethyl-methyl-amino]-2,6-dimethyl-phenoxy]ethanoylamino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-~{N}-[(1~{S},2~{R})-2-oxidanyl-2,3-dihydro-1~{H}-inden-1-yl]-1,3-thiazolidine-4-carboxamide |
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![8VF 8VF](https://data.pdbj.org/pdbjplus/data/cc/svg/8VF.svg) | 8VF | Name: | (4R)-3-[(2S,3S)-3-[2-[4-[2-azanylethyl(ethyl)amino]-2,6-dimethyl-phenoxy]ethanoylamino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-N-[(1S,2R)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]-1,3-thiazolidine-4-carboxamide | Formula: | C39 H51 N5 O6 S | SMILES: | CCN(CCN)c1cc(C)c(OCC(=O)N[CH](Cc2ccccc2)[CH](O)C(=O)N3CSC(C)(C)[CH]3C(=O)N[CH]4[CH](O)Cc5ccccc45)c(C)c1 | InChi: | InChI=1S/C39H51N5O6S/c1-6-43(17-16-40)28-18-24(2)35(25(3)19-28)50-22-32(46)41-30(20-26-12-8-7-9-13-26)34(47)38(49)44-23-51-39(4,5)36(44)37(48)42-33-29-15-11-10-14-27(29)21-31(33)45/h7-15,18-19,30-31,33-34,36,45,47H,6,16-17,20-23,40H2,1-5H3,(H,41,46)(H,42,48)/t30-,31+,33-,34-,36+/m0/s1 | Definition date: | 2017-10-04 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (4~{R})-3-[(2~{S},3~{S})-3-[2-[4-[2-azanylethyl(ethyl)amino]-2,6-dimethyl-phenoxy]ethanoylamino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-~{N}-[(1~{S},2~{R})-2-oxidanyl-2,3-dihydro-1~{H}-inden-1-yl]-1,3-thiazolidine-4-carboxamide |
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![8VO 8VO](https://data.pdbj.org/pdbjplus/data/cc/svg/8VO.svg) | 8VO | Name: | (4R)-3-[(2S,3S)-3-[[(2R)-2-[2-(4-aminophenyl)ethanoylamino]-3-methylsulfanyl-propanoyl]amino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-N-[(1S,2R)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]-1,3-thiazolidine-4-carboxamide | Formula: | C37 H45 N5 O6 S2 | SMILES: | CSC[CH](NC(=O)Cc1ccc(N)cc1)C(=O)N[CH](Cc2ccccc2)[CH](O)C(=O)N3CSC(C)(C)[CH]3C(=O)N[CH]4[CH](O)Cc5ccccc45 | InChi: | InChI=1S/C37H45N5O6S2/c1-37(2)33(35(47)41-31-26-12-8-7-11-24(26)19-29(31)43)42(21-50-37)36(48)32(45)27(17-22-9-5-4-6-10-22)40-34(46)28(20-49-3)39-30(44)18-23-13-15-25(38)16-14-23/h4-16,27-29,31-33,43,45H,17-21,38H2,1-3H3,(H,39,44)(H,40,46)(H,41,47)/t27-,28-,29+,31-,32-,33+/m0/s1 | Definition date: | 2017-10-04 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (4~{R})-3-[(2~{S},3~{S})-3-[[(2~{R})-2-[2-(4-aminophenyl)ethanoylamino]-3-methylsulfanyl-propanoyl]amino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-~{N}-[(1~{S},2~{R})-2-oxidanyl-2,3-dihydro-1~{H}-inden-1-yl]-1,3-thiazolidine-4-carboxamide |
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![8YO 8YO](https://data.pdbj.org/pdbjplus/data/cc/svg/8YO.svg) | 8YO | Name: | 7-methoxy-1-benzofuran-2-carboxylic acid | Formula: | C10 H8 O4 | SMILES: | COc1cccc2cc(oc12)C(O)=O | InChi: | InChI=1S/C10H8O4/c1-13-7-4-2-3-6-5-8(10(11)12)14-9(6)7/h2-5H,1H3,(H,11,12) | Definition date: | 2017-11-09 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 7-methoxy-1-benzofuran-2-carboxylic acid |
