![ZOI ZOI](https://data.pdbj.org/pdbjplus/data/cc/svg/ZOI.svg) | ZOI | 表記: | N-[(3M)-3-{6-[(3R)-3-methoxyoxolan-3-yl]pyridin-2-yl}-1-methyl-1H-pyrrolo[2,3-c]pyridin-5-yl]urea | 組成式: | C19 H21 N5 O3 | SMILES: | COC1(CCOC1)c1nc(ccc1)c1cn(C)c2cnc(NC(N)=O)cc21 | InChi: | InChI=1S/C19H21N5O3/c1-24-10-13(12-8-17(23-18(20)25)21-9-15(12)24)14-4-3-5-16(22-14)19(26-2)6-7-27-11-19/h3-5,8-10H,6-7,11H2,1-2H3,(H3,20,21,23,25)/t19-/m0/s1 | 定義日: | 2023-06-29 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | N-[(3M)-3-{6-[(3R)-3-methoxyoxolan-3-yl]pyridin-2-yl}-1-methyl-1H-pyrrolo[2,3-c]pyridin-5-yl]urea |
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![ZOQ ZOQ](https://data.pdbj.org/pdbjplus/data/cc/svg/ZOQ.svg) | ZOQ | 表記: | N-{(3P)-3-[3-(dimethylsulfamoyl)phenyl]-1H-pyrrolo[2,3-c]pyridin-5-yl}cyclopropanecarboxamide | 組成式: | C19 H20 N4 O3 S | SMILES: | CN(C)S(=O)(=O)c1cccc(c1)c1c[NH]c2cnc(cc21)NC(=O)C1CC1 | InChi: | InChI=1S/C19H20N4O3S/c1-23(2)27(25,26)14-5-3-4-13(8-14)16-10-20-17-11-21-18(9-15(16)17)22-19(24)12-6-7-12/h3-5,8-12,20H,6-7H2,1-2H3,(H,21,22,24) | 定義日: | 2023-06-29 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | N-{(3P)-3-[3-(dimethylsulfamoyl)phenyl]-1H-pyrrolo[2,3-c]pyridin-5-yl}cyclopropanecarboxamide |
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![XOQ XOQ](https://data.pdbj.org/pdbjplus/data/cc/svg/XOQ.svg) | XOQ | 表記: | 1-[(3M)-3-{3-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethoxy]pyridin-2-yl}phenyl]piperazine | 組成式: | C23 H29 N5 O | SMILES: | Cc1nn(C)c(C)c1CCOc1cccnc1c1cccc(c1)N1CCNCC1 | InChi: | InChI=1S/C23H29N5O/c1-17-21(18(2)27(3)26-17)9-15-29-22-8-5-10-25-23(22)19-6-4-7-20(16-19)28-13-11-24-12-14-28/h4-8,10,16,24H,9,11-15H2,1-3H3 | 定義日: | 2022-12-03 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | 1-[(3M)-3-{3-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethoxy]pyridin-2-yl}phenyl]piperazine |
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![XRB XRB](https://data.pdbj.org/pdbjplus/data/cc/svg/XRB.svg) | XRB | 表記: | 5-[(4-{4-[(E)-2-cyanoethenyl]-2,6-dimethylphenoxy}pyrimidin-2-yl)amino]-2-[4-(methanesulfonyl)piperazin-1-yl]benzonitrile | 組成式: | C27 H27 N7 O3 S | SMILES: | O=S(C)(=O)N1CCN(CC1)c1ccc(Nc2nc(Oc3c(C)cc(C=CC#N)cc3C)ccn2)cc1C#N | InChi: | InChI=1S/C27H27N7O3S/c1-19-15-21(5-4-9-28)16-20(2)26(19)37-25-8-10-30-27(32-25)31-23-6-7-24(22(17-23)18-29)33-11-13-34(14-12-33)38(3,35)36/h4-8,10,15-17H,11-14H2,1-3H3,(H,30,31,32)/b5-4+ | 定義日: | 2022-12-06 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | 5-[(4-{4-[(E)-2-cyanoethenyl]-2,6-dimethylphenoxy}pyrimidin-2-yl)amino]-2-[4-(methanesulfonyl)piperazin-1-yl]benzonitrile |
