 | | 0YA | | Name: | cyclopropanesulfonamide | | Formula: | C3 H7 N O2 S | | SMILES: | O=S(=O)(N)C1CC1 | | InChi: | InChI=1S/C3H7NO2S/c4-7(5,6)3-1-2-3/h3H,1-2H2,(H2,4,5,6) | | Definition date: | 2012-09-12 | | Last modified: | 2023-11-03 | | Release date: | 2012-12-07 | | Identifier: | cyclopropanesulfonamide |
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 | | LDX | | Name: | 3-(2-fluorophenyl)-N-(4-methylpyridin-3-yl)propanamide | | Formula: | C15 H15 F N2 O | | SMILES: | O=C(Nc1cnccc1C)CCc1ccccc1F | | InChi: | InChI=1S/C15H15FN2O/c1-11-8-9-17-10-14(11)18-15(19)7-6-12-4-2-3-5-13(12)16/h2-5,8-10H,6-7H2,1H3,(H,18,19) | | Definition date: | 2023-08-15 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | 3-(2-fluorophenyl)-N-(4-methylpyridin-3-yl)propanamide |
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 | | KCJ | | Name: | 3-(1,3-thiazol-4-yl)-L-alanine | | Formula: | C6 H8 N2 O2 S | | SMILES: | c1scnc1CC(C(O)=O)N | | InChi: | InChI=1S/C6H8N2O2S/c7-5(6(9)10)1-4-2-11-3-8-4/h2-3,5H,1,7H2,(H,9,10)/t5-/m0/s1 | | Definition date: | 2018-11-20 | | Last modified: | 2023-11-03 | | Release date: | 2019-10-02 | | Identifier: | 3-(1,3-thiazol-4-yl)-L-alanine |
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 | | MA | | Name: | METHYL L-ALANINATE | | Formula: | C4 H9 N O2 | | SMILES: | O=C(OC)C(N)C | | InChi: | InChI=1S/C4H9NO2/c1-3(5)4(6)7-2/h3H,5H2,1-2H3/t3-/m0/s1 | | Definition date: | 2008-07-10 | | Last modified: | 2023-11-03 | | Identifier: | methyl L-alaninate |
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 | | MAA | | Name: | N-methyl-L-alanine | | Formula: | C4 H9 N O2 | | SMILES: | O=C(O)C(NC)C | | InChi: | InChI=1S/C4H9NO2/c1-3(5-2)4(6)7/h3,5H,1-2H3,(H,6,7)/t3-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | N-methyl-L-alanine |
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 | | MBQ | | Name: | 2-HYDROXY-5-({1-[(4-METHYLPHENOXY)METHYL]-3-OXOPROP-1-ENYL}AMINO)-L-TYROSINE | | Formula: | C20 H22 N2 O6 | | SMILES: | O=C(O)C(N)Cc2c(O)cc(O)c(NC(=CC=O)COc1ccc(cc1)C)c2 | | InChi: | InChI=1S/C20H22N2O6/c1-12-2-4-15(5-3-12)28-11-14(6-7-23)22-17-9-13(8-16(21)20(26)27)18(24)10-19(17)25/h2-7,9-10,16,22,24-25H,8,11,21H2,1H3,(H,26,27)/b14-6+/t16-/m0/s1 | | Definition date: | 2004-03-04 | | Last modified: | 2023-11-03 | | Identifier: | 2-hydroxy-5-({(1E)-1-[(4-methylphenoxy)methyl]-3-oxoprop-1-en-1-yl}amino)-L-tyrosine |
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 | | MCS | | Name: | MALONYL CYSTEINE | | Formula: | C6 H9 N O5 S | | SMILES: | O=C(O)C(N)CSC(=O)CC(=O)O | | InChi: | InChI=1S/C6H9NO5S/c7-3(6(11)12)2-13-5(10)1-4(8)9/h3H,1-2,7H2,(H,8,9)(H,11,12)/t3-/m0/s1 | | Definition date: | 2007-02-02 | | Last modified: | 2023-11-03 | | Identifier: | S-(carboxyacetyl)-L-cysteine |