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![8YR 8YR](https://data.pdbj.org/pdbjplus/data/cc/svg/8YR.svg) | 8YR | Name: | (2S)-2-azanyl-2-[(3R)-oxolan-3-yl]ethanoic acid | Formula: | C6 H11 N O3 | SMILES: | N[CH]([CH]1CCOC1)C(O)=O | InChi: | InChI=1S/C6H11NO3/c7-5(6(8)9)4-1-2-10-3-4/h4-5H,1-3,7H2,(H,8,9)/t4-,5-/m0/s1 | Definition date: | 2017-11-09 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2~{S})-2-azanyl-2-[(3~{R})-oxolan-3-yl]ethanoic acid |
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![8YU 8YU](https://data.pdbj.org/pdbjplus/data/cc/svg/8YU.svg) | 8YU | Name: | (2,6-dimethylphenyl)methanamine | Formula: | C9 H13 N | SMILES: | Cc1cccc(C)c1CN | InChi: | InChI=1S/C9H13N/c1-7-4-3-5-8(2)9(7)6-10/h3-5H,6,10H2,1-2H3 | Definition date: | 2017-11-09 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2,6-dimethylphenyl)methanamine |
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![E4Z E4Z](https://data.pdbj.org/pdbjplus/data/cc/svg/E4Z.svg) | E4Z | Name: | Baloxavir acid | Formula: | C24 H19 F2 N3 O4 S | SMILES: | OC1=C2N(C=CC1=O)N([CH]3COCCN3C2=O)[CH]4c5ccc(F)c(F)c5CSc6ccccc46 | InChi: | InChI=1S/C24H19F2N3O4S/c25-16-6-5-13-15(20(16)26)12-34-18-4-2-1-3-14(18)21(13)29-19-11-33-10-9-27(19)24(32)22-23(31)17(30)7-8-28(22)29/h1-8,19,21,31H,9-12H2/t19-,21+/m1/s1 | Definition date: | 2018-02-19 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (3~{R})-2-[(11~{S})-7,8-bis(fluoranyl)-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-11-oxidanyl-5-oxa-1,2,8-triazatricyclo[8.4.0.0^{3,8}]tetradeca-10,13-diene-9,12-dione |
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![HDJ HDJ](https://data.pdbj.org/pdbjplus/data/cc/svg/HDJ.svg) | HDJ | Name: | (2R,3S,4R)-3-(2',6'-difluoro-4'-methyl[1,1'-biphenyl]-4-yl)-4-(fluoromethyl)azetidine-2-carbonitrile | Formula: | C18 H15 F3 N2 | SMILES: | c3c(F)c(c2ccc(C1C(CF)NC1C#N)cc2)c(cc3C)F | InChi: | InChI=1S/C18H15F3N2/c1-10-6-13(20)17(14(21)7-10)11-2-4-12(5-3-11)18-15(8-19)23-16(18)9-22/h2-7,15-16,18,23H,8H2,1H3/t15-,16-,18+/m0/s1 | Definition date: | 2018-06-27 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2R,3S,4R)-3-(2',6'-difluoro-4'-methyl[1,1'-biphenyl]-4-yl)-4-(fluoromethyl)azetidine-2-carbonitrile |
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![DUH DUH](https://data.pdbj.org/pdbjplus/data/cc/svg/DUH.svg) | DUH | Name: | 2-oxidanyl-~{N}-[2,3,5,6-tetrakis(fluoranyl)-4-phenyl-phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide | Formula: | C20 H11 F4 N3 O2 | SMILES: | Oc1nn2ccccc2c1C(=O)Nc3c(F)c(F)c(c(F)c3F)c4ccccc4 | InChi: | InChI=1S/C20H11F4N3O2/c21-14-12(10-6-2-1-3-7-10)15(22)17(24)18(16(14)23)25-19(28)13-11-8-4-5-9-27(11)26-20(13)29/h1-9H,(H,25,28)(H,26,29) | Definition date: | 2018-01-31 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 2-oxidanyl-~{N}-[2,3,5,6-tetrakis(fluoranyl)-4-phenyl-phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide |