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![ZVJ ZVJ](https://data.pdbj.org/pdbjplus/data/cc/svg/ZVJ.svg) | ZVJ | 表記: | Fenoterol | 組成式: | C17 H21 N O4 | SMILES: | Oc1cc(cc(O)c1)C(O)CNC(C)Cc1ccc(O)cc1 | InChi: | InChI=1S/C17H21NO4/c1-11(6-12-2-4-14(19)5-3-12)18-10-17(22)13-7-15(20)9-16(21)8-13/h2-5,7-9,11,17-22H,6,10H2,1H3/t11-,17+/m0/s1 | 定義日: | 2023-04-06 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | 5-[(1S)-1-hydroxy-2-{[(2S)-1-(4-hydroxyphenyl)propan-2-yl]amino}ethyl]benzene-1,3-diol |
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![XTI XTI](https://data.pdbj.org/pdbjplus/data/cc/svg/XTI.svg) | XTI | 表記: | 6-[(6M)-6-(1-methyl-1H-imidazol-5-yl)-2,3-dihydro-4H-1,4-thiazin-4-yl]-9H-purine | 組成式: | C13 H13 N7 S | SMILES: | Cn1cncc1C1=CN(CCS1)c1ncnc2[NH]cnc12 | InChi: | InChI=1S/C13H13N7S/c1-19-8-14-4-9(19)10-5-20(2-3-21-10)13-11-12(16-6-15-11)17-7-18-13/h4-8H,2-3H2,1H3,(H,15,16,17,18) | 別名: | Aplithianine A | 定義日: | 2022-12-07 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | 6-[(6M)-6-(1-methyl-1H-imidazol-5-yl)-2,3-dihydro-4H-1,4-thiazin-4-yl]-9H-purine |
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![ZWD ZWD](https://data.pdbj.org/pdbjplus/data/cc/svg/ZWD.svg) | ZWD | 表記: | N-(4-aminobenzoyl)glycine | 組成式: | C9 H10 N2 O3 | SMILES: | O=C(NCC(=O)O)c1ccc(N)cc1 | InChi: | InChI=1S/C9H10N2O3/c10-7-3-1-6(2-4-7)9(14)11-5-8(12)13/h1-4H,5,10H2,(H,11,14)(H,12,13) | 別名: | Para-aminohippuric acid | 定義日: | 2023-04-10 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | N-(4-aminobenzoyl)glycine |
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![XTT XTT](https://data.pdbj.org/pdbjplus/data/cc/svg/XTT.svg) | XTT | 表記: | 6-[(6P)-6-(1-methyl-1H-imidazol-5-yl)-2,3-dihydro-4H-1,4-thiazin-4-yl]-7,9-dihydro-8H-purin-8-one | 組成式: | C13 H13 N7 O S | SMILES: | Cn1cncc1C1=CN(CCS1)c1ncnc2NC(=O)Nc12 | InChi: | InChI=1S/C13H13N7OS/c1-19-7-14-4-8(19)9-5-20(2-3-22-9)12-10-11(15-6-16-12)18-13(21)17-10/h4-7H,2-3H2,1H3,(H2,15,16,17,18,21) | 別名: | Aplithianine B | 定義日: | 2022-12-07 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | 6-[(6P)-6-(1-methyl-1H-imidazol-5-yl)-2,3-dihydro-4H-1,4-thiazin-4-yl]-7,9-dihydro-8H-purin-8-one |
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![XU0 XU0](https://data.pdbj.org/pdbjplus/data/cc/svg/XU0.svg) | XU0 | 表記: | 6-[(6P)-6-(4-bromo-1-methyl-1H-imidazol-5-yl)-2,3-dihydro-4H-1,4-thiazin-4-yl]-7H-purine | 組成式: | C13 H12 Br N7 S | SMILES: | Brc1ncn(C)c1C1=CN(CCS1)c1ncnc2nc[NH]c12 | InChi: | InChI=1S/C13H12BrN7S/c1-20-7-19-11(14)10(20)8-4-21(2-3-22-8)13-9-12(16-5-15-9)17-6-18-13/h4-7H,2-3H2,1H3,(H,15,16,17,18) | 定義日: | 2022-12-07 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | 6-[(6P)-6-(4-bromo-1-methyl-1H-imidazol-5-yl)-2,3-dihydro-4H-1,4-thiazin-4-yl]-7H-purine |