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 | | MEA | | Name: | N-METHYLPHENYLALANINE | | Formula: | C10 H13 N O2 | | SMILES: | O=C(O)C(NC)Cc1ccccc1 | | InChi: | InChI=1S/C10H13NO2/c1-11-9(10(12)13)7-8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3,(H,12,13)/t9-/m0/s1 | | Definition date: | 2002-06-19 | | Last modified: | 2023-11-03 | | Identifier: | N-methyl-L-phenylalanine |
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 | | MF0 | | Name: | (2R)-2-(5-chloropyridin-3-yl)-N-(4-methylpyridin-3-yl)propanamide | | Formula: | C14 H14 Cl N3 O | | SMILES: | O=C(Nc1cnccc1C)C(C)c1cc(Cl)cnc1 | | InChi: | InChI=1S/C14H14ClN3O/c1-9-3-4-16-8-13(9)18-14(19)10(2)11-5-12(15)7-17-6-11/h3-8,10H,1-2H3,(H,18,19)/t10-/m1/s1 | | Definition date: | 2023-08-15 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | (2R)-2-(5-chloropyridin-3-yl)-N-(4-methylpyridin-3-yl)propanamide |
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 | | MGG | | Name: | 2-(2-CARBOXY-ACETYLAMINO)-5-GUANIDINO-PENTANOIC ACID | | Formula: | C9 H17 N4 O5 | | SMILES: | O=C(NC(C(=O)O)CCCNC(=[NH2+])N)CC(=O)O | | InChi: | InChI=1S/C9H16N4O5/c10-9(11)12-3-1-2-5(8(17)18)13-6(14)4-7(15)16/h5H,1-4H2,(H,13,14)(H,15,16)(H,17,18)(H4,10,11,12)/p+1/t5-/m1/s1 | | Synonyms: | D-ARGININE WITH 3-OXO-PROPIONIC ACID MODIFICATION | | Definition date: | 1999-08-25 | | Last modified: | 2023-11-03 | | Identifier: | amino({(4R)-4-carboxy-4-[(carboxyacetyl)amino]butyl}amino)methaniminium |
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 | | MH6 | | Name: | 3-hydroxy-2-iminopropanoic acid | | Formula: | C3 H5 N O3 | | SMILES: | O=C(O)C(=[N@H])CO | | InChi: | InChI=1S/C3H5NO3/c4-2(1-5)3(6)7/h4-5H,1H2,(H,6,7)/b4-2+ | | Definition date: | 2008-03-11 | | Last modified: | 2023-11-03 | | Identifier: | (2E)-3-hydroxy-2-iminopropanoic acid |
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 | | MHS | | Name: | N1-METHYLATED HISTIDINE | | Formula: | C7 H11 N3 O2 | | SMILES: | O=C(O)C(N)Cc1cncn1C | | InChi: | InChI=1S/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | 3-methyl-L-histidine |
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 | | MHU | | Name: | 4-N,N-(DIMETHYLAMINO)-L-PHENYLALANINE | | Formula: | C12 H18 N2 O2 | | SMILES: | O=C(O)C(NC)Cc1ccc(N(C)C)cc1 | | InChi: | InChI=1S/C12H18N2O2/c1-13-11(12(15)16)8-9-4-6-10(7-5-9)14(2)3/h4-7,11,13H,8H2,1-3H3,(H,15,16)/t11-/m0/s1 | | Definition date: | 2010-07-15 | | Last modified: | 2023-11-03 | | Identifier: | 4-(dimethylamino)-N-methyl-L-phenylalanine |
