 | | H00 | | Name: | 4-sulfanylbutanoic acid | | Formula: | C4 H8 O2 S | | SMILES: | C(C(=O)O)CCS | | InChi: | InChI=1S/C4H8O2S/c5-4(6)2-1-3-7/h7H,1-3H2,(H,5,6) | | Definition date: | 2017-08-15 | | Last modified: | 2023-11-03 | | Release date: | 2018-02-21 | | Identifier: | 4-sulfanylbutanoic acid |
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 | | 5OH | | Name: | (2S)-amino[(4R,6S)-2-amino-6-hydroxy-3,4,5,6-tetrahydropyrimidin-4-yl]ethanoic acid | | Formula: | C6 H12 N4 O3 | | SMILES: | N[CH]([CH]1C[CH](O)N=C(N)N1)C(O)=O | | InChi: | InChI=1S/C6H12N4O3/c7-4(5(12)13)2-1-3(11)10-6(8)9-2/h2-4,11H,1,7H2,(H,12,13)(H3,8,9,10)/t2-,3+,4+/m1/s1 | | Definition date: | 2010-02-05 | | Last modified: | 2023-11-03 | | Identifier: | (2S)-2-azanyl-2-[(4S,6R)-2-azanyl-4-hydroxy-1,4,5,6-tetrahydropyrimidin-6-yl]ethanoic acid |
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 | | 5OL | | Name: | N~6~-(1,1-dihydroxyethyl)-L-lysine | | Formula: | C8 H18 N2 O4 | | SMILES: | C(CCCCNC(C)(O)O)(C(=O)O)N | | InChi: | InChI=1S/C8H18N2O4/c1-8(13,14)10-5-3-2-4-6(9)7(11)12/h6,10,13-14H,2-5,9H2,1H3,(H,11,12)/t6-/m0/s1 | | Definition date: | 2015-10-29 | | Last modified: | 2023-11-03 | | Release date: | 2016-07-27 | | Identifier: | N~6~-(1,1-dihydroxyethyl)-L-lysine |
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 | | 5OM | | Name: | (2S)-2-amino-8,8-dihydroxy-8-[(2S)-oxiran-2-yl]octanoic acid | | Formula: | C10 H19 N O5 | | SMILES: | OC(CCCCCC(N)C(=O)O)(O)C1OC1 | | InChi: | InChI=1S/C10H19NO5/c11-7(9(12)13)4-2-1-3-5-10(14,15)8-6-16-8/h7-8,14-15H,1-6,11H2,(H,12,13)/t7-,8-/m0/s1 | | Definition date: | 2015-10-29 | | Last modified: | 2023-11-03 | | Release date: | 2016-07-27 | | Identifier: | (2S)-2-amino-8,8-dihydroxy-8-[(2S)-oxiran-2-yl]octanoic acid |
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 | | 5OW | | Name: | (2~{S})-2-azanyl-6-[[(~{Z})-~{C}-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]-~{N}-[(2~{R})-1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl]carbonimidoyl]amino]hexanoic acid | | Formula: | C17 H27 N4 O9 P S | | SMILES: | Cc1ncc(CO[P](O)(O)=O)c(c1O)C(NCCCC[CH](N)C(O)=O)=N[CH](CS)C(O)=O | | InChi: | InChI=1S/C17H27N4O9PS/c1-9-14(22)13(10(6-20-9)7-30-31(27,28)29)15(21-12(8-32)17(25)26)19-5-3-2-4-11(18)16(23)24/h6,11-12,22,32H,2-5,7-8,18H2,1H3,(H,19,21)(H,23,24)(H,25,26)(H2,27,28,29)/t11-,12-/m0/s1 | | Definition date: | 2015-10-30 | | Last modified: | 2023-11-03 | | Release date: | 2016-11-09 | | Identifier: | (2~{S})-2-azanyl-6-[[(~{Z})-~{C}-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]-~{N}-[(2~{R})-1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl]carbonimidoyl]amino]hexanoic acid |
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 | | H14 | | Name: | (2S,3R)-BETA-HYDROXY-PHENYLALANINE | | Formula: | C9 H11 N O3 | | SMILES: | O=C(O)C(N)C(O)c1ccccc1 | | InChi: | InChI=1S/C9H11NO3/c10-7(9(12)13)8(11)6-4-2-1-3-5-6/h1-5,7-8,11H,10H2,(H,12,13)/t7-,8+/m0/s1 | | Synonyms: | BETA-HYDROXY-PHENYLALANINE | | Definition date: | 2008-10-17 | | Last modified: | 2023-11-03 | | Release date: | 2012-12-21 | | Identifier: | (betaR)-beta-hydroxy-L-phenylalanine |
