![KYN KYN](https://data.pdbj.org/pdbjplus/data/cc/svg/KYN.svg) | KYN | 表記: | (2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid | 組成式: | C10 H12 N2 O3 | SMILES: | O=C(c1ccccc1N)CC(C(=O)O)N | InChi: | InChI=1S/C10H12N2O3/c11-7-4-2-1-3-6(7)9(13)5-8(12)10(14)15/h1-4,8H,5,11-12H2,(H,14,15)/t8-/m0/s1 | 別名: | L-KYNURENINE | 定義日: | 2004-05-16 | 最終更新日: | 2023-11-03 | 識別子(ID): | (2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid |
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![KYQ KYQ](https://data.pdbj.org/pdbjplus/data/cc/svg/KYQ.svg) | KYQ | 表記: | (E)-N~6~-(1-carboxy-2-hydroxyethylidene)-L-lysine | 組成式: | C9 H16 N2 O5 | SMILES: | O=C(O)C(N)CCCC/N=C(/C(=O)O)CO | InChi: | InChI=1S/C9H16N2O5/c10-6(8(13)14)3-1-2-4-11-7(5-12)9(15)16/h6,12H,1-5,10H2,(H,13,14)(H,15,16)/b11-7+/t6-/m0/s1 | 定義日: | 2008-04-04 | 最終更新日: | 2023-11-03 | 識別子(ID): | (E)-N~6~-(1-carboxy-2-hydroxyethylidene)-L-lysine |
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![2TY 2TY](https://data.pdbj.org/pdbjplus/data/cc/svg/2TY.svg) | 2TY | 表記: | 2-HYDROXY-5-{[(1E)-2-PHENYLETHYLIDENE]AMINO}-L-TYROSINE | 組成式: | C17 H18 N2 O4 | SMILES: | O=C(O)C(N)Cc2cc(N=CCc1ccccc1)c(O)cc2O | InChi: | InChI=1S/C17H18N2O4/c18-13(17(22)23)8-12-9-14(16(21)10-15(12)20)19-7-6-11-4-2-1-3-5-11/h1-5,7,9-10,13,20-21H,6,8,18H2,(H,22,23)/b19-7+/t13-/m0/s1 | 定義日: | 2005-07-07 | 最終更新日: | 2023-11-03 | 識別子(ID): | 2-hydroxy-5-{[(1E)-2-phenylethylidene]amino}-L-tyrosine |
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![KYU KYU](https://data.pdbj.org/pdbjplus/data/cc/svg/KYU.svg) | KYU | 表記: | 2-(3-chlorophenyl)-2,2-difluoro-N-(4-methylpyridin-3-yl)acetamide | 組成式: | C14 H11 Cl F2 N2 O | SMILES: | O=C(Nc1cnccc1C)C(F)(F)c1cccc(Cl)c1 | InChi: | InChI=1S/C14H11ClF2N2O/c1-9-5-6-18-8-12(9)19-13(20)14(16,17)10-3-2-4-11(15)7-10/h2-8H,1H3,(H,19,20) | 定義日: | 2023-08-14 | 最終更新日: | 2023-11-03 | 公開日: | 2023-11-08 | 識別子(ID): | 2-(3-chlorophenyl)-2,2-difluoro-N-(4-methylpyridin-3-yl)acetamide |
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![KZ1 KZ1](https://data.pdbj.org/pdbjplus/data/cc/svg/KZ1.svg) | KZ1 | 表記: | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-5-oxo-4-[(2,3,5-trifluoro-4-hydroxyphenyl)methylidene]-4,5-dihydro-1H-imidazol-1-yl}acetic acid | 組成式: | C14 H12 F3 N3 O4 S | SMILES: | NC(CS)C1=N/C(C(N1CC(=O)O)=O)=Cc2c(c(c(c(c2)F)O)F)F | InChi: | InChI=1S/C14H12F3N3O4S/c15-6-1-5(10(16)11(17)12(6)23)2-8-14(24)20(3-9(21)22)13(19-8)7(18)4-25/h1-2,7,23,25H,3-4,18H2,(H,21,22)/b8-2-/t7-/m0/s1 | 別名: | CHROMOPHORE (CYS-TYR-GLY)-(2,3,5-F3Y) | 定義日: | 2019-01-25 | 最終更新日: | 2023-11-03 | 公開日: | 2019-06-12 | 識別子(ID): | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-5-oxo-4-[(2,3,5-trifluoro-4-hydroxyphenyl)methylidene]-4,5-dihydro-1H-imidazol-1-yl}acetic acid |
