 | | 4BF | | 表記: | 4-BROMO-L-PHENYLALANINE | | 組成式: | C9 H10 Br N O2 | | SMILES: | Brc1ccc(cc1)CC(C(=O)O)N | | InChi: | InChI=1S/C9H10BrNO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1 | | 別名: | P-BROMO-L-PHENYLALANINE | | 定義日: | 2005-08-22 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 4-bromo-L-phenylalanine |
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 | | NQO | | 表記: | 2-(3-chlorophenyl)-N-(4-methylpyridazin-3-yl)acetamide | | 組成式: | C13 H12 Cl N3 O | | SMILES: | Cc1ccnnc1NC(=O)Cc1cccc(Cl)c1 | | InChi: | InChI=1S/C13H12ClN3O/c1-9-5-6-15-17-13(9)16-12(18)8-10-3-2-4-11(14)7-10/h2-7H,8H2,1H3,(H,16,17,18) | | 定義日: | 2023-08-16 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-11-08 | | 識別子（ID）: | 2-(3-chlorophenyl)-N-(4-methylpyridazin-3-yl)acetamide |
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 | | NR0 | | 表記: | N-[(3R,4R)-4-aminooxolan-3-yl]-2-(6-amino-9H-purin-9-yl)-N-(2-oxoethyl)acetamide | | 組成式: | C13 H17 N7 O4 | | SMILES: | OC(=O)CN(C1COCC1N)C(=O)Cn1cnc2c(N)ncnc21 | | InChi: | InChI=1S/C13H17N7O4/c14-7-3-24-4-8(7)20(2-10(22)23)9(21)1-19-6-18-11-12(15)16-5-17-13(11)19/h5-8H,1-4,14H2,(H,22,23)(H2,15,16,17)/t7-,8-/m0/s1 | | 定義日: | 2022-04-07 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-04-05 | | 識別子（ID）: | N-[(3R,4R)-4-aminooxolan-3-yl]-N-[(6-amino-9H-purin-9-yl)acetyl]glycine |
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 | | 4CF | | 表記: | 4-cyano-L-phenylalanine | | 組成式: | C10 H10 N2 O2 | | SMILES: | O=C(O)C(N)Cc1ccc(C#N)cc1 | | InChi: | InChI=1S/C10H10N2O2/c11-6-8-3-1-7(2-4-8)5-9(12)10(13)14/h1-4,9H,5,12H2,(H,13,14)/t9-/m0/s1 | | 定義日: | 2010-09-07 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 4-cyano-L-phenylalanine |
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 | | NRC | | 表記: | methyl (2R)-2-(3-chlorophenyl)-3-[(4-methylpyridin-3-yl)amino]-3-oxopropanoate | | 組成式: | C16 H15 Cl N2 O3 | | SMILES: | O=C(Nc1cnccc1C)C(c1cccc(Cl)c1)C(=O)OC | | InChi: | InChI=1S/C16H15ClN2O3/c1-10-6-7-18-9-13(10)19-15(20)14(16(21)22-2)11-4-3-5-12(17)8-11/h3-9,14H,1-2H3,(H,19,20)/t14-/m1/s1 | | 定義日: | 2023-08-16 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-11-08 | | 識別子（ID）: | methyl (2R)-2-(3-chlorophenyl)-3-[(4-methylpyridin-3-yl)amino]-3-oxopropanoate |
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 | | 4CG | | 表記: | (1R,2Z)-2-[(2R)-2-amino-3-(phosphonooxy)propylidene]cyclopentanecarboxylic acid | | 組成式: | C9 H16 N O6 P | | SMILES: | C1(/C(CCC1)C(=O)O)=C/C(COP(O)(O)=O)N | | InChi: | InChI=1S/C9H16NO6P/c10-7(5-16-17(13,14)15)4-6-2-1-3-8(6)9(11)12/h4,7-8H,1-3,5,10H2,(H,11,12)(H2,13,14,15)/b6-4-/t7-,8-/m1/s1 | | 定義日: | 2015-02-27 | | 最終更新日: | 2023-11-03 | | 公開日: | 2015-09-16 | | 識別子（ID）: | (1R,2Z)-2-[(2R)-2-amino-3-(phosphonooxy)propylidene]cyclopentanecarboxylic acid |