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![EXE EXE](https://data.pdbj.org/pdbjplus/data/cc/svg/EXE.svg) | EXE | Name: | (2~{R},3~{S},4~{S})-1-[(2~{S})-2-acetamido-3,3-dimethyl-butanoyl]-3-fluoranyl-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide | Formula: | C24 H31 F N4 O4 S | SMILES: | CC(=O)N[CH](C(=O)N1C[CH](O)[CH](F)[CH]1C(=O)NCc2ccc(cc2)c3scnc3C)C(C)(C)C | InChi: | InChI=1S/C24H31FN4O4S/c1-13-20(34-12-27-13)16-8-6-15(7-9-16)10-26-22(32)19-18(25)17(31)11-29(19)23(33)21(24(3,4)5)28-14(2)30/h6-9,12,17-19,21,31H,10-11H2,1-5H3,(H,26,32)(H,28,30)/t17-,18+,19-,21+/m0/s1 | Definition date: | 2018-05-03 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2~{R},3~{S},4~{S})-1-[(2~{S})-2-acetamido-3,3-dimethyl-butanoyl]-3-fluoranyl-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide |
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![EXH EXH](https://data.pdbj.org/pdbjplus/data/cc/svg/EXH.svg) | EXH | Name: | (2~{R},3~{R},4~{S})-1-[(2~{S})-2-acetamido-3,3-dimethyl-butanoyl]-3-fluoranyl-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide | Formula: | C24 H31 F N4 O4 S | SMILES: | CC(=O)N[CH](C(=O)N1C[CH](O)[CH](F)[CH]1C(=O)NCc2ccc(cc2)c3scnc3C)C(C)(C)C | InChi: | InChI=1S/C24H31FN4O4S/c1-13-20(34-12-27-13)16-8-6-15(7-9-16)10-26-22(32)19-18(25)17(31)11-29(19)23(33)21(24(3,4)5)28-14(2)30/h6-9,12,17-19,21,31H,10-11H2,1-5H3,(H,26,32)(H,28,30)/t17-,18-,19-,21+/m0/s1 | Definition date: | 2018-05-03 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2~{R},3~{R},4~{S})-1-[(2~{S})-2-acetamido-3,3-dimethyl-butanoyl]-3-fluoranyl-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide |
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![F4Z F4Z](https://data.pdbj.org/pdbjplus/data/cc/svg/F4Z.svg) | F4Z | Name: | 3,5,6-trichloro-2-pyridinol | Formula: | C5 H2 Cl3 N O | SMILES: | Oc1nc(Cl)c(Cl)cc1Cl | InChi: | InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10) | Definition date: | 2018-05-31 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 3,5,6-tris(chloranyl)pyridin-2-ol |
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![F52 F52](https://data.pdbj.org/pdbjplus/data/cc/svg/F52.svg) | F52 | Name: | 2-[2,4,5-tris(chloranyl)phenoxy]ethanoic acid | Formula: | C8 H5 Cl3 O3 | SMILES: | OC(=O)COc1cc(Cl)c(Cl)cc1Cl | InChi: | InChI=1S/C8H5Cl3O3/c9-4-1-6(11)7(2-5(4)10)14-3-8(12)13/h1-2H,3H2,(H,12,13) | Definition date: | 2018-06-01 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 2-[2,4,5-tris(chloranyl)phenoxy]ethanoic acid |
