 | | PSW | | Name: | 3-(SULFANYLSELANYL)-L-ALANINE | | Formula: | C3 H7 N O2 S Se | | SMILES: | O=C(O)C(N)C[Se]S | | InChi: | InChI=1S/C3H7NO2SSe/c4-2(1-8-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1 | | Definition date: | 2009-08-07 | | Last modified: | 2023-11-03 | | Identifier: | 3-(sulfanylselanyl)-L-alanine |
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 | | PTH | | Name: | CE1-METHYLENE-HYDROXY-PHOSPHOTYROSINE | | Formula: | C10 H14 N O7 P | | SMILES: | O=P(Oc1ccc(cc1CO)CC(C(=O)O)N)(O)O | | InChi: | InChI=1S/C10H14NO7P/c11-8(10(13)14)4-6-1-2-9(7(3-6)5-12)18-19(15,16)17/h1-3,8,12H,4-5,11H2,(H,13,14)(H2,15,16,17)/t8-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | 3-(hydroxymethyl)-O-phosphono-L-tyrosine |
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 | | PTM | | Name: | ALPHA-METHYL-O-PHOSPHOTYROSINE | | Formula: | C10 H14 N O6 P | | SMILES: | O=P(Oc1ccc(cc1)CC(C(=O)O)(N)C)(O)O | | InChi: | InChI=1S/C10H14NO6P/c1-10(11,9(12)13)6-7-2-4-8(5-3-7)17-18(14,15)16/h2-5H,6,11H2,1H3,(H,12,13)(H2,14,15,16)/t10-/m0/s1 | | Definition date: | 2001-09-19 | | Last modified: | 2023-11-03 | | Identifier: | alpha-methyl-O-phosphono-L-tyrosine |
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 | | PTR | | Name: | O-PHOSPHOTYROSINE | | Formula: | C9 H12 N O6 P | | SMILES: | O=P(Oc1ccc(cc1)CC(C(=O)O)N)(O)O | | InChi: | InChI=1S/C9H12NO6P/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)(H2,13,14,15)/t8-/m0/s1 | | Synonyms: | PHOSPHONOTYROSINE | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | O-phosphono-L-tyrosine |
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 | | PUK | | Name: | N-[(2S)-2-amino-3-phenylpropyl]-L-phenylalanine | | Formula: | C18 H22 N2 O2 | | SMILES: | O=C(O)C(NCC(N)Cc1ccccc1)Cc2ccccc2 | | InChi: | InChI=1S/C18H22N2O2/c19-16(11-14-7-3-1-4-8-14)13-20-17(18(21)22)12-15-9-5-2-6-10-15/h1-10,16-17,20H,11-13,19H2,(H,21,22)/t16-,17-/m0/s1 | | Definition date: | 2009-02-06 | | Last modified: | 2023-11-03 | | Identifier: | N-[(2S)-2-amino-3-phenylpropyl]-L-phenylalanine |
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 | | PVH | | Name: | HISTIDINE-METHYL-ESTER | | Formula: | C7 H12 N3 O2 | | SMILES: | O=C(OC)C(N)Cc1cnc[nH+]1 | | InChi: | InChI=1S/C7H11N3O2/c1-12-7(11)6(8)2-5-3-9-4-10-5/h3-4,6H,2,8H2,1H3,(H,9,10)/p+1/t6-/m0/s1 | | Definition date: | 2001-04-02 | | Last modified: | 2023-11-03 | | Identifier: | methyl 3-(1H-imidazol-3-ium-4-yl)-L-alaninate |
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 | | PVO | | Name: | 2,2-bis(oxidanyl)propanoic acid | | Formula: | C3 H6 O4 | | SMILES: | CC(O)(O)C(O)=O | | InChi: | InChI=1S/C3H6O4/c1-3(6,7)2(4)5/h6-7H,1H3,(H,4,5) | | Definition date: | 2016-08-23 | | Last modified: | 2023-11-03 | | Release date: | 2017-09-13 | | Identifier: | 2,2-bis(oxidanyl)propanoic acid |
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 | | QI4 | | Name: | (2S)-2-(3,4-dichlorophenyl)-N-(isoquinolin-4-yl)propanamide | | Formula: | C18 H14 Cl2 N2 O | | SMILES: | Clc1ccc(cc1Cl)C(C)C(=O)Nc1cncc2ccccc21 | | InChi: | InChI=1S/C18H14Cl2N2O/c1-11(12-6-7-15(19)16(20)8-12)18(23)22-17-10-21-9-13-4-2-3-5-14(13)17/h2-11H,1H3,(H,22,23)/t11-/m0/s1 | | Definition date: | 2023-08-18 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | (2S)-2-(3,4-dichlorophenyl)-N-(isoquinolin-4-yl)propanamide |
