| 9DW | 表記: | (2~{S})-2-azanyl-3-[4-(2-ethyl-4-methoxy-phenyl)phenyl]propanoic acid | 組成式: | C18 H21 N O3 | SMILES: | CCc1cc(OC)ccc1c2ccc(C[CH](N)C(O)=O)cc2 | InChi: | InChI=1S/C18H21NO3/c1-3-13-11-15(22-2)8-9-16(13)14-6-4-12(5-7-14)10-17(19)18(20)21/h4-9,11,17H,3,10,19H2,1-2H3,(H,20,21)/t17-/m0/s1 | 定義日: | 2017-05-11 | 最終更新日: | 2023-11-03 | 公開日: | 2017-06-14 | 識別子(ID): | (2~{S})-2-azanyl-3-[4-(2-ethyl-4-methoxy-phenyl)phenyl]propanoic acid |
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| 9EV | 表記: | 6-[(2R)-2-{3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}-5-oxo-1,3-oxazolidin-3-yl]-L-norleucine | 組成式: | C16 H24 N3 O9 P | SMILES: | C2(c1c(c(C)ncc1COP(=O)(O)O)O)N(CC(O2)=O)CCCCC(C(O)=O)N | InChi: | InChI=1S/C16H24N3O9P/c1-9-14(21)13(10(6-18-9)8-27-29(24,25)26)15-19(7-12(20)28-15)5-3-2-4-11(17)16(22)23/h6,11,15,21H,2-5,7-8,17H2,1H3,(H,22,23)(H2,24,25,26)/t11-,15+/m0/s1 | 定義日: | 2017-05-03 | 最終更新日: | 2023-11-03 | 公開日: | 2017-05-17 | 識別子(ID): | 6-[(2R)-2-{3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}-5-oxo-1,3-oxazolidin-3-yl]-L-norleucine |
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| 9FB | 表記: | (1~{S},2~{R})-2-azanylcyclopentane-1-carboxylic acid | 組成式: | C6 H11 N O2 | SMILES: | N[CH]1CCC[CH]1C(O)=O | InChi: | InChI=1S/C6H11NO2/c7-5-3-1-2-4(5)6(8)9/h4-5H,1-3,7H2,(H,8,9)/t4-,5+/m0/s1 | 定義日: | 2017-05-16 | 最終更新日: | 2023-11-03 | 公開日: | 2020-10-28 | 識別子(ID): | (1~{S},2~{R})-2-azanylcyclopentane-1-carboxylic acid |
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| 9FZ | 表記: | (2~{S})-2-azanyl-5-(4-methyl-1,2,3-triazol-1-yl)pentanoic acid | 組成式: | C8 H14 N4 O2 | SMILES: | Cc1cn(CCC[CH](N)C(O)=O)nn1 | InChi: | InChI=1S/C8H14N4O2/c1-6-5-12(11-10-6)4-2-3-7(9)8(13)14/h5,7H,2-4,9H2,1H3,(H,13,14)/t7-/m0/s1 | 定義日: | 2017-05-17 | 最終更新日: | 2023-11-03 | 公開日: | 2017-08-30 | 識別子(ID): | (2~{S})-2-azanyl-5-(4-methyl-1,2,3-triazol-1-yl)pentanoic acid |
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| 9G2 | 表記: | (2~{S})-2-azanyl-5-(4-ethyl-1,2,3-triazol-1-yl)pentanoic acid | 組成式: | C9 H16 N4 O2 | SMILES: | CCc1cn(CCC[CH](N)C(O)=O)nn1 | InChi: | InChI=1S/C9H16N4O2/c1-2-7-6-13(12-11-7)5-3-4-8(10)9(14)15/h6,8H,2-5,10H2,1H3,(H,14,15)/t8-/m0/s1 | 定義日: | 2017-05-17 | 最終更新日: | 2023-11-03 | 公開日: | 2017-08-30 | 識別子(ID): | (2~{S})-2-azanyl-5-(4-ethyl-1,2,3-triazol-1-yl)pentanoic acid |
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| DV7 | 表記: | L-(7-hydroxycoumarin-4-yl)ethylglycine | 組成式: | C13 H13 N O5 | SMILES: | C(C(CCC=2c1ccc(O)cc1OC(C=2)=O)N)(=O)O | InChi: | InChI=1S/C13H13NO5/c14-10(13(17)18)4-1-7-5-12(16)19-11-6-8(15)2-3-9(7)11/h2-3,5-6,10,15H,1,4,14H2,(H,17,18)/t10-/m0/s1 | 別名: | (2S)-2-amino-4-(7-hydroxy-2-oxo-2H-1-benzopyran-4-yl)butanoic acid | 定義日: | 2017-11-09 | 最終更新日: | 2023-11-03 | 公開日: | 2018-11-14 | 識別子(ID): | (2S)-2-amino-4-(7-hydroxy-2-oxo-2H-1-benzopyran-4-yl)butanoic acid |