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 | | 5PG | | Name: | (2S)-(4-hydroxyphenyl)(methylamino)ethanoic acid | | Formula: | C9 H11 N O3 | | SMILES: | O=C(O)C(NC)c1ccc(O)cc1 | | InChi: | InChI=1S/C9H11NO3/c1-10-8(9(12)13)6-2-4-7(11)5-3-6/h2-5,8,10-11H,1H3,(H,12,13)/t8-/m0/s1 | | Synonyms: | N-METHYL-4-HYDROXY-PHENYLGLYCINE | | Definition date: | 2010-07-29 | | Last modified: | 2023-11-03 | | Identifier: | (2S)-(4-hydroxyphenyl)(methylamino)ethanoic acid |
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 | | 5PV | | Name: | 5-PHENYLVALERIC ACID | | Formula: | C11 H14 O2 | | SMILES: | O=C(O)CCCCc1ccccc1 | | InChi: | InChI=1S/C11H14O2/c12-11(13)9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,12,13) | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | 5-phenylpentanoic acid |
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 | | 5R0 | | Name: | 4-~{tert}-butylbenzoic acid | | Formula: | C11 H14 O2 | | SMILES: | CC(C)(C)c1ccc(cc1)C(O)=O | | InChi: | InChI=1S/C11H14O2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H,12,13) | | Definition date: | 2015-11-12 | | Last modified: | 2023-11-03 | | Release date: | 2015-12-16 | | Identifier: | 4-tert-butylbenzoic acid |
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 | | 5R5 | | Name: | methyl L-serinate | | Formula: | C4 H9 N O3 | | SMILES: | NC(C(=O)OC)CO | | InChi: | InChI=1S/C4H9NO3/c1-8-4(7)3(5)2-6/h3,6H,2,5H2,1H3/t3-/m0/s1 | | Synonyms: | methyl (2~{S})-2-azanyl-3-oxidanyl-propanoate | | Definition date: | 2015-11-13 | | Last modified: | 2023-11-03 | | Release date: | 2015-12-16 | | Identifier: | methyl L-serinate |
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 | | H3I | | Name: | (2~{S})-4-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-(7~{H}-purin-6-ylcarbamoyl)amino]-2-azanyl-butanoic acid | | Formula: | C20 H24 N12 O6 | | SMILES: | N[CH](CCN(C[CH]1O[CH]([CH](O)[CH]1O)n2cnc3c(N)ncnc23)C(=O)Nc4ncnc5nc[nH]c45)C(O)=O | | InChi: | InChI=1S/C20H24N12O6/c21-8(19(35)36)1-2-31(20(37)30-16-11-15(25-4-23-11)26-6-27-16)3-9-12(33)13(34)18(38-9)32-7-29-10-14(22)24-5-28-17(10)32/h4-9,12-13,18,33-34H,1-3,21H2,(H,35,36)(H2,22,24,28)(H2,23,25,26,27,30,37)/t8-,9+,12-,13?,18+/m0/s1 | | Definition date: | 2023-07-21 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | (2~{S})-4-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-(7~{H}-purin-6-ylcarbamoyl)amino]-2-azanyl-butanoic acid |
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 | | 5SQ | | Name: | 2-[2-[(1S)-1-azanyl-2-(1H-imidazol-4-yl)ethyl]-4-[(4-hydroxyphenyl)methylidene]-5-oxidanylidene-imidazol-1-yl]ethanoic acid | | Formula: | C17 H17 N5 O4 | | SMILES: | N[CH](Cc1c[nH]cn1)C2=NC(=Cc3ccc(O)cc3)C(=O)N2CC(O)=O | | InChi: | InChI=1S/C17H17N5O4/c18-13(6-11-7-19-9-20-11)16-21-14(17(26)22(16)8-15(24)25)5-10-1-3-12(23)4-2-10/h1-5,7,9,13,23H,6,8,18H2,(H,19,20)(H,24,25)/b14-5-/t13-/m0/s1 | | Synonyms: | GREEN CHROMOPHORE (HIS-TYR-GLY) | | Definition date: | 2015-11-24 | | Last modified: | 2023-11-03 | | Release date: | 2016-08-03 | | Identifier: | 2-[2-[(1~{S})-1-azanyl-2-(1~{H}-imidazol-4-yl)ethyl]-4-[(4-hydroxyphenyl)methylidene]-5-oxidanylidene-imidazol-1-yl]ethanoic acid |