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 | | QML | | Name: | (3S)-5-chloro-N-(isoquinolin-4-yl)-N-propanoyl-2,3-dihydro-1-benzofuran-3-carboxamide | | Formula: | C21 H17 Cl N2 O3 | | SMILES: | CCC(=O)N(c1cncc2ccccc21)C(=O)C1COc2ccc(Cl)cc21 | | InChi: | InChI=1S/C21H17ClN2O3/c1-2-20(25)24(18-11-23-10-13-5-3-4-6-15(13)18)21(26)17-12-27-19-8-7-14(22)9-16(17)19/h3-11,17H,2,12H2,1H3/t17-/m1/s1 | | Definition date: | 2023-08-18 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | (3S)-5-chloro-N-(isoquinolin-4-yl)-N-propanoyl-2,3-dihydro-1-benzofuran-3-carboxamide |
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 | | QPA | | Name: | S-[(1S)-1-carboxy-1-(phosphonooxy)ethyl]-L-cysteine | | Formula: | C6 H12 N O8 P S | | SMILES: | O=C(O)C(OP(=O)(O)O)(SCC(C(=O)O)N)C | | InChi: | InChI=1S/C6H12NO8PS/c1-6(5(10)11,15-16(12,13)14)17-2-3(7)4(8)9/h3H,2,7H2,1H3,(H,8,9)(H,10,11)(H2,12,13,14)/t3-,6-/m0/s1 | | Definition date: | 2011-07-12 | | Last modified: | 2023-11-03 | | Identifier: | S-[(1S)-1-carboxy-1-(phosphonooxy)ethyl]-L-cysteine |
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 | | QPH | | Name: | N-formyl-L-phenylalanine | | Formula: | C10 H11 N O3 | | SMILES: | O=C(O)C(NC=O)Cc1ccccc1 | | InChi: | InChI=1S/C10H11NO3/c12-7-11-9(10(13)14)6-8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H,11,12)(H,13,14)/t9-/m0/s1 | | Definition date: | 2011-04-28 | | Last modified: | 2023-11-03 | | Identifier: | N-formyl-L-phenylalanine |
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 | | QQF | | Name: | 2-(3,4-dichlorophenyl)-N-(isoquinolin-4-yl)-N~2~-(methoxyacetyl)-L-alaninamide | | Formula: | C21 H19 Cl2 N3 O3 | | SMILES: | Clc1ccc(cc1Cl)C(C)(NC(=O)COC)C(=O)Nc1cncc2ccccc21 | | InChi: | InChI=1S/C21H19Cl2N3O3/c1-21(26-19(27)12-29-2,14-7-8-16(22)17(23)9-14)20(28)25-18-11-24-10-13-5-3-4-6-15(13)18/h3-11H,12H2,1-2H3,(H,25,28)(H,26,27)/t21-/m1/s1 | | Definition date: | 2023-08-18 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | 2-(3,4-dichlorophenyl)-N-(isoquinolin-4-yl)-N~2~-(methoxyacetyl)-L-alaninamide |
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 | | QQO | | Name: | (2R)-N-{(2R)-2-(3,4-dichlorophenyl)-1-[(isoquinolin-4-yl)amino]-1-oxopropan-2-yl}-4-(propan-2-yl)morpholine-2-carboxamide | | Formula: | C26 H28 Cl2 N4 O3 | | SMILES: | CC(C)N1CC(OCC1)C(=O)NC(C)(c1ccc(Cl)c(Cl)c1)C(=O)Nc1cncc2ccccc21 | | InChi: | InChI=1S/C26H28Cl2N4O3/c1-16(2)32-10-11-35-23(15-32)24(33)31-26(3,18-8-9-20(27)21(28)12-18)25(34)30-22-14-29-13-17-6-4-5-7-19(17)22/h4-9,12-14,16,23H,10-11,15H2,1-3H3,(H,30,34)(H,31,33)/t23-,26-/m1/s1 | | Definition date: | 2023-08-18 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | (2R)-N-{(2R)-2-(3,4-dichlorophenyl)-1-[(isoquinolin-4-yl)amino]-1-oxopropan-2-yl}-4-(propan-2-yl)morpholine-2-carboxamide |
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 | | D8R | | Name: | (2~{S})-2-azanyl-6-[[(2~{R})-2-oxidanylpropanoyl]amino]hexanoic acid | | Formula: | C9 H18 N2 O4 | | SMILES: | C[CH](O)C(=O)NCCCC[CH](N)C(O)=O | | InChi: | InChI=1S/C9H18N2O4/c1-6(12)8(13)11-5-3-2-4-7(10)9(14)15/h6-7,12H,2-5,10H2,1H3,(H,11,13)(H,14,15)/t6-,7+/m1/s1 | | Definition date: | 2022-04-11 | | Last modified: | 2023-11-03 | | Release date: | 2023-05-10 | | Identifier: | (2~{S})-2-azanyl-6-[[(2~{R})-2-oxidanylpropanoyl]amino]hexanoic acid |
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 | | DAH | | Name: | 3,4-DIHYDROXYPHENYLALANINE | | Formula: | C9 H11 N O4 | | SMILES: | O=C(O)C(N)Cc1cc(O)c(O)cc1 | | InChi: | InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)/t6-/m0/s1 | | Synonyms: | L-DOPA | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | 3-hydroxy-L-tyrosine |