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| DV9 | 表記: | (2S)-2-azanyl-6,6-bis(fluoranyl)-5-oxidanylidene-6-phosphono-hexanoic acid | 組成式: | C6 H10 F2 N O6 P | SMILES: | N[CH](CCC(=O)C(F)(F)[P](O)(O)=O)C(O)=O | InChi: | InChI=1S/C6H10F2NO6P/c7-6(8,16(13,14)15)4(10)2-1-3(9)5(11)12/h3H,1-2,9H2,(H,11,12)(H2,13,14,15)/t3-/m0/s1 | 定義日: | 2019-09-06 | 最終更新日: | 2023-11-03 | 公開日: | 2021-09-08 | 識別子(ID): | (2~{S})-2-azanyl-6,6-bis(fluoranyl)-5-oxidanylidene-6-phosphono-hexanoic acid |
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| DVA | 表記: | D-VALINE | 組成式: | C5 H11 N O2 | SMILES: | O=C(O)C(N)C(C)C | InChi: | InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m1/s1 | 定義日: | 1999-07-08 | 最終更新日: | 2023-11-03 | 識別子(ID): | D-valine |
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| DYA | 表記: | DIDEHYDROASPARTATE | 組成式: | C4 H5 N O4 | SMILES: | NC(=CC(O)=O)C(O)=O | InChi: | InChI=1S/C4H5NO4/c5-2(4(8)9)1-3(6)7/h1H,5H2,(H,6,7)(H,8,9)/b2-1- | 定義日: | 2015-04-24 | 最終更新日: | 2023-11-03 | 公開日: | 2016-04-13 | 識別子(ID): | (Z)-2-azanylbut-2-enedioic acid |
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| DYG | 表記: | (3S)-3-amino-3-[(4Z)-1-(carboxymethyl)-4-[(4-hydroxyphenyl)methylidene]-5-oxo-imidazol-2-yl]propanoic acid | 組成式: | C15 H15 N3 O6 | SMILES: | O=C(O)CC(N)C1=N/C(C(=O)N1CC(=O)O)=Cc2ccc(O)cc2 | InChi: | InChI=1S/C15H15N3O6/c16-10(6-12(20)21)14-17-11(15(24)18(14)7-13(22)23)5-8-1-3-9(19)4-2-8/h1-5,10,19H,6-7,16H2,(H,20,21)(H,22,23)/b11-5-/t10-/m0/s1 | 別名: | CHROMOPHORE (ASP-TYR-GLY) | 定義日: | 2004-10-25 | 最終更新日: | 2023-11-03 | 識別子(ID): | (3S)-3-amino-3-{(4Z)-1-(carboxymethyl)-4-[(4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}propanoic acid |
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| DYL | 表記: | (2R)-2-aminopent-4-enoic acid | 組成式: | C5 H9 N O2 | SMILES: | O=C(O)C(N)C/C=C | InChi: | InChI=1S/C5H9NO2/c1-2-3-4(6)5(7)8/h2,4H,1,3,6H2,(H,7,8)/t4-/m1/s1 | 定義日: | 2013-12-20 | 最終更新日: | 2023-11-03 | 公開日: | 2015-01-21 | 識別子(ID): | (2R)-2-aminopent-4-enoic acid |
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| E03 | 表記: | 6-FLUORO-D-TRYPTOPHAN | 組成式: | C11 H11 F N2 O2 | SMILES: | N[CH](Cc1c[nH]c2cc(F)ccc12)C(O)=O | InChi: | InChI=1S/C11H11FN2O2/c12-7-1-2-8-6(3-9(13)11(15)16)5-14-10(8)4-7/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m1/s1 | 別名: | (2R)-2-azanyl-3-(6-fluoranyl-1H-indol-3-yl)propanoic acid | 定義日: | 2019-09-27 | 最終更新日: | 2023-11-03 | 公開日: | 2019-10-16 | 識別子(ID): | (2~{R})-2-azanyl-3-(6-fluoranyl-1~{H}-indol-3-yl)propanoic acid |