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![JYF JYF](https://data.pdbj.org/pdbjplus/data/cc/svg/JYF.svg) | JYF | 表記: | (~{Z})-1,2-bis(chloranyl)ethene | 組成式: | C2 H2 Cl2 | SMILES: | ClC=CCl | InChi: | InChI=1S/C2H2Cl2/c3-1-2-4/h1-2H/b2-1- | 定義日: | 2023-08-10 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | (~{Z})-1,2-bis(chloranyl)ethene |
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![1HI 1HI](https://data.pdbj.org/pdbjplus/data/cc/svg/1HI.svg) | 1HI | 表記: | 2-[(3S)-piperidin-3-yl]-1,3-benzoxazole | 組成式: | C12 H14 N2 O | SMILES: | C1CNC[CH](C1)c2oc3ccccc3n2 | InChi: | InChI=1S/C12H14N2O/c1-2-6-11-10(5-1)14-12(15-11)9-4-3-7-13-8-9/h1-2,5-6,9,13H,3-4,7-8H2/t9-/m0/s1 | 定義日: | 2022-10-13 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | 2-[(3~{S})-piperidin-3-yl]-1,3-benzoxazole |
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![1IE 1IE](https://data.pdbj.org/pdbjplus/data/cc/svg/1IE.svg) | 1IE | 表記: | ~{N}-(3-methylsulfanylphenyl)-4~{H}-cyclopenta[b]quinolin-9-amine | 組成式: | C19 H16 N2 S | SMILES: | CSc1cccc(Nc2c3ccccc3[nH]c4cccc24)c1 | InChi: | InChI=1S/C19H16N2S/c1-22-14-7-4-6-13(12-14)20-19-15-8-2-3-10-17(15)21-18-11-5-9-16(18)19/h2-12,20-21H,1H3 | 定義日: | 2022-10-13 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | ~{N}-(3-methylsulfanylphenyl)-4~{H}-cyclopenta[b]quinolin-9-amine |
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![I0Z I0Z](https://data.pdbj.org/pdbjplus/data/cc/svg/I0Z.svg) | I0Z | 表記: | 1,3-dimethyl-5-[1-[[(3~{S})-1-(1-propan-2-ylpiperidin-4-yl)carbonylpiperidin-3-yl]methyl]benzimidazol-2-yl]pyridin-2-one | 組成式: | C29 H39 N5 O2 | SMILES: | CC(C)N1CCC(CC1)C(=O)N2CCC[CH](C2)Cn3c4ccccc4nc3C5=CN(C)C(=O)C(=C5)C | InChi: | InChI=1S/C29H39N5O2/c1-20(2)32-14-11-23(12-15-32)29(36)33-13-7-8-22(17-33)18-34-26-10-6-5-9-25(26)30-27(34)24-16-21(3)28(35)31(4)19-24/h5-6,9-10,16,19-20,22-23H,7-8,11-15,17-18H2,1-4H3/t22-/m1/s1 | 定義日: | 2023-07-25 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | 1,3-dimethyl-5-[1-[[(3~{S})-1-(1-propan-2-ylpiperidin-4-yl)carbonylpiperidin-3-yl]methyl]benzimidazol-2-yl]pyridin-2-one |
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![KWI KWI](https://data.pdbj.org/pdbjplus/data/cc/svg/KWI.svg) | KWI | 表記: | 1-[(2-chlorophenyl)methyl]-3-methyl-N-(1-methyl-1,2,3,4-tetrazol-5-yl)-2-oxidanylidene-benzimidazole-4-carboxamide | 組成式: | C18 H16 Cl N7 O2 | SMILES: | Cn1nnnc1NC(=O)c2cccc3N(Cc4ccccc4Cl)C(=O)N(C)c23 | InChi: | InChI=1S/C18H16ClN7O2/c1-24-15-12(16(27)20-17-21-22-23-25(17)2)7-5-9-14(15)26(18(24)28)10-11-6-3-4-8-13(11)19/h3-9H,10H2,1-2H3,(H,20,21,23,27) | 定義日: | 2022-10-25 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | 1-[(2-chlorophenyl)methyl]-3-methyl-~{N}-(1-methyl-1,2,3,4-tetrazol-5-yl)-2-oxidanylidene-benzimidazole-4-carboxamide |