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![KZ4 KZ4](https://data.pdbj.org/pdbjplus/data/cc/svg/KZ4.svg) | KZ4 | 表記: | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(3-bromo-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid | 組成式: | C14 H14 Br N3 O4 S | SMILES: | NC(CS)C=1N(C(=O)C(N=1)=[C@H]c2cc(c(cc2)O)Br)CC(=O)O | InChi: | InChI=1S/C14H14BrN3O4S/c15-8-3-7(1-2-11(8)19)4-10-14(22)18(5-12(20)21)13(17-10)9(16)6-23/h1-4,9,19,23H,5-6,16H2,(H,20,21)/b10-4-/t9-/m0/s1 | 別名: | CHROMOPHORE (CYS-TYR-GLY)3-Br | 定義日: | 2019-01-25 | 最終更新日: | 2023-11-03 | 公開日: | 2019-06-12 | 識別子(ID): | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(3-bromo-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid |
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![KZ7 KZ7](https://data.pdbj.org/pdbjplus/data/cc/svg/KZ7.svg) | KZ7 | 表記: | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(3-chloro-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid | 組成式: | C14 H14 Cl N3 O4 S | SMILES: | NC(CS)C=1N(CC(=O)O)C(=O)C(N=1)=[C@H]c2ccc(c(c2)Cl)O | InChi: | InChI=1S/C14H14ClN3O4S/c15-8-3-7(1-2-11(8)19)4-10-14(22)18(5-12(20)21)13(17-10)9(16)6-23/h1-4,9,19,23H,5-6,16H2,(H,20,21)/t9-/m0/s1 | 別名: | CHROMOPHORE (CYS-TYR-GLY)3-Cl | 定義日: | 2019-01-25 | 最終更新日: | 2023-11-03 | 公開日: | 2019-06-12 | 識別子(ID): | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(3-chloro-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid |
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![2UE 2UE](https://data.pdbj.org/pdbjplus/data/cc/svg/2UE.svg) | 2UE | 表記: | 1-[4-(2-oxoethyl)benzyl]guanidine | 組成式: | C10 H13 N3 O | SMILES: | C(c1ccc(cc1)CNC(N)=[N@H])C=O | InChi: | InChI=1S/C10H13N3O/c11-10(12)13-7-9-3-1-8(2-4-9)5-6-14/h1-4,6H,5,7H2,(H4,11,12,13) | 定義日: | 2015-06-22 | 最終更新日: | 2023-11-03 | 公開日: | 2015-07-01 | 識別子(ID): | 1-[4-(2-oxoethyl)benzyl]guanidine |
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![KZC KZC](https://data.pdbj.org/pdbjplus/data/cc/svg/KZC.svg) | KZC | 表記: | N-(2-anilinoethyl)-2-oxo-1,2-dihydroquinoline-4-carboxamide | 組成式: | C18 H17 N3 O2 | SMILES: | O=C(NCCNc1ccccc1)C1=CC(=O)Nc2ccccc21 | InChi: | InChI=1S/C18H17N3O2/c22-17-12-15(14-8-4-5-9-16(14)21-17)18(23)20-11-10-19-13-6-2-1-3-7-13/h1-9,12,19H,10-11H2,(H,20,23)(H,21,22) | 定義日: | 2023-08-15 | 最終更新日: | 2023-11-03 | 公開日: | 2023-11-08 | 識別子(ID): | N-(2-anilinoethyl)-2-oxo-1,2-dihydroquinoline-4-carboxamide |
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![KZG KZG](https://data.pdbj.org/pdbjplus/data/cc/svg/KZG.svg) | KZG | 表記: | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(4-hydroxy-3-iodophenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}aceti
c acid | 組成式: | C14 H14 I N3 O4 S | SMILES: | NC(CS)C1=N/C(C(N1CC(O)=O)=O)=Cc2cc(c(cc2)O)I | InChi: | InChI=1S/C14H14IN3O4S/c15-8-3-7(1-2-11(8)19)4-10-14(22)18(5-12(20)21)13(17-10)9(16)6-23/h1-4,9,19,23H,5-6,16H2,(H,20,21)/b10-4-/t9-/m0/s1 | 別名: | CHROMOPHORE (CYS-TYR-GLY)3-I | 定義日: | 2019-01-28 | 最終更新日: | 2023-11-03 | 公開日: | 2019-06-12 | 識別子(ID): | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(4-hydroxy-3-iodophenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid |