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| E1H | 表記: | ETHANIMINE | 組成式: | C2 H5 N | SMILES: | [N@H]=CC | InChi: | InChI=1S/C2H5N/c1-2-3/h2-3H,1H3/b3-2- | 定義日: | 2006-02-24 | 最終更新日: | 2023-11-03 | 識別子(ID): | (1Z)-ethanimine |
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| E2G | 表記: | (2R)-N-[(4-{2-[(acetylamino)methyl]phenyl}-5-methyl-4H-1,2,4-triazol-3-yl)methyl]-2-amino-2-hydroxyacetamide | 組成式: | C15 H20 N6 O3 | SMILES: | C(NC(C(N)O)=O)c1nnc(C)n1c2c(cccc2)CNC(C)=O | InChi: | InChI=1S/C15H20N6O3/c1-9-19-20-13(8-18-15(24)14(16)23)21(9)12-6-4-3-5-11(12)7-17-10(2)22/h3-6,14,23H,7-8,16H2,1-2H3,(H,17,22)(H,18,24)/t14-/m1/s1 | 定義日: | 2017-11-27 | 最終更新日: | 2023-11-03 | 公開日: | 2017-12-27 | 識別子(ID): | (2R)-N-[(4-{2-[(acetylamino)methyl]phenyl}-5-methyl-4H-1,2,4-triazol-3-yl)methyl]-2-amino-2-hydroxyacetamide |
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| E5X | 表記: | 4-(hydroxymethyl)benzoic acid | 組成式: | C8 H8 O3 | SMILES: | OCc1ccc(cc1)C(O)=O | InChi: | InChI=1S/C8H8O3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4,9H,5H2,(H,10,11) | 定義日: | 2019-10-24 | 最終更新日: | 2023-11-03 | 公開日: | 2020-07-15 | 識別子(ID): | 4-(hydroxymethyl)benzoic acid |
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| E6F | 表記: | (1~{S},2~{S})-2-azanylcyclohexane-1-carboxylic acid | 組成式: | C7 H13 N O2 | SMILES: | N[CH]1CCCC[CH]1C(O)=O | InChi: | InChI=1S/C7H13NO2/c8-6-4-2-1-3-5(6)7(9)10/h5-6H,1-4,8H2,(H,9,10)/t5-,6-/m0/s1 | 定義日: | 2019-10-29 | 最終更新日: | 2023-11-03 | 公開日: | 2020-09-02 | 識別子(ID): | (1~{S},2~{S})-2-azanylcyclohexane-1-carboxylic acid |
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| E7P | 表記: | (2S)-2-amino-4-phosphonobutanoic acid | 組成式: | C4 H10 N O5 P | SMILES: | OP(=O)(CCC(C(O)=O)N)O | InChi: | InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)/t3-/m0/s1 | 定義日: | 2017-12-06 | 最終更新日: | 2023-11-03 | 公開日: | 2018-02-07 | 識別子(ID): | (2S)-2-amino-4-phosphonobutanoic acid |
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| E95 | 表記: | 7-Methyl-L-Tryptophan | 組成式: | C12 H14 N2 O2 | SMILES: | Cc1cccc2c(C[CH](N)C(O)=O)c[nH]c12 | InChi: | InChI=1S/C12H14N2O2/c1-7-3-2-4-9-8(6-14-11(7)9)5-10(13)12(15)16/h2-4,6,10,14H,5,13H2,1H3,(H,15,16)/t10-/m0/s1 | 定義日: | 2018-03-06 | 最終更新日: | 2023-11-03 | 公開日: | 2019-02-13 | 識別子(ID): | (2~{S})-2-azanyl-3-(7-methyl-1~{H}-indol-3-yl)propanoic acid |