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 | | 5T3 | | Name: | N~6~-ethyl-N~6~-propan-2-yl-L-lysine | | Formula: | C11 H24 N2 O2 | | SMILES: | NC(CCCCN(C(C)C)CC)C(=O)O | | InChi: | InChI=1S/C11H24N2O2/c1-4-13(9(2)3)8-6-5-7-10(12)11(14)15/h9-10H,4-8,12H2,1-3H3,(H,14,15)/t10-/m0/s1 | | Definition date: | 2019-12-19 | | Last modified: | 2023-11-03 | | Release date: | 2020-01-15 | | Identifier: | N~6~-ethyl-N~6~-propan-2-yl-L-lysine |
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 | | H5M | | Name: | TRANS-3-HYDROXY-5-METHYLPROLINE | | Formula: | C6 H11 N O3 | | SMILES: | O=C(O)C1NC(C)CC1O | | InChi: | InChI=1S/C6H11NO3/c1-3-2-4(8)5(7-3)6(9)10/h3-5,7-8H,2H2,1H3,(H,9,10)/t3-,4-,5-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | (3S,5S)-3-hydroxy-5-methyl-L-proline |
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 | | H7V | | Name: | 3-cyclohexyl-N-methyl-L-alanine | | Formula: | C10 H19 N O2 | | SMILES: | N(C(C(O)=O)CC1CCCCC1)C | | InChi: | InChI=1S/C10H19NO2/c1-11-9(10(12)13)7-8-5-3-2-4-6-8/h8-9,11H,2-7H2,1H3,(H,12,13)/t9-/m0/s1 | | Definition date: | 2018-06-13 | | Last modified: | 2023-11-03 | | Release date: | 2018-10-17 | | Identifier: | 3-cyclohexyl-N-methyl-L-alanine |
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 | | HOO | | Name: | (2~{S})-2-azanyl-3-[2,5-bis(oxidanylidene)imidazol-4-yl]propanoic acid | | Formula: | C6 H7 N3 O4 | | SMILES: | N[CH](CC1=NC(=O)NC1=O)C(O)=O | | InChi: | InChI=1S/C6H7N3O4/c7-2(5(11)12)1-3-4(10)9-6(13)8-3/h2H,1,7H2,(H,11,12)(H,9,10,13)/t2-/m0/s1 | | Definition date: | 2018-06-07 | | Last modified: | 2023-11-03 | | Release date: | 2019-02-27 | | Identifier: | (2~{S})-2-azanyl-3-[2,5-bis(oxidanylidene)imidazol-4-yl]propanoic acid |
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 | | HOX | | Name: | 4-amino-L-phenylalanine | | Formula: | C9 H12 N2 O2 | | SMILES: | O=C(O)C(N)Cc1ccc(N)cc1 | | InChi: | InChI=1S/C9H12N2O2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,10-11H2,(H,12,13)/t8-/m0/s1 | | Definition date: | 2009-08-25 | | Last modified: | 2023-11-03 | | Identifier: | 4-amino-L-phenylalanine |
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 | | HP9 | | Name: | (2S)-2-azanyl-3-(7-fluoranyl-9-oxidanylidene-xanthen-2-yl)propanoic acid | | Formula: | C16 H12 F N O4 | | SMILES: | N[CH](Cc1ccc2Oc3ccc(F)cc3C(=O)c2c1)C(O)=O | | InChi: | InChI=1S/C16H12FNO4/c17-9-2-4-14-11(7-9)15(19)10-5-8(1-3-13(10)22-14)6-12(18)16(20)21/h1-5,7,12H,6,18H2,(H,20,21)/t12-/m0/s1 | | Definition date: | 2021-01-26 | | Last modified: | 2023-11-03 | | Release date: | 2022-07-27 | | Identifier: | (2~{S})-2-azanyl-3-(7-fluoranyl-9-oxidanylidene-xanthen-2-yl)propanoic acid |
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 | | HPE | | Name: | HOMOPHENYLALANINE | | Formula: | C10 H13 N O2 | | SMILES: | O=C(O)C(N)CCc1ccccc1 | | InChi: | InChI=1S/C10H13NO2/c11-9(10(12)13)7-6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/t9-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | (2S)-2-amino-4-phenylbutanoic acid |