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 | | AY0 | | Name: | (1R,2R,3S)-2-(methylcarbamoyl)-3-[4-(phosphonooxy)phenyl]cyclopropanecarboxylic acid | | Formula: | C12 H14 N O7 P | | SMILES: | O=C(NC)C2C(c1ccc(OP(=O)(O)O)cc1)C2C(=O)O | | InChi: | InChI=1S/C12H14NO7P/c1-13-11(14)9-8(10(9)12(15)16)6-2-4-7(5-3-6)20-21(17,18)19/h2-5,8-10H,1H3,(H,13,14)(H,15,16)(H2,17,18,19)/t8-,9+,10+/m0/s1 | | Definition date: | 2010-10-09 | | Last modified: | 2023-11-03 | | Identifier: | (1R,2R,3S)-2-(methylcarbamoyl)-3-[4-(phosphonooxy)phenyl]cyclopropanecarboxylic acid |
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 | | B3U | | Name: | 2-amino-L-histidine | | Formula: | C6 H10 N4 O2 | | SMILES: | O=C(O)C(N)Cc1cnc(N)n1 | | InChi: | InChI=1S/C6H10N4O2/c7-4(5(11)12)1-3-2-9-6(8)10-3/h2,4H,1,7H2,(H,11,12)(H3,8,9,10)/t4-/m0/s1 | | Definition date: | 2007-11-07 | | Last modified: | 2023-11-03 | | Identifier: | 2-amino-L-histidine |
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 | | 51T | | Name: | 2,3,6-trifluoro-L-tyrosine | | Formula: | C9 H8 F3 N O3 | | SMILES: | NC(Cc1c(cc(c(c1F)F)O)F)C(=O)O | | InChi: | InChI=1S/C9H8F3NO3/c10-4-2-6(14)8(12)7(11)3(4)1-5(13)9(15)16/h2,5,14H,1,13H2,(H,15,16)/t5-/m0/s1 | | Definition date: | 2015-07-13 | | Last modified: | 2023-11-03 | | Release date: | 2016-06-22 | | Identifier: | 2,3,6-trifluoro-L-tyrosine |
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 | | 54C | | Name: | (betaR)-beta-hydroxy-1-{2-[(2R)-oxiran-2-yl]propan-2-yl}-L-tryptophan | | Formula: | C16 H20 N2 O4 | | SMILES: | C(C(=O)O)(N)C(c1cn(c2c1cccc2)C(C)(C)C3CO3)O | | InChi: | InChI=1S/C16H20N2O4/c1-16(2,12-8-22-12)18-7-10(14(19)13(17)15(20)21)9-5-3-4-6-11(9)18/h3-7,12-14,19H,8,17H2,1-2H3,(H,20,21)/t12-,13-,14+/m0/s1 | | Definition date: | 2015-07-23 | | Last modified: | 2023-11-03 | | Release date: | 2015-10-28 | | Identifier: | (betaR)-beta-hydroxy-1-{2-[(2R)-oxiran-2-yl]propan-2-yl}-L-tryptophan |
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 | | EW6 | | Name: | alpha-methyl-L-serine | | Formula: | C4 H9 N O3 | | SMILES: | C[C](N)(CO)C(O)=O | | InChi: | InChI=1S/C4H9NO3/c1-4(5,2-6)3(7)8/h6H,2,5H2,1H3,(H,7,8)/t4-/m0/s1 | | Synonyms: | (2S)-2-azanyl-2-methyl-3-oxidanyl-propanoic acid | | Definition date: | 2020-02-10 | | Last modified: | 2023-11-03 | | Release date: | 2021-03-10 | | Identifier: | (2~{S})-2-azanyl-2-methyl-3-oxidanyl-propanoic acid |
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 | | 55I | | Name: | 4-(trifluoromethyl)-L-phenylalanine | | Formula: | C10 H10 F3 N O2 | | SMILES: | FC(F)(F)c1ccc(CC(N)C(=O)O)cc1 | | InChi: | InChI=1S/C10H10F3NO2/c11-10(12,13)7-3-1-6(2-4-7)5-8(14)9(15)16/h1-4,8H,5,14H2,(H,15,16)/t8-/m0/s1 | | Definition date: | 2021-07-16 | | Last modified: | 2023-11-03 | | Release date: | 2021-09-29 | | Identifier: | 4-(trifluoromethyl)-L-phenylalanine |