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 | | NRL | | 表記: | N-[(3R,4R)-4-aminooxolan-3-yl]-N-[(4-amino-2-oxopyrimidin-1(2H)-yl)acetyl]glycine | | 組成式: | C12 H17 N5 O5 | | SMILES: | OC(=O)CN(C1COCC1N)C(=O)CN1C=CC(N)=NC1=O | | InChi: | InChI=1S/C12H17N5O5/c13-7-5-22-6-8(7)17(4-11(19)20)10(18)3-16-2-1-9(14)15-12(16)21/h1-2,7-8H,3-6,13H2,(H,19,20)(H2,14,15,21)/t7-,8-/m0/s1 | | 定義日: | 2022-04-07 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-04-05 | | 識別子（ID）: | N-[(3R,4R)-4-aminooxolan-3-yl]-N-[(4-amino-2-oxopyrimidin-1(2H)-yl)acetyl]glycine |
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 | | NRX | | 表記: | 2-(3-chlorophenyl)-N-[(4S)-imidazo[1,5-a]pyridin-1-yl]acetamide | | 組成式: | C15 H12 Cl N3 O | | SMILES: | Clc1cccc(c1)CC(=O)Nc1ncn2ccccc12 | | InChi: | InChI=1S/C15H12ClN3O/c16-12-5-3-4-11(8-12)9-14(20)18-15-13-6-1-2-7-19(13)10-17-15/h1-8,10H,9H2,(H,18,20) | | 定義日: | 2023-08-16 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-11-08 | | 識別子（ID）: | 2-(3-chlorophenyl)-N-[(4S)-imidazo[1,5-a]pyridin-1-yl]acetamide |
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 | | 4D4 | | 表記: | (2S,3R)-2-azanyl-5-carbamimidamido-3-oxidanyl-pentanoic acid | | 組成式: | C6 H14 N4 O3 | | SMILES: | C(O)(=O)C(C(CCN/C(N)=N)O)N | | InChi: | InChI=1S/C6H14N4O3/c7-4(5(12)13)3(11)1-2-10-6(8)9/h3-4,11H,1-2,7H2,(H,12,13)(H4,8,9,10)/t3-,4+/m1/s1 | | 定義日: | 2015-03-02 | | 最終更新日: | 2023-11-03 | | 公開日: | 2015-03-18 | | 識別子（ID）: | (2S,3R)-2-amino-5-carbamimidamido-3-hydroxypentanoic acid (non-preferred name) |
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 | | NSF | | 表記: | N-[(3R,4R)-4-aminooxolan-3-yl]-N-[(5-iodo-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)acetyl]glycine | | 組成式: | C12 H15 I N4 O6 | | SMILES: | OC(=O)CN(C1COCC1N)C(=O)CN1C=C(I)C(=O)NC1=O | | InChi: | InChI=1S/C12H15IN4O6/c13-6-1-16(12(22)15-11(6)21)2-9(18)17(3-10(19)20)8-5-23-4-7(8)14/h1,7-8H,2-5,14H2,(H,19,20)(H,15,21,22)/t7-,8-/m0/s1 | | 定義日: | 2022-04-07 | | 最終更新日: | 2023-11-03 | | 公開日: | 2023-04-05 | | 識別子（ID）: | N-[(3R,4R)-4-aminooxolan-3-yl]-N-[(5-iodo-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)acetyl]glycine |
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 | | TXY | | 表記: | 3-[(5S)-4,5-dihydroxycyclohexa-1,3-dien-1-yl]-L-alanine | | 組成式: | C9 H13 N O4 | | SMILES: | O=C(O)C(N)CC1=CC=C(O)C(O)C1 | | InChi: | InChI=1S/C9H13NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,6,8,11-12H,3-4,10H2,(H,13,14)/t6-,8-/m0/s1 | | 定義日: | 2013-05-27 | | 最終更新日: | 2023-11-03 | | 公開日: | 2014-06-25 | | 識別子（ID）: | 3-[(5S)-4,5-dihydroxycyclohexa-1,3-dien-1-yl]-L-alanine |