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![7YF 7YF](https://data.pdbj.org/pdbjplus/data/cc/svg/7YF.svg) | 7YF | Name: | (2R)-N-[2-[[(2S)-5-carbamimidamido-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-1,2-dihydropyrrole-2-carboxamide | Formula: | C13 H20 N6 O4 | SMILES: | NC(=N)NCCC[CH](NC(=O)CNC(=O)[CH]1NC(=O)C=C1)C=O | InChi: | InChI=1S/C13H20N6O4/c14-13(15)16-5-1-2-8(7-20)18-11(22)6-17-12(23)9-3-4-10(21)19-9/h3-4,7-9H,1-2,5-6H2,(H,17,23)(H,18,22)(H,19,21)(H4,14,15,16)/t8-,9+/m0/s1 | Definition date: | 2017-02-14 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2~{R})-~{N}-[2-[[(2~{S})-5-carbamimidamido-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-1,2-dihydropyrrole-2-carboxamide |
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![7YL 7YL](https://data.pdbj.org/pdbjplus/data/cc/svg/7YL.svg) | 7YL | Name: | (2R)-5-oxidanylidene-1,2-dihydropyrrole-2-carboxylic acid | Formula: | C5 H5 N O3 | SMILES: | OC(=O)[CH]1NC(=O)C=C1 | InChi: | InChI=1S/C5H5NO3/c7-4-2-1-3(6-4)5(8)9/h1-3H,(H,6,7)(H,8,9)/t3-/m1/s1 | Definition date: | 2017-02-14 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2~{R})-5-oxidanylidene-1,2-dihydropyrrole-2-carboxylic acid |
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![7YO 7YO](https://data.pdbj.org/pdbjplus/data/cc/svg/7YO.svg) | 7YO | Name: | (2R)-5-oxidanylidenepyrrolidine-2-carboxylic acid | Formula: | C5 H7 N O3 | SMILES: | OC(=O)[CH]1CCC(=O)N1 | InChi: | InChI=1S/C5H7NO3/c7-4-2-1-3(6-4)5(8)9/h3H,1-2H2,(H,6,7)(H,8,9)/t3-/m1/s1 | Definition date: | 2017-02-15 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2~{R})-5-oxidanylidenepyrrolidine-2-carboxylic acid |
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![7YR 7YR](https://data.pdbj.org/pdbjplus/data/cc/svg/7YR.svg) | 7YR | Name: | (2R)-N-[2-[[(2S)-1-[[4-[bis(oxidanyl)amino]phenyl]amino]-5-carbamimidamido-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-pyrrolidine-2-carboxamide | Formula: | C19 H28 N8 O6 | SMILES: | NC(=N)NCCC[CH](NC(=O)CNC(=O)[CH]1CCC(=O)N1)C(=O)Nc2ccc(cc2)N(O)O | InChi: | InChI=1S/C19H28N8O6/c20-19(21)22-9-1-2-13(18(31)24-11-3-5-12(6-4-11)27(32)33)26-16(29)10-23-17(30)14-7-8-15(28)25-14/h3-6,13-14,32-33H,1-2,7-10H2,(H,23,30)(H,24,31)(H,25,28)(H,26,29)(H4,20,21,22)/t13-,14+/m0/s1 | Definition date: | 2017-02-15 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2~{R})-~{N}-[2-[[(2~{S})-1-[[4-[bis(oxidanyl)amino]phenyl]amino]-5-carbamimidamido-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-pyrrolidine-2-carboxamide |