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 | | HPH | | Name: | (2S)-2-amino-3-phenylpropane-1,1-diol | | Formula: | C9 H13 N O2 | | SMILES: | OC(O)C(N)Cc1ccccc1 | | InChi: | InChI=1S/C9H13NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8-9,11-12H,6,10H2/t8-/m0/s1 | | Synonyms: | (2S)-2-amino-3-phenylpropane-1,1-diol | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | (2S)-2-amino-3-phenylpropane-1,1-diol |
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 | | HQA | | Name: | 3-(8-hydroxyquinolin-3-yl)-L-alanine | | Formula: | C12 H12 N2 O3 | | SMILES: | O=C(O)C(N)Cc1cc2cccc(O)c2nc1 | | InChi: | InChI=1S/C12H12N2O3/c13-9(12(16)17)5-7-4-8-2-1-3-10(15)11(8)14-6-7/h1-4,6,9,15H,5,13H2,(H,16,17)/t9-/m0/s1 | | Definition date: | 2008-12-10 | | Last modified: | 2023-11-03 | | Identifier: | 3-(8-hydroxyquinolin-3-yl)-L-alanine |
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 | | 5ZA | | Name: | (5Z)-2-[(1S,2R)-1-AMINO-2-HYDROXYPROPYL]-5-[(4-AMINO-1H-INDOL-3-YL)METHYLENE]-3-(2-HYDROXYETHYL)-3,5-DIHYDRO-4H-IMIDAZOL-4-ONE | | Formula: | C17 H19 N5 O4 | | SMILES: | O=C1N(C(=N/C1=Cc3c2c(cccc2nc3)N)C(N)C(O)C)CC(=O)O | | InChi: | InChI=1S/C17H19N5O4/c1-8(23)15(19)16-21-12(17(26)22(16)7-13(24)25)5-9-6-20-11-4-2-3-10(18)14(9)11/h2-6,8,15,20,23H,7,18-19H2,1H3,(H,24,25)/b12-5-/t8-,15+/m1/s1 | | Definition date: | 2003-04-22 | | Last modified: | 2023-11-03 | | Identifier: | {(4Z)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-[(4-amino-1H-indol-3-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid |
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 | | HR7 | | Name: | (3S)-3-amino-6-[(diaminomethylidene)amino]hexanoic acid | | Formula: | C7 H16 N4 O2 | | SMILES: | O=C(O)CC(N)CCC/N=C(N)N | | InChi: | InChI=1S/C7H16N4O2/c8-5(4-6(12)13)2-1-3-11-7(9)10/h5H,1-4,8H2,(H,12,13)(H4,9,10,11) | | Synonyms: | BETA-HOMOARGININE | | Definition date: | 2011-05-18 | | Last modified: | 2023-11-03 | | Identifier: | (3S)-3-amino-6-[(diaminomethylidene)amino]hexanoic acid |
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 | | HRG | | Name: | L-HOMOARGININE | | Formula: | C7 H16 N4 O2 | | SMILES: | O=C(O)C(N)CCCCNC(=[N@H])N | | InChi: | InChI=1S/C7H16N4O2/c8-5(6(12)13)3-1-2-4-11-7(9)10/h5H,1-4,8H2,(H,12,13)(H4,9,10,11)/t5-/m0/s1 | | Definition date: | 1999-12-16 | | Last modified: | 2023-11-03 | | Identifier: | N~6~-carbamimidoyl-L-lysine |
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 | | 60F | | Name: | (2~{R})-2-azanyl-3-[(~{E})-3-(4-hydroxyphenyl)prop-2-enoyl]sulfanyl-propanoic acid | | Formula: | C12 H13 N O4 S | | SMILES: | N[CH](CSC(=O)C=Cc1ccc(O)cc1)C(O)=O | | InChi: | InChI=1S/C12H13NO4S/c13-10(12(16)17)7-18-11(15)6-3-8-1-4-9(14)5-2-8/h1-6,10,14H,7,13H2,(H,16,17)/b6-3+/t10-/m0/s1 | | Definition date: | 2016-01-07 | | Last modified: | 2023-11-03 | | Release date: | 2016-05-18 | | Identifier: | (2~{R})-2-azanyl-3-[(~{E})-3-(4-hydroxyphenyl)prop-2-enoyl]sulfanyl-propanoic acid |
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