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| 6RK | 表記: | 4-azanylcyclohexane-1-carboxylic acid | 組成式: | C7 H13 N O2 | SMILES: | N[CH]1CC[CH](CC1)C(O)=O | InChi: | InChI=1S/C7H13NO2/c8-6-3-1-5(2-4-6)7(9)10/h5-6H,1-4,8H2,(H,9,10)/t5-,6- | 定義日: | 2016-06-03 | 最終更新日: | 2023-11-03 | 公開日: | 2016-07-13 | 識別子(ID): | 4-azanylcyclohexane-1-carboxylic acid |
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| 6V9 | 表記: | 2-methyl-1,3-thiazole-5-carboxylic acid | 組成式: | C5 H5 N O2 S | SMILES: | Cc1sc(cn1)C(O)=O | InChi: | InChI=1S/C5H5NO2S/c1-3-6-2-4(9-3)5(7)8/h2H,1H3,(H,7,8) | 定義日: | 2016-07-04 | 最終更新日: | 2023-11-03 | 公開日: | 2016-08-17 | 識別子(ID): | 2-methyl-1,3-thiazole-5-carboxylic acid |
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| 6VA | 表記: | (3~{R},4~{S})-4-azanyl-2-methyl-5-phenyl-pentane-2,3-diol | 組成式: | C12 H19 N O2 | SMILES: | CC(C)(O)[CH](O)[CH](N)Cc1ccccc1 | InChi: | InChI=1S/C12H19NO2/c1-12(2,15)11(14)10(13)8-9-6-4-3-5-7-9/h3-7,10-11,14-15H,8,13H2,1-2H3/t10-,11+/m0/s1 | 定義日: | 2016-07-04 | 最終更新日: | 2023-11-03 | 公開日: | 2016-08-17 | 識別子(ID): | (3~{R},4~{S})-4-azanyl-2-methyl-5-phenyl-pentane-2,3-diol |
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| 6VF | 表記: | (2~{R},3~{S})-3-azanyl-4-(4-hydroxyphenyl)butane-1,2-diol | 組成式: | C10 H15 N O3 | SMILES: | N[CH](Cc1ccc(O)cc1)[CH](O)CO | InChi: | InChI=1S/C10H15NO3/c11-9(10(14)6-12)5-7-1-3-8(13)4-2-7/h1-4,9-10,12-14H,5-6,11H2/t9-,10-/m0/s1 | 定義日: | 2016-07-06 | 最終更新日: | 2023-11-03 | 公開日: | 2016-08-17 | 識別子(ID): | (2~{R},3~{S})-3-azanyl-4-(4-hydroxyphenyl)butane-1,2-diol |
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| 6ZS | 表記: | L-isovaline | 組成式: | C5 H11 N O2 | SMILES: | CC[C](C)(N)C(O)=O | InChi: | InChI=1S/C5H11NO2/c1-3-5(2,6)4(7)8/h3,6H2,1-2H3,(H,7,8)/t5-/m0/s1 | 定義日: | 2016-08-02 | 最終更新日: | 2023-11-03 | 公開日: | 2017-10-04 | 識別子(ID): | (2~{S})-2-azanyl-2-methyl-butanoic acid |
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| 707 | 表記: | N-(3-bromo-4-methoxybenzoyl)-beta-alanine | 組成式: | C11 H12 Br N O4 | SMILES: | O=C(O)CCNC(c1cc(c(OC)cc1)Br)=O | InChi: | InChI=1S/C11H12BrNO4/c1-17-9-3-2-7(6-8(9)12)11(16)13-5-4-10(14)15/h2-3,6H,4-5H2,1H3,(H,13,16)(H,14,15) | 定義日: | 2015-09-11 | 最終更新日: | 2023-11-03 | 公開日: | 2016-02-24 | 識別子(ID): | N-(3-bromo-4-methoxybenzoyl)-beta-alanine |
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| 73C | 表記: | (2~{S})-2-azanyl-3-butoxy-propanoic acid | 組成式: | C7 H15 N O3 | SMILES: | CCCCOC[CH](N)C(O)=O | InChi: | InChI=1S/C7H15NO3/c1-2-3-4-11-5-6(8)7(9)10/h6H,2-5,8H2,1H3,(H,9,10)/t6-/m0/s1 | 定義日: | 2015-12-22 | 最終更新日: | 2023-11-03 | 公開日: | 2016-06-15 | 識別子(ID): | (2~{S})-2-azanyl-3-butoxy-propanoic acid |
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