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![OZ6 OZ6](https://data.pdbj.org/pdbjplus/data/cc/svg/OZ6.svg) | OZ6 | 表記: | (1R,2S,5S)-3-[(2S)-2-(tert-butylcarbamoylamino)-3,3-dimethyl-butanoyl]-6,6-dimethyl-N-[(2S)-1-oxidanylidene-3-[(3S)-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]-3-azabicyclo[3.1.0]hexane-2-carboxamide | 組成式: | C26 H43 N5 O5 | SMILES: | CC(C)(C)NC(=O)N[CH](C(=O)N1C[CH]2[CH]([CH]1C(=O)N[CH](C[CH]3CCNC3=O)C=O)C2(C)C)C(C)(C)C | InChi: | InChI=1S/C26H43N5O5/c1-24(2,3)19(29-23(36)30-25(4,5)6)22(35)31-12-16-17(26(16,7)8)18(31)21(34)28-15(13-32)11-14-9-10-27-20(14)33/h13-19H,9-12H2,1-8H3,(H,27,33)(H,28,34)(H2,29,30,36)/t14-,15-,16-,17-,18-,19+/m0/s1 | 定義日: | 2023-02-28 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | (1~{R},2~{S},5~{S})-3-[(2~{S})-2-(~{tert}-butylcarbamoylamino)-3,3-dimethyl-butanoyl]-6,6-dimethyl-~{N}-[(2~{S})-1-oxidanylidene-3-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]-3-azabicyclo[3.1.0]hexane-2-carboxamide |
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![OZB OZB](https://data.pdbj.org/pdbjplus/data/cc/svg/OZB.svg) | OZB | 表記: | (8S)-N-[(1S)-1-cyano-2-[(3S)-2-oxidanylidenepyrrolidin-3-yl]ethyl]-7-[(2S)-2-[(1-fluoranylcyclopropyl)carbonylamino]-3,3-dimethyl-butanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxamide | 組成式: | C24 H34 F N5 O4 S2 | SMILES: | CC(C)(C)[CH](NC(=O)C1(F)CC1)C(=O)N2CC3(C[CH]2C(=O)N[CH](C[CH]4CCNC4=O)C#N)SCCS3 | InChi: | InChI=1S/C24H34FN5O4S2/c1-22(2,3)17(29-21(34)23(25)5-6-23)20(33)30-13-24(35-8-9-36-24)11-16(30)19(32)28-15(12-26)10-14-4-7-27-18(14)31/h14-17H,4-11,13H2,1-3H3,(H,27,31)(H,28,32)(H,29,34)/t14-,15-,16-,17+/m0/s1 | 定義日: | 2023-02-28 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | (8~{S})-~{N}-[(1~{S})-1-cyano-2-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]ethyl]-7-[(2~{S})-2-[(1-fluoranylcyclopropyl)carbonylamino]-3,3-dimethyl-butanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxamide |
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![OZL OZL](https://data.pdbj.org/pdbjplus/data/cc/svg/OZL.svg) | OZL | 表記: | (8~{S})-7-[(2~{S})-2-(~{tert}-butylcarbamoylamino)-3,3-dimethyl-butanoyl]-~{N}-[(1~{S})-1-cyano-2-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]ethyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxamide | 組成式: | C25 H40 N6 O4 S2 | SMILES: | CC(C)(C)NC(=O)N[CH](C(=O)N1CC2(C[CH]1C(=O)N[CH](C[CH]3CCNC3=O)C#N)SCCS2)C(C)(C)C | InChi: | InChI=1S/C25H40N6O4S2/c1-23(2,3)18(29-22(35)30-24(4,5)6)21(34)31-14-25(36-9-10-37-25)12-17(31)20(33)28-16(13-26)11-15-7-8-27-19(15)32/h15-18H,7-12,14H2,1-6H3,(H,27,32)(H,28,33)(H2,29,30,35)/t15-,16-,17-,18+/m0/s1 | 定義日: | 2023-02-28 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | (8~{S})-7-[(2~{S})-2-(~{tert}-butylcarbamoylamino)-3,3-dimethyl-butanoyl]-~{N}-[(1~{S})-1-cyano-2-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]ethyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxamide |
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![P0O P0O](https://data.pdbj.org/pdbjplus/data/cc/svg/P0O.svg) | P0O | 表記: | (1R,2S,5S)-3-[(2S)-2-(tert-butylcarbamoylamino)-3,3-dimethyl-butanoyl]-6,6-dimethyl-N-[(2S)-5-oxidanylidene-1-[(3S)-2-oxidanylidenepyrrolidin-3-yl]hex-3-en-2-yl]-3-azabicyclo[3.1.0]hexane-2-carboxamide | 組成式: | C29 H47 N5 O5 | SMILES: | CC(=O)C=C[CH](C[CH]1CCNC1=O)NC(=O)[CH]2[CH]3[CH](CN2C(=O)[CH](NC(=O)NC(C)(C)C)C(C)(C)C)C3(C)C | InChi: | InChI=1S/C29H47N5O5/c1-16(35)10-11-18(14-17-12-13-30-23(17)36)31-24(37)21-20-19(29(20,8)9)15-34(21)25(38)22(27(2,3)4)32-26(39)33-28(5,6)7/h10-11,17-22H,12-15H2,1-9H3,(H,30,36)(H,31,37)(H2,32,33,39)/b11-10+/t17-,18+,19-,20-,21-,22+/m0/s1 | 定義日: | 2023-02-28 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | (1~{R},2~{S},5~{S})-3-[(2~{S})-2-(~{tert}-butylcarbamoylamino)-3,3-dimethyl-butanoyl]-6,6-dimethyl-~{N}-[(2~{S})-5-oxidanylidene-1-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]hex-3-en-2-yl]-3-azabicyclo[3.1.0]hexane-2-carboxamide |
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![N1K N1K](https://data.pdbj.org/pdbjplus/data/cc/svg/N1K.svg) | N1K | 表記: | N-(1-methyl-1,2,3,4-tetrazol-5-yl)-1-pentyl-pyrrolo[2,3-b]pyridine-4-carboxamide | 組成式: | C15 H19 N7 O | SMILES: | CCCCCn1ccc2c(ccnc12)C(=O)Nc3nnnn3C | InChi: | InChI=1S/C15H19N7O/c1-3-4-5-9-22-10-7-11-12(6-8-16-13(11)22)14(23)17-15-18-19-20-21(15)2/h6-8,10H,3-5,9H2,1-2H3,(H,17,18,20,23) | 定義日: | 2023-01-06 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | ~{N}-(1-methyl-1,2,3,4-tetrazol-5-yl)-1-pentyl-pyrrolo[2,3-b]pyridine-4-carboxamide |
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![PQL PQL](https://data.pdbj.org/pdbjplus/data/cc/svg/PQL.svg) | PQL | 表記: | (8~{S})-~{N}-[(1~{S})-1-cyano-2-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]ethyl]-7-[(2~{S})-3,3-dimethyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxamide | 組成式: | C22 H30 F3 N5 O4 S2 | SMILES: | CC(C)(C)[CH](NC(=O)C(F)(F)F)C(=O)N1CC2(C[CH]1C(=O)N[CH](C[CH]3CCNC3=O)C#N)SCCS2 | InChi: | InChI=1S/C22H30F3N5O4S2/c1-20(2,3)15(29-19(34)22(23,24)25)18(33)30-11-21(35-6-7-36-21)9-14(30)17(32)28-13(10-26)8-12-4-5-27-16(12)31/h12-15H,4-9,11H2,1-3H3,(H,27,31)(H,28,32)(H,29,34)/t12-,13-,14-,15+/m0/s1 | 定義日: | 2023-03-06 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | (8~{S})-~{N}-[(1~{S})-1-cyano-2-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]ethyl]-7-[(2~{S})-3,3-dimethyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxamide |