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![KZV KZV](https://data.pdbj.org/pdbjplus/data/cc/svg/KZV.svg) | KZV | 表記: | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(3-fluoro-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}ace
tic acid | 組成式: | C14 H14 F N3 O4 S | SMILES: | NC(CS)C=1N(CC(=O)O)C(=O)C(N=1)=[C@H]c2cc(F)c(cc2)O | InChi: | InChI=1S/C14H14FN3O4S/c15-8-3-7(1-2-11(8)19)4-10-14(22)18(5-12(20)21)13(17-10)9(16)6-23/h1-4,9,19,23H,5-6,16H2,(H,20,21)/t9-/m0/s1 | 別名: | CHROMOPHORE (CYS-TYR-GLY)-3F | 定義日: | 2019-01-28 | 最終更新日: | 2023-11-03 | 公開日: | 2019-06-12 | 識別子(ID): | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(3-fluoro-4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid |
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![KZX KZX](https://data.pdbj.org/pdbjplus/data/cc/svg/KZX.svg) | KZX | 表記: | 2-(3-fluorophenyl)-N-(4-methylpyridin-3-yl)acetamide | 組成式: | C14 H13 F N2 O | SMILES: | O=C(Nc1cnccc1C)Cc1cccc(F)c1 | InChi: | InChI=1S/C14H13FN2O/c1-10-5-6-16-9-13(10)17-14(18)8-11-3-2-4-12(15)7-11/h2-7,9H,8H2,1H3,(H,17,18) | 定義日: | 2023-08-15 | 最終更新日: | 2023-11-03 | 公開日: | 2023-11-08 | 識別子(ID): | 2-(3-fluorophenyl)-N-(4-methylpyridin-3-yl)acetamide |
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![KZY KZY](https://data.pdbj.org/pdbjplus/data/cc/svg/KZY.svg) | KZY | 表記: | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(4-hydroxy-3-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid | 組成式: | C15 H17 N3 O4 S | SMILES: | NC(CS)C1=N/C(C(N1CC(=O)O)=O)=Cc2cc(c(cc2)O)C | InChi: | InChI=1S/C15H17N3O4S/c1-8-4-9(2-3-12(8)19)5-11-15(22)18(6-13(20)21)14(17-11)10(16)7-23/h2-5,10,19,23H,6-7,16H2,1H3,(H,20,21)/b11-5-/t10-/m0/s1 | 別名: | CHROMOPHORE (CYS-TYR-GLY)3-CH3 | 定義日: | 2019-01-28 | 最終更新日: | 2023-11-03 | 公開日: | 2019-06-12 | 識別子(ID): | {(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-[(4-hydroxy-3-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid |
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![0WZ 0WZ](https://data.pdbj.org/pdbjplus/data/cc/svg/0WZ.svg) | 0WZ | 表記: | 3-(1H-pyrazol-1-yl)-L-tyrosine | 組成式: | C12 H13 N3 O3 | SMILES: | O=C(O)C(N)Cc1ccc(O)c(c1)n2nccc2 | InChi: | InChI=1S/C12H13N3O3/c13-9(12(17)18)6-8-2-3-11(16)10(7-8)15-5-1-4-14-15/h1-5,7,9,16H,6,13H2,(H,17,18)/t9-/m0/s1 | 定義日: | 2012-08-16 | 最終更新日: | 2023-11-03 | 公開日: | 2012-08-24 | 識別子(ID): | 3-(1H-pyrazol-1-yl)-L-tyrosine |