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 | | TY2 | | 表記: | 3-AMINO-L-TYROSINE | | 組成式: | C9 H12 N2 O3 | | SMILES: | O=C(O)C(N)Cc1ccc(O)c(N)c1 | | InChi: | InChI=1S/C9H12N2O3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,10-11H2,(H,13,14)/t7-/m0/s1 | | 定義日: | 2007-11-17 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 3-amino-L-tyrosine |
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 | | TY5 | | 表記: | O-benzyl-L-tyrosine | | 組成式: | C16 H17 N O3 | | SMILES: | O=C(O)C(N)Cc2ccc(OCc1ccccc1)cc2 | | InChi: | InChI=1S/C16H17NO3/c17-15(16(18)19)10-12-6-8-14(9-7-12)20-11-13-4-2-1-3-5-13/h1-9,15H,10-11,17H2,(H,18,19)/t15-/m0/s1 | | 定義日: | 2010-12-10 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | O-benzyl-L-tyrosine |
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 | | TYB | | 表記: | TYROSINAL | | 組成式: | C9 H11 N O2 | | SMILES: | O=CC(N)Cc1ccc(O)cc1 | | InChi: | InChI=1S/C9H11NO2/c10-8(6-11)5-7-1-3-9(12)4-2-7/h1-4,6,8,12H,5,10H2/t8-/m0/s1 | | 定義日: | 2000-12-01 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | (2S)-2-amino-3-(4-hydroxyphenyl)propanal |
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 | | TYF | | 表記: | (2S)-2-hydroxy-3-(4-hydroxyphenyl)propanoic acid | | 組成式: | C9 H10 O4 | | SMILES: | O=C(O)C(O)Cc1ccc(O)cc1 | | InChi: | InChI=1S/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13)/t8-/m0/s1 | | 定義日: | 2013-10-01 | | 最終更新日: | 2023-11-03 | | 公開日: | 2013-10-30 | | 識別子（ID）: | (2S)-2-hydroxy-3-(4-hydroxyphenyl)propanoic acid |
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 | | TYI | | 表記: | 3,5-DIIODOTYROSINE | | 組成式: | C9 H9 I2 N O3 | | SMILES: | Ic1cc(cc(I)c1O)CC(C(=O)O)N | | InChi: | InChI=1S/C9H9I2NO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)/t7-/m0/s1 | | 定義日: | 1999-07-08 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 3,5-diiodo-L-tyrosine |
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 | | CE7 | | 表記: | (3S)-3-amino-4,4,4-trihydroxybutanamide | | 組成式: | C4 H10 N2 O4 | | SMILES: | C(C(N)=O)C(N)C(O)(O)O | | InChi: | InChI=1S/C4H10N2O4/c5-2(1-3(6)7)4(8,9)10/h2,8-10H,1,5H2,(H2,6,7)/t2-/m0/s1 | | 定義日: | 2017-09-20 | | 最終更新日: | 2023-11-03 | | 公開日: | 2018-02-07 | | 識別子（ID）: | (3S)-3-amino-4,4,4-trihydroxybutanamide |
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 | | TYO | | 表記: | (4Z,6E)-2-AMINO-7-HYDROPEROXY-4-[(E)-2-HYDROXYVINYL]HEPTA-4,6-DIENOIC ACID | | 組成式: | C9 H13 N O5 | | SMILES: | O=C(O)C(N)CC(C=CO)=CC=COO | | InChi: | InChI=1S/C9H13NO5/c10-8(9(12)13)6-7(3-4-11)2-1-5-15-14/h1-5,8,11,14H,6,10H2,(H,12,13)/b4-3?,5-1+,7-2+/t8-/m0/s1 | | 定義日: | 2006-09-22 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | (2S,4Z,6E)-2-amino-7-hydroperoxy-4-[(E)-2-hydroxyethenyl]hepta-4,6-dienoic acid |