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 | | DAL | | Name: | D-ALANINE | | Formula: | C3 H7 N O2 | | SMILES: | O=C(O)C(N)C | | InChi: | InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | D-alanine |
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 | | DBY | | Name: | 3,5 DIBROMOTYROSINE | | Formula: | C9 H9 Br2 N O3 | | SMILES: | Brc1cc(cc(Br)c1O)CC(C(=O)O)N | | InChi: | InChI=1S/C9H9Br2NO3/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: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | 3,5-dibromo-L-tyrosine |
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 | | DBZ | | Name: | 3-(BENZOYLAMINO)-L-ALANINE | | Formula: | C10 H12 N2 O3 | | SMILES: | O=C(NCC(C(=O)O)N)c1ccccc1 | | InChi: | InChI=1S/C10H12N2O3/c11-8(10(14)15)6-12-9(13)7-4-2-1-3-5-7/h1-5,8H,6,11H2,(H,12,13)(H,14,15)/t8-/m0/s1 | | Definition date: | 2004-03-14 | | Last modified: | 2023-11-03 | | Identifier: | 3-[(phenylcarbonyl)amino]-L-alanine |
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 | | DC0 | | Name: | N-[(2S)-2-amino-4-methylpentyl]-L-phenylalanine | | Formula: | C15 H24 N2 O2 | | SMILES: | O=C(O)C(NCC(N)CC(C)C)Cc1ccccc1 | | InChi: | InChI=1S/C15H24N2O2/c1-11(2)8-13(16)10-17-14(15(18)19)9-12-6-4-3-5-7-12/h3-7,11,13-14,17H,8-10,16H2,1-2H3,(H,18,19)/t13-,14-/m0/s1 | | Definition date: | 2010-10-09 | | Last modified: | 2023-11-03 | | Identifier: | N-[(2S)-2-amino-4-methylpentyl]-L-phenylalanine |
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 | | DCY | | Name: | D-CYSTEINE | | Formula: | C3 H7 N O2 S | | SMILES: | O=C(O)C(N)CS | | InChi: | InChI=1S/C3H7NO2S/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | D-cysteine |
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 | | DDZ | | Name: | 3,3-DIHYDROXY L-ALANINE | | Formula: | C3 H7 N O4 | | SMILES: | O=C(O)C(N)C(O)O | | InChi: | InChI=1S/C3H7NO4/c4-1(2(5)6)3(7)8/h1-2,5-6H,4H2,(H,7,8)/t1-/m0/s1 | | Synonyms: | 3-HYDROXY-L-SERINE | | Definition date: | 2000-06-06 | | Last modified: | 2023-11-03 | | Identifier: | 3-hydroxy-L-serine |
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 | | DFF | | Name: | 4-benzoyl-D-phenylalanine | | Formula: | C16 H15 N O3 | | SMILES: | O=C(O)C(N)Cc1ccc(cc1)C(=O)c2ccccc2 | | InChi: | InChI=1S/C16H15NO3/c17-14(16(19)20)10-11-6-8-13(9-7-11)15(18)12-4-2-1-3-5-12/h1-9,14H,10,17H2,(H,19,20)/t14-/m1/s1 | | Definition date: | 2013-12-24 | | Last modified: | 2023-11-03 | | Release date: | 2014-05-21 | | Identifier: | 4-benzoyl-D-phenylalanine |
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 | | DHI | | Name: | D-HISTIDINE | | Formula: | C6 H10 N3 O2 | | SMILES: | O=C(O)C(N)Cc1cnc[nH+]1 | | InChi: | InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/p+1/t5-/m1/s1 | | Definition date: | 1999-09-08 | | Last modified: | 2023-11-03 | | Identifier: | 3-(1H-imidazol-3-ium-4-yl)-D-alanine |
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 | | DI7 | | Name: | 2,6-dimethyl-L-tyrosine | | Formula: | C11 H15 N O3 | | SMILES: | O=C(O)C(N)Cc1c(cc(O)cc1C)C | | InChi: | InChI=1S/C11H15NO3/c1-6-3-8(13)4-7(2)9(6)5-10(12)11(14)15/h3-4,10,13H,5,12H2,1-2H3,(H,14,15)/t10-/m0/s1 | | Definition date: | 2014-12-10 | | Last modified: | 2023-11-03 | | Release date: | 2015-01-14 | | Identifier: | 2,6-dimethyl-L-tyrosine |
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 | | DIB | | Name: | 3-AMINO-(DIMETHYLPROPYLAMINE) | | Formula: | C5 H14 N2 | | SMILES: | NCCCN(C)C | | InChi: | InChI=1S/C5H14N2/c1-7(2)5-3-4-6/h3-6H2,1-2H3 | | Definition date: | 2002-08-08 | | Last modified: | 2023-11-03 | | Identifier: | N,N-dimethylpropane-1,3-diamine |
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