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![0Y8 0Y8](https://data.pdbj.org/pdbjplus/data/cc/svg/0Y8.svg) | 0Y8 | 表記: | (4R)-4-[(7-bromoisoquinolin-1-yl)oxy]-L-proline | 組成式: | C14 H13 Br N2 O3 | SMILES: | O=C(O)C3NCC(Oc1nccc2c1cc(Br)cc2)C3 | InChi: | InChI=1S/C14H13BrN2O3/c15-9-2-1-8-3-4-16-13(11(8)5-9)20-10-6-12(14(18)19)17-7-10/h1-5,10,12,17H,6-7H2,(H,18,19)/t10-,12+/m1/s1 | 定義日: | 2012-09-12 | 最終更新日: | 2023-11-03 | 公開日: | 2012-12-07 | 識別子(ID): | (4R)-4-[(7-bromoisoquinolin-1-yl)oxy]-L-proline |
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![L1F L1F](https://data.pdbj.org/pdbjplus/data/cc/svg/L1F.svg) | L1F | 表記: | N-[2-(2-methoxyphenoxy)ethyl]-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide | 組成式: | C20 H20 N2 O4 | SMILES: | COc1ccccc1OCCN(C)C(=O)C1=CC(=O)Nc2ccccc21 | InChi: | InChI=1S/C20H20N2O4/c1-22(11-12-26-18-10-6-5-9-17(18)25-2)20(24)15-13-19(23)21-16-8-4-3-7-14(15)16/h3-10,13H,11-12H2,1-2H3,(H,21,23) | 定義日: | 2023-08-15 | 最終更新日: | 2023-11-03 | 公開日: | 2023-11-08 | 識別子(ID): | N-[2-(2-methoxyphenoxy)ethyl]-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide |
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![0YG 0YG](https://data.pdbj.org/pdbjplus/data/cc/svg/0YG.svg) | 0YG | 表記: | N-[(2Z)-2-amino-3-(4-hydroxyphenyl)prop-2-enoyl]glycine | 組成式: | C11 H12 N2 O4 | SMILES: | NC(=Cc1ccc(O)cc1)C(=O)NCC(O)=O | InChi: | InChI=1S/C11H12N2O4/c12-9(11(17)13-6-10(15)16)5-7-1-3-8(14)4-2-7/h1-5,14H,6,12H2,(H,13,17)(H,15,16)/b9-5- | 定義日: | 2010-02-16 | 最終更新日: | 2023-11-03 | 識別子(ID): | 2-[[(Z)-2-azanyl-3-(4-hydroxyphenyl)prop-2-enoyl]amino]ethanoic acid |
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![L2I L2I](https://data.pdbj.org/pdbjplus/data/cc/svg/L2I.svg) | L2I | 表記: | (2S)-4-(methylamino)-2-phenyl-N-(pyridin-3-yl)butanamide | 組成式: | C16 H19 N3 O | SMILES: | O=C(Nc1cccnc1)C(CCNC)c1ccccc1 | InChi: | InChI=1S/C16H19N3O/c1-17-11-9-15(13-6-3-2-4-7-13)16(20)19-14-8-5-10-18-12-14/h2-8,10,12,15,17H,9,11H2,1H3,(H,19,20)/t15-/m0/s1 | 定義日: | 2023-08-15 | 最終更新日: | 2023-11-03 | 公開日: | 2023-11-08 | 識別子(ID): | (2S)-4-(methylamino)-2-phenyl-N-(pyridin-3-yl)butanamide |
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![L3I L3I](https://data.pdbj.org/pdbjplus/data/cc/svg/L3I.svg) | L3I | 表記: | 2-(3-chlorophenyl)-2-methyl-N-(4-methylpyridin-3-yl)propanamide | 組成式: | C16 H17 Cl N2 O | SMILES: | O=C(Nc1cnccc1C)C(C)(C)c1cccc(Cl)c1 | InChi: | InChI=1S/C16H17ClN2O/c1-11-7-8-18-10-14(11)19-15(20)16(2,3)12-5-4-6-13(17)9-12/h4-10H,1-3H3,(H,19,20) | 定義日: | 2023-08-15 | 最終更新日: | 2023-11-03 | 公開日: | 2023-11-08 | 識別子(ID): | 2-(3-chlorophenyl)-2-methyl-N-(4-methylpyridin-3-yl)propanamide |
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![L3R L3R](https://data.pdbj.org/pdbjplus/data/cc/svg/L3R.svg) | L3R | 表記: | (2~{S},3~{R},4~{R},5~{S},6~{R})-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methyl-phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol | 組成式: | C24 H25 F O5 S | SMILES: | Cc1ccc(cc1Cc2sc(cc2)c3ccc(F)cc3)[CH]4O[CH](CO)[CH](O)[CH](O)[CH]4O | InChi: | InChI=1S/C24H25FO5S/c1-13-2-3-15(24-23(29)22(28)21(27)19(12-26)30-24)10-16(13)11-18-8-9-20(31-18)14-4-6-17(25)7-5-14/h2-10,19,21-24,26-29H,11-12H2,1H3/t19-,21-,22+,23-,24+/m1/s1 | 別名: | Canagliflozin | 定義日: | 2022-11-09 | 最終更新日: | 2023-11-03 | 公開日: | 2023-11-08 | 識別子(ID): | (2~{S},3~{R},4~{R},5~{S},6~{R})-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methyl-phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol |