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 | | TYQ | | 表記: | 3-AMINO-6-HYDROXY-TYROSINE | | 組成式: | C9 H12 N2 O4 | | SMILES: | O=C(O)C(N)Cc1c(O)cc(O)c(N)c1 | | InChi: | InChI=1S/C9H12N2O4/c10-5-1-4(2-6(11)9(14)15)7(12)3-8(5)13/h1,3,6,12-13H,2,10-11H2,(H,14,15)/t6-/m0/s1 | | 定義日: | 1999-08-26 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 3-amino-6-hydroxy-L-tyrosine |
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 | | TYR | | 表記: | TYROSINE | | 組成式: | C9 H11 N O3 | | SMILES: | O=C(O)C(N)Cc1ccc(O)cc1 | | InChi: | InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1 | | 定義日: | 1999-07-08 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | L-tyrosine |
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 | | TYS | | 表記: | O-SULFO-L-TYROSINE | | 組成式: | C9 H11 N O6 S | | SMILES: | O=C(O)C(N)Cc1ccc(OS(=O)(=O)O)cc1 | | InChi: | InChI=1S/C9H11NO6S/c10-8(9(11)12)5-6-1-3-7(4-2-6)16-17(13,14)15/h1-4,8H,5,10H2,(H,11,12)(H,13,14,15)/t8-/m0/s1 | | 定義日: | 1999-07-08 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | O-sulfo-L-tyrosine |
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 | | TYT | | 表記: | TYROSINE DERIVATIVE | | 組成式: | C18 H20 N2 O4 | | SMILES: | O=C(O)C(N)CC3C(=O)C=C(O)/C(=N/C2CC2c1ccccc1)C3 | | InChi: | InChI=1S/C18H20N2O4/c19-13(18(23)24)6-11-7-15(17(22)9-16(11)21)20-14-8-12(14)10-4-2-1-3-5-10/h1-5,9,11-14,22H,6-8,19H2,(H,23,24)/b20-15+ | | 別名: | 2-AMINO-3-[4-HYDROXY-6-OXO-3-(2-PHENYL-CYCLOPROPYLIMINO)-CYCLOHEXA-1,4-DIENYL]-PROPIONIC ACID | | 定義日: | 2002-06-21 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 3-{(5E)-4-hydroxy-2-oxo-5-[(2-phenylcyclopropyl)imino]cyclohex-3-en-1-yl}alanine |
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 | | TYW | | 表記: | (2S)-2-amino-3-(4-hydroxyphenyl)propane-1,1-diol | | 組成式: | C9 H13 N O3 | | SMILES: | Oc1ccc(cc1)CC(N)C(O)O | | InChi: | InChI=1S/C9H13NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8-9,11-13H,5,10H2/t8-/m0/s1 | | 定義日: | 2011-09-27 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | (2S)-2-amino-3-(4-hydroxyphenyl)propane-1,1-diol |
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 | | TYY | | 表記: | 3-(4-HYDROXY-3-IMINO-6-OXO-CYCLOHEXA-1,4-DIENYL)-ALANINE | | 組成式: | C9 H10 N2 O4 | | SMILES: | O=C1C=C(O)C(=[N@H])C=C1CC(C(=O)O)N | | InChi: | InChI=1S/C9H10N2O4/c10-5-1-4(2-6(11)9(14)15)7(12)3-8(5)13/h1,3,6,10,13H,2,11H2,(H,14,15)/b10-5-/t6-/m0/s1 | | 定義日: | 1999-08-26 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 3-[(3Z)-4-hydroxy-3-imino-6-oxocyclohexa-1,4-dien-1-yl]-L-alanine |
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 | | TYZ | | 表記: | PARA ACETAMIDO BENZOIC ACID | | 組成式: | C9 H9 N O3 | | SMILES: | O=C(Nc1ccc(cc1)C(=O)O)C | | InChi: | InChI=1S/C9H9NO3/c1-6(11)10-8-4-2-7(3-5-8)9(12)13/h2-5H,1H3,(H,10,11)(H,12,13) | | 定義日: | 2004-08-07 | | 最終更新日: | 2023-11-03 | | 識別子（ID）: | 4-(acetylamino)benzoic acid |
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