 | | M5I | | Name: | N-(3-chlorophenyl)-2-(4-methylpyridin-3-yl)acetamide | | Formula: | C14 H13 Cl N2 O | | SMILES: | O=C(Cc1cnccc1C)Nc1cccc(Cl)c1 | | InChi: | InChI=1S/C14H13ClN2O/c1-10-5-6-16-9-11(10)7-14(18)17-13-4-2-3-12(15)8-13/h2-6,8-9H,7H2,1H3,(H,17,18) | | Definition date: | 2023-08-15 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | N-(3-chlorophenyl)-2-(4-methylpyridin-3-yl)acetamide |
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 | | 5GG | | Name: | Deoxyhypusine | | Formula: | C10 H23 N3 O2 | | SMILES: | NC(C(=O)O)CCCCNCCCCN | | InChi: | InChI=1S/C10H23N3O2/c11-6-2-4-8-13-7-3-1-5-9(12)10(14)15/h9,13H,1-8,11-12H2,(H,14,15)/t9-/m0/s1 | | Definition date: | 2015-09-23 | | Last modified: | 2023-11-03 | | Release date: | 2016-01-20 | | Identifier: | N~6~-(4-aminobutyl)-L-lysine |
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 | | M5X | | Name: | (3S)-3-hydroxy-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide | | Formula: | C8 H8 N2 O4 S | | SMILES: | NS(=O)(=O)c1cc2c(cc1)NC(=O)C2O | | InChi: | InChI=1S/C8H8N2O4S/c9-15(13,14)4-1-2-6-5(3-4)7(11)8(12)10-6/h1-3,7,11H,(H,10,12)(H2,9,13,14)/t7-/m0/s1 | | Definition date: | 2023-08-15 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | (3S)-3-hydroxy-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide |
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 | | M6I | | Name: | N-(3-chlorophenyl)-N'-(pyridin-3-yl)urea | | Formula: | C12 H10 Cl N3 O | | SMILES: | O=C(Nc1cccnc1)Nc1cccc(Cl)c1 | | InChi: | InChI=1S/C12H10ClN3O/c13-9-3-1-4-10(7-9)15-12(17)16-11-5-2-6-14-8-11/h1-8H,(H2,15,16,17) | | Definition date: | 2023-08-15 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | N-(3-chlorophenyl)-N'-(pyridin-3-yl)urea |
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 | | M6U | | Name: | N-(4-ethylpyridin-3-yl)-2-[6-(trifluoromethyl)pyridin-2-yl]acetamide | | Formula: | C15 H14 F3 N3 O | | SMILES: | FC(F)(F)c1cccc(CC(=O)Nc2cnccc2CC)n1 | | InChi: | InChI=1S/C15H14F3N3O/c1-2-10-6-7-19-9-12(10)21-14(22)8-11-4-3-5-13(20-11)15(16,17)18/h3-7,9H,2,8H2,1H3,(H,21,22) | | Definition date: | 2023-08-15 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | N-(4-ethylpyridin-3-yl)-2-[6-(trifluoromethyl)pyridin-2-yl]acetamide |
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 | | M7X | | Name: | 2-(3-chlorophenyl)-N-(5-methylpyridin-3-yl)acetamide | | Formula: | C14 H13 Cl N2 O | | SMILES: | O=C(Nc1cc(C)cnc1)Cc1cccc(Cl)c1 | | InChi: | InChI=1S/C14H13ClN2O/c1-10-5-13(9-16-8-10)17-14(18)7-11-3-2-4-12(15)6-11/h2-6,8-9H,7H2,1H3,(H,17,18) | | Definition date: | 2023-08-15 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | 2-(3-chlorophenyl)-N-(5-methylpyridin-3-yl)acetamide |
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 | | DNW | | Name: | 3-[(2,4-dinitrophenyl)amino]-L-alanine | | Formula: | C9 H10 N4 O6 | | SMILES: | O=C(O)C(N)CNc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O | | InChi: | InChI=1S/C9H10N4O6/c10-6(9(14)15)4-11-7-2-1-5(12(16)17)3-8(7)13(18)19/h1-3,6,11H,4,10H2,(H,14,15)/t6-/m0/s1 | | Definition date: | 2013-05-07 | | Last modified: | 2023-11-03 | | Release date: | 2014-03-12 | | Identifier: | 3-[(2,4-dinitrophenyl)amino]-L-alanine |
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 | | DOA | | Name: | 12-AMINO-DODECANOIC ACID | | Formula: | C12 H25 N O2 | | SMILES: | O=C(O)CCCCCCCCCCCN | | InChi: | InChI=1S/C12H25NO2/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h1-11,13H2,(H,14,15) | | Definition date: | 2000-03-31 | | Last modified: | 2023-11-03 | | Identifier: | 12-aminododecanoic acid |