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![11Q 11Q](https://data.pdbj.org/pdbjplus/data/cc/svg/11Q.svg) | 11Q | 表記: | 1-(cyclohexylmethyl)-L-proline | 組成式: | C12 H21 N O2 | SMILES: | O=C(O)C2N(CC1CCCCC1)CCC2 | InChi: | InChI=1S/C12H21NO2/c14-12(15)11-7-4-8-13(11)9-10-5-2-1-3-6-10/h10-11H,1-9H2,(H,14,15)/t11-/m0/s1 | 定義日: | 2012-09-29 | 最終更新日: | 2023-11-03 | 公開日: | 2013-04-03 | 識別子(ID): | 1-(cyclohexylmethyl)-L-proline |
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![L4N L4N](https://data.pdbj.org/pdbjplus/data/cc/svg/L4N.svg) | L4N | 表記: | (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide | 組成式: | C14 H18 N2 O | SMILES: | O=C(Nc1cnccc1C)C1CCC2(CC2)C1 | InChi: | InChI=1S/C14H18N2O/c1-10-3-7-15-9-12(10)16-13(17)11-2-4-14(8-11)5-6-14/h3,7,9,11H,2,4-6,8H2,1H3,(H,16,17)/t11-/m1/s1 | 定義日: | 2023-08-15 | 最終更新日: | 2023-11-03 | 公開日: | 2023-11-08 | 識別子(ID): | (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide |
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![L4R L4R](https://data.pdbj.org/pdbjplus/data/cc/svg/L4R.svg) | L4R | 表記: | Fmoc-(R)-2-(7-octenyl)alanine | 組成式: | C11 H21 N O2 | SMILES: | C[C](N)(CCCCCCC=C)C(O)=O | InChi: | InChI=1S/C11H21NO2/c1-3-4-5-6-7-8-9-11(2,12)10(13)14/h3H,1,4-9,12H2,2H3,(H,13,14)/t11-/m1/s1 | 定義日: | 2022-06-16 | 最終更新日: | 2023-11-03 | 公開日: | 2022-07-20 | 識別子(ID): | (2~{R})-2-azanyl-2-methyl-dec-9-enoic acid |
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![L4U L4U](https://data.pdbj.org/pdbjplus/data/cc/svg/L4U.svg) | L4U | 表記: | (3S)-3,4-dimethyl-N-(4-methylpyridin-3-yl)pentanamide | 組成式: | C13 H20 N2 O | SMILES: | O=C(Nc1cnccc1C)CC(C)C(C)C | InChi: | InChI=1S/C13H20N2O/c1-9(2)11(4)7-13(16)15-12-8-14-6-5-10(12)3/h5-6,8-9,11H,7H2,1-4H3,(H,15,16)/t11-/m0/s1 | 定義日: | 2023-08-15 | 最終更新日: | 2023-11-03 | 公開日: | 2023-11-08 | 識別子(ID): | (3S)-3,4-dimethyl-N-(4-methylpyridin-3-yl)pentanamide |
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![L5I L5I](https://data.pdbj.org/pdbjplus/data/cc/svg/L5I.svg) | L5I | 表記: | (2R)-3-cyclopropyl-2-methyl-N-(4-methylpyridin-3-yl)propanamide | 組成式: | C13 H18 N2 O | SMILES: | O=C(Nc1cnccc1C)C(C)CC1CC1 | InChi: | InChI=1S/C13H18N2O/c1-9-5-6-14-8-12(9)15-13(16)10(2)7-11-3-4-11/h5-6,8,10-11H,3-4,7H2,1-2H3,(H,15,16)/t10-/m1/s1 | 定義日: | 2023-08-15 | 最終更新日: | 2023-11-03 | 公開日: | 2023-11-08 | 識別子(ID): | (2R)-3-cyclopropyl-2-methyl-N-(4-methylpyridin-3-yl)propanamide |
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