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![O84 O84](https://data.pdbj.org/pdbjplus/data/cc/svg/O84.svg) | O84 | Name: | [(2~{R},4~{a}~{R},6~{R},7~{a}~{R})-6-[2,4-bis(oxidanylidene)-5-[(~{E})-3-phosphonoprop-1-enyl]pyrimidin-1-yl]-2-phenyl-4~{a},6,7,7~{a}-tetrahydro-4~{H}-furo[3,2-d][1,3]dioxin-2-yl]phosphonic acid | Formula: | C19 H22 N2 O11 P2 | SMILES: | O[P](O)(=O)CC=CC1=CN([CH]2C[CH]3O[C](OC[CH]3O2)(c4ccccc4)[P](O)(O)=O)C(=O)NC1=O | InChi: | InChI=1S/C19H22N2O11P2/c22-17-12(5-4-8-33(24,25)26)10-21(18(23)20-17)16-9-14-15(31-16)11-30-19(32-14,34(27,28)29)13-6-2-1-3-7-13/h1-7,10,14-16H,8-9,11H2,(H,20,22,23)(H2,24,25,26)(H2,27,28,29)/b5-4+/t14-,15-,16-,19-/m1/s1 | Definition date: | 2018-03-23 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | [(2~{R},4~{a}~{R},6~{R},7~{a}~{R})-6-[2,4-bis(oxidanylidene)-5-[(~{E})-3-phosphonoprop-1-enyl]pyrimidin-1-yl]-2-phenyl-4~{a},6,7,7~{a}-tetrahydro-4~{H}-furo[3,2-d][1,3]dioxin-2-yl]phosphonic acid |
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![R33 R33](https://data.pdbj.org/pdbjplus/data/cc/svg/R33.svg) | R33 | Name: | N-[(3S)-6-carbamimidamido-2-oxohexan-3-yl]glycinamide | Formula: | C9 H19 N5 O2 | SMILES: | C(=O)(C)C(CCCN/C(N)=N)NC(=O)CN | InChi: | InChI=1S/C9H19N5O2/c1-6(15)7(14-8(16)5-10)3-2-4-13-9(11)12/h7H,2-5,10H2,1H3,(H,14,16)(H4,11,12,13)/t7-/m0/s1 | Definition date: | 2017-07-08 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | N-[(3S)-6-carbamimidamido-2-oxohexan-3-yl]glycinamide |
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![V3A V3A](https://data.pdbj.org/pdbjplus/data/cc/svg/V3A.svg) | V3A | Name: | 9-{2-deoxy-5-O-[(R)-{[(R)-[(R)-fluoro(phosphono)methyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D-erythro-pentofuranosyl}-9H-purin-6-amine | Formula: | C11 H17 F N5 O11 P3 | SMILES: | P(=O)(O)(OP(O)(C(P(=O)(O)O)F)=O)OCC3OC(n1cnc2c1ncnc2N)CC3O | InChi: | InChI=1S/C11H17FN5O11P3/c12-11(29(19,20)21)30(22,23)28-31(24,25)26-2-6-5(18)1-7(27-6)17-4-16-8-9(13)14-3-15-10(8)17/h3-7,11,18H,1-2H2,(H,22,23)(H,24,25)(H2,13,14,15)(H2,19,20,21)/t5-,6+,7-,11+/m0/s1 | Definition date: | 2018-03-22 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | 9-{2-deoxy-5-O-[(R)-{[(R)-[(R)-fluoro(phosphono)methyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D-erythro-pentofuranosyl}-9H-purin-6-amine |
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![VA4 VA4](https://data.pdbj.org/pdbjplus/data/cc/svg/VA4.svg) | VA4 | Name: | 5'-O-[(R)-{[(R)-[(R)-chloro(phosphono)methyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-2'-deoxyadenosine | Formula: | C11 H17 Cl N5 O11 P3 | SMILES: | n1c(c2c(nc1)n(cn2)C3OC(C(C3)O)COP(=O)(O)OP(O)(C(P(=O)(O)O)Cl)=O)N | InChi: | InChI=1S/C11H17ClN5O11P3/c12-11(29(19,20)21)30(22,23)28-31(24,25)26-2-6-5(18)1-7(27-6)17-4-16-8-9(13)14-3-15-10(8)17/h3-7,11,18H,1-2H2,(H,22,23)(H,24,25)(H2,13,14,15)(H2,19,20,21)/t5-,6+,7+,11+/m0/s1 | Definition date: | 2018-03-22 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | 5'-O-[(R)-{[(R)-[(R)-chloro(phosphono)methyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-2'-deoxyadenosine |
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