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![UCU UCU](https://data.pdbj.org/pdbjplus/data/cc/svg/UCU.svg) | UCU | 表記: | (2R)-2-oxidanylbutanoic acid | 組成式: | C4 H8 O3 | SMILES: | CC[CH](O)C(O)=O | InChi: | InChI=1S/C4H8O3/c1-2-3(5)4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1 | 別名: | (R)-2-Hydroxybutanoic acid | 定義日: | 2023-05-26 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | (2~{R})-2-oxidanylbutanoic acid |
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![UE3 UE3](https://data.pdbj.org/pdbjplus/data/cc/svg/UE3.svg) | UE3 | 表記: | (2R)-2-oxidanylpentanoic acid | 組成式: | C5 H10 O3 | SMILES: | CCC[CH](O)C(O)=O | InChi: | InChI=1S/C5H10O3/c1-2-3-4(6)5(7)8/h4,6H,2-3H2,1H3,(H,7,8)/t4-/m1/s1 | 別名: | (2R)-2-hydroxypentanoic acid | 定義日: | 2023-05-26 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | (2~{R})-2-oxidanylpentanoic acid |
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![UEI UEI](https://data.pdbj.org/pdbjplus/data/cc/svg/UEI.svg) | UEI | 表記: | (2R,3S)-3-methyl-2-oxidanyl-pentanoic acid | 組成式: | C6 H12 O3 | SMILES: | CC[CH](C)[CH](O)C(O)=O | InChi: | InChI=1S/C6H12O3/c1-3-4(2)5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/t4-,5+/m0/s1 | 別名: | (2R,3S)-2-hydroxy-3-methylpentanoic acid | 定義日: | 2023-05-27 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | (2~{R},3~{S})-3-methyl-2-oxidanyl-pentanoic acid |
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![UIT UIT](https://data.pdbj.org/pdbjplus/data/cc/svg/UIT.svg) | UIT | 表記: | (2R)-2-oxidanyloctanoic acid | 組成式: | C8 H16 O3 | SMILES: | CCCCCC[CH](O)C(O)=O | InChi: | InChI=1S/C8H16O3/c1-2-3-4-5-6-7(9)8(10)11/h7,9H,2-6H2,1H3,(H,10,11)/t7-/m1/s1 | 定義日: | 2023-06-03 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | (2~{R})-2-oxidanyloctanoic acid |
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![P6E P6E](https://data.pdbj.org/pdbjplus/data/cc/svg/P6E.svg) | P6E | 表記: | N-[4-(3-chloranylphenoxy)-3-sulfamoyl-phenyl]-2-phenyl-ethanamide | 組成式: | C20 H17 Cl N2 O4 S | SMILES: | N[S](=O)(=O)c1cc(NC(=O)Cc2ccccc2)ccc1Oc3cccc(Cl)c3 | InChi: | InChI=1S/C20H17ClN2O4S/c21-15-7-4-8-17(12-15)27-18-10-9-16(13-19(18)28(22,25)26)23-20(24)11-14-5-2-1-3-6-14/h1-10,12-13H,11H2,(H,23,24)(H2,22,25,26) | 定義日: | 2023-03-04 | 最終更新日: | 2023-10-13 | 公開日: | 2023-10-18 | 識別子(ID): | ~{N}-[4-(3-chloranylphenoxy)-3-sulfamoyl-phenyl]-2-phenyl-ethanamide |
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