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 | | EXB | | Name: | 3-(1H-benzimidazol-1-yl)propanoic acid | | Formula: | C10 H10 N2 O2 | | SMILES: | O=C(O)CCn1c2ccccc2nc1 | | InChi: | InChI=1S/C10H10N2O2/c13-10(14)5-6-12-7-11-8-3-1-2-4-9(8)12/h1-4,7H,5-6H2,(H,13,14) | | Definition date: | 2008-11-12 | | Last modified: | 2023-11-03 | | Identifier: | 3-(1H-benzimidazol-1-yl)propanoic acid |
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 | | EXL | | Name: | 1-Methyl-L-tryptophan | | Formula: | C12 H14 N2 O2 | | SMILES: | Cn1cc(C[CH](N)C(O)=O)c2ccccc12 | | InChi: | InChI=1S/C12H14N2O2/c1-14-7-8(6-10(13)12(15)16)9-4-2-3-5-11(9)14/h2-5,7,10H,6,13H2,1H3,(H,15,16)/t10-/m0/s1 | | Synonyms: | (2S)-2-azanyl-3-(1-methylindol-3-yl)propanoic acid | | Definition date: | 2020-02-14 | | Last modified: | 2023-11-03 | | Release date: | 2020-07-08 | | Identifier: | (2~{S})-2-azanyl-3-(1-methylindol-3-yl)propanoic acid |
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 | | 56A | | Name: | 3-(8-phenyloctyl)-L-histidine | | Formula: | C20 H29 N3 O2 | | SMILES: | O=C(O)C(N)Cc1cncn1CCCCCCCCc2ccccc2 | | InChi: | InChI=1S/C20H29N3O2/c21-19(20(24)25)14-18-15-22-16-23(18)13-9-4-2-1-3-6-10-17-11-7-5-8-12-17/h5,7-8,11-12,15-16,19H,1-4,6,9-10,13-14,21H2,(H,24,25)/t19-/m0/s1 | | Definition date: | 2011-04-29 | | Last modified: | 2023-11-03 | | Identifier: | 3-(8-phenyloctyl)-L-histidine |
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 | | F2F | | Name: | 3,4-difluoro-L-phenylalanine | | Formula: | C9 H9 F2 N O2 | | SMILES: | Fc1ccc(cc1F)CC(C(=O)O)N | | InChi: | InChI=1S/C9H9F2NO2/c10-6-2-1-5(3-7(6)11)4-8(12)9(13)14/h1-3,8H,4,12H2,(H,13,14)/t8-/m0/s1 | | Definition date: | 2008-05-20 | | Last modified: | 2023-11-03 | | Identifier: | 3,4-difluoro-L-phenylalanine |
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 | | F2Y | | Name: | 3,5-difluoro-L-tyrosine | | Formula: | C9 H9 F2 N O3 | | SMILES: | Fc1cc(cc(F)c1O)CC(C(=O)O)N | | InChi: | InChI=1S/C9H9F2NO3/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 | | Definition date: | 2012-10-25 | | Last modified: | 2023-11-03 | | Release date: | 2013-03-13 | | Identifier: | 3,5-difluoro-L-tyrosine |
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 | | F7P | | Name: | 1-[(3R)-3-hydroxy-2-methylbutan-2-yl]-L-tryptophan | | Formula: | C16 H22 N2 O3 | | SMILES: | C(C(N)C(O)=O)c2c1ccccc1n(c2)C(C(C)O)(C)C | | InChi: | InChI=1S/C16H22N2O3/c1-10(19)16(2,3)18-9-11(8-13(17)15(20)21)12-6-4-5-7-14(12)18/h4-7,9-10,13,19H,8,17H2,1-3H3,(H,20,21)/t10-,13+/m1/s1 | | Definition date: | 2018-03-09 | | Last modified: | 2023-11-03 | | Release date: | 2019-06-05 | | Identifier: | 1-[(3R)-3-hydroxy-2-methylbutan-2-yl]-L-tryptophan |
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