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 | | DPQ | | Name: | (S)-2-AMINO-3-(4-HYDROXY-3-OXOCYCLOHEXA-1,4-DIENYL)PROPANOIC ACID | | Formula: | C9 H11 N O4 | | SMILES: | O=C1C=C(CC(C(=O)O)N)CC=C1O | | InChi: | InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h2,4,6,11H,1,3,10H2,(H,13,14)/t6-/m0/s1 | | Definition date: | 2007-05-11 | | Last modified: | 2023-11-03 | | Identifier: | 3-(4-hydroxy-3-oxocyclohexa-1,4-dien-1-yl)-L-alanine |
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 | | DQK | | Name: | (2~{S})-4-[[(5~{S})-5-azanyl-6-oxidanylidene-hexyl]amino]-2-naphthalen-2-ylsulfanyl-4-oxidanylidene-butanoic acid | | Formula: | C20 H24 N2 O4 S | | SMILES: | N[CH](CCCCNC(=O)C[CH](Sc1ccc2ccccc2c1)C(O)=O)C=O | | InChi: | InChI=1S/C20H24N2O4S/c21-16(13-23)7-3-4-10-22-19(24)12-18(20(25)26)27-17-9-8-14-5-1-2-6-15(14)11-17/h1-2,5-6,8-9,11,13,16,18H,3-4,7,10,12,21H2,(H,22,24)(H,25,26)/t16-,18-/m0/s1 | | Definition date: | 2018-01-26 | | Last modified: | 2023-11-03 | | Release date: | 2018-04-18 | | Identifier: | (2~{S})-4-[[(5~{S})-5-azanyl-6-oxidanylidene-hexyl]amino]-2-naphthalen-2-ylsulfanyl-4-oxidanylidene-butanoic acid |
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 | | 5MW | | Name: | (2~{S})-5-[4-(aminomethyl)-1,2,3-triazol-1-yl]-2-azanyl-pentanoic acid | | Formula: | C8 H15 N5 O2 | | SMILES: | NCc1cn(CCC[CH](N)C(O)=O)nn1 | | InChi: | InChI=1S/C8H15N5O2/c9-4-6-5-13(12-11-6)3-1-2-7(10)8(14)15/h5,7H,1-4,9-10H2,(H,14,15)/t7-/m0/s1 | | Definition date: | 2015-10-23 | | Last modified: | 2023-11-03 | | Release date: | 2016-05-18 | | Identifier: | (2~{S})-5-[4-(aminomethyl)-1,2,3-triazol-1-yl]-2-azanyl-pentanoic acid |
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 | | 6J9 | | Name: | 4-(piperazin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine | | Formula: | C10 H13 N5 | | SMILES: | c2(c1c(ncc1)ncn2)N3CCNCC3 | | InChi: | InChI=1S/C10H13N5/c1-2-12-9-8(1)10(14-7-13-9)15-5-3-11-4-6-15/h1-2,7,11H,3-6H2,(H,12,13,14) | | Definition date: | 2016-04-14 | | Last modified: | 2023-11-03 | | Release date: | 2016-07-20 | | Identifier: | 4-(piperazin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine |
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 | | DTR | | Name: | D-TRYPTOPHAN | | Formula: | C11 H12 N2 O2 | | SMILES: | O=C(O)C(N)Cc2c1ccccc1nc2 | | InChi: | InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | D-tryptophan |
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 | | DV9 | | Name: | (2S)-2-azanyl-6,6-bis(fluoranyl)-5-oxidanylidene-6-phosphono-hexanoic acid | | Formula: | 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 | | Definition date: | 2019-09-06 | | Last modified: | 2023-11-03 | | Release date: | 2021-09-08 | | Identifier: | (2~{S})-2-azanyl-6,6-bis(fluoranyl)-5-oxidanylidene-6-phosphono-hexanoic acid |
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 | | DYG | | Name: | (3S)-3-amino-3-[(4Z)-1-(carboxymethyl)-4-[(4-hydroxyphenyl)methylidene]-5-oxo-imidazol-2-yl]propanoic acid | | Formula: | 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 | | Synonyms: | CHROMOPHORE (ASP-TYR-GLY) | | Definition date: | 2004-10-25 | | Last modified: | 2023-11-03 | | Identifier: | (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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 | | E03 | | Name: | 6-FLUORO-D-TRYPTOPHAN | | Formula: | 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 | | Synonyms: | (2R)-2-azanyl-3-(6-fluoranyl-1H-indol-3-yl)propanoic acid | | Definition date: | 2019-09-27 | | Last modified: | 2023-11-03 | | Release date: | 2019-10-16 | | Identifier: | (2~{R})-2-azanyl-3-(6-fluoranyl-1~{H}-indol-3-yl)propanoic acid |
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 | | MN2 | | Name: | 1-CARBOXYETHYLAMINOMETHYL-4-AMINOMETHYLBENZENE | | Formula: | C11 H17 N2 O2 | | SMILES: | O=C(O)CCNCc1ccc(cc1)C[NH3+] | | InChi: | InChI=1S/C11H16N2O2/c12-7-9-1-3-10(4-2-9)8-13-6-5-11(14)15/h1-4,13H,5-8,12H2,(H,14,15)/p+1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | (4-{[(2-carboxyethyl)amino]methyl}phenyl)methanaminium |
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 | | MN7 | | Name: | 1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE | | Formula: | C12 H17 N O2 | | SMILES: | O=C(O)c1ccc(cc1)CNCC(C)C | | InChi: | InChI=1S/C12H17NO2/c1-9(2)7-13-8-10-3-5-11(6-4-10)12(14)15/h3-6,9,13H,7-8H2,1-2H3,(H,14,15) | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | 4-{[(2-methylpropyl)amino]methyl}benzoic acid |
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 | | MN8 | | Name: | 2-(4-CARCOXY-5-ISOPROPYLTHIAZOLYL)BENZOPIPERIDINE | | Formula: | C16 H18 N2 O2 S | | SMILES: | O=C(O)c1nc(sc1C(C)C)C3NCc2ccccc2C3 | | InChi: | InChI=1S/C16H18N2O2S/c1-9(2)14-13(16(19)20)18-15(21-14)12-7-10-5-3-4-6-11(10)8-17-12/h3-6,9,12,17H,7-8H2,1-2H3,(H,19,20)/t12-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | 5-(1-methylethyl)-2-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]-1,3-thiazole-4-carboxylic acid |
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 | | MP4 | | Name: | (2S)-amino(3,5-dihydroxy-4-methylphenyl)ethanoic acid | | Formula: | C9 H11 N O4 | | SMILES: | O=C(O)C(c1cc(O)c(c(O)c1)C)N | | InChi: | InChI=1S/C9H11NO4/c1-4-6(11)2-5(3-7(4)12)8(10)9(13)14/h2-3,8,11-12H,10H2,1H3,(H,13,14)/t8-/m0/s1 | | Definition date: | 2012-02-10 | | Last modified: | 2023-11-03 | | Identifier: | (2S)-amino(3,5-dihydroxy-4-methylphenyl)ethanoic acid |
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 | | MQ3 | | Name: | (2R)-2-cyclohexyl-N-(4-methylpyridin-3-yl)propanamide | | Formula: | C15 H22 N2 O | | SMILES: | O=C(Nc1cnccc1C)C(C)C1CCCCC1 | | InChi: | InChI=1S/C15H22N2O/c1-11-8-9-16-10-14(11)17-15(18)12(2)13-6-4-3-5-7-13/h8-10,12-13H,3-7H2,1-2H3,(H,17,18)/t12-/m1/s1 | | Definition date: | 2023-08-16 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | (2R)-2-cyclohexyl-N-(4-methylpyridin-3-yl)propanamide |
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 | | 6VA | | Name: | (3~{R},4~{S})-4-azanyl-2-methyl-5-phenyl-pentane-2,3-diol | | Formula: | 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 | | Definition date: | 2016-07-04 | | Last modified: | 2023-11-03 | | Release date: | 2016-08-17 | | Identifier: | (3~{R},4~{S})-4-azanyl-2-methyl-5-phenyl-pentane-2,3-diol |
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 | | 6VF | | Name: | (2~{R},3~{S})-3-azanyl-4-(4-hydroxyphenyl)butane-1,2-diol | | Formula: | 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 | | Definition date: | 2016-07-06 | | Last modified: | 2023-11-03 | | Release date: | 2016-08-17 | | Identifier: | (2~{R},3~{S})-3-azanyl-4-(4-hydroxyphenyl)butane-1,2-diol |
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 | | 3A5 | | Name: | (2Z,4S)-3-AZA-5-CARBOXYL-2-METHYL-4(METHYLCARBOXY)PENT-2-ENOYL | | Formula: | C8 H11 N O6 | | SMILES: | O=C(OC)C(/N=C(/C(=O)O)C)CC(=O)O | | InChi: | InChI=1S/C8H11NO6/c1-4(7(12)13)9-5(3-6(10)11)8(14)15-2/h5H,3H2,1-2H3,(H,10,11)(H,12,13)/b9-4+/t5-/m0/s1 | | Definition date: | 2012-03-28 | | Last modified: | 2023-11-03 | | Release date: | 2012-10-26 | | Identifier: | (3S)-3-[(E)-(1-carboxyethylidene)amino]-4-methoxy-4-oxobutanoic acid (non-preferred name) |
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 | | MU3 | | Name: | (4R)-N-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-3,4-dihydro-2H-1-benzopyran-4-carboxamide | | Formula: | C15 H16 N4 O2 | | SMILES: | O=C(Nc1nncn1C1CC1)C1CCOc2ccccc21 | | InChi: | InChI=1S/C15H16N4O2/c20-14(17-15-18-16-9-19(15)10-5-6-10)12-7-8-21-13-4-2-1-3-11(12)13/h1-4,9-10,12H,5-8H2,(H,17,18,20)/t12-/m1/s1 | | Definition date: | 2023-08-16 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | (4R)-N-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-3,4-dihydro-2H-1-benzopyran-4-carboxamide |
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