 | | 9XQ | | Name: | [azanyl-[(3-carboxyphenyl)amino]methylidene]azanium | | Formula: | C8 H10 N3 O2 | | SMILES: | NC(=[NH2+])Nc1cccc(c1)C(O)=O | | InChi: | InChI=1S/C8H9N3O2/c9-8(10)11-6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)(H4,9,10,11)/p+1 | | Definition date: | 2017-07-27 | | Last modified: | 2023-11-03 | | Release date: | 2018-06-06 | | Identifier: | [azanyl-[(3-carboxyphenyl)amino]methylidene]azanium |
|
 | | 45F | | Name: | (4S)-4-(prop-2-yn-1-yloxy)-L-proline | | Formula: | C8 H11 N O3 | | SMILES: | O=C(O)C1NCC(OCC#C)C1 | | InChi: | InChI=1S/C8H11NO3/c1-2-3-12-6-4-7(8(10)11)9-5-6/h1,6-7,9H,3-5H2,(H,10,11)/t6-,7-/m0/s1 | | Definition date: | 2015-02-09 | | Last modified: | 2023-11-03 | | Release date: | 2015-02-25 | | Identifier: | (4S)-4-(prop-2-yn-1-yloxy)-L-proline |
|
 | | 45W | | Name: | (4S)-4-(ethynyloxy)-D-proline | | Formula: | C7 H9 N O3 | | SMILES: | O=C(O)C1NCC(OC#C)C1 | | InChi: | InChI=1S/C7H9NO3/c1-2-11-5-3-6(7(9)10)8-4-5/h1,5-6,8H,3-4H2,(H,9,10)/t5-,6+/m0/s1 | | Definition date: | 2015-02-10 | | Last modified: | 2023-11-03 | | Release date: | 2015-05-13 | | Identifier: | (4S)-4-(ethynyloxy)-D-proline |
|
 | | A0A | | Name: | (2S)-2-AMINO-4-(FORMYLOXY)-4-OXOBUTANOIC ACID | | Formula: | C5 H7 N O5 | | SMILES: | O=C(OC=O)CC(C(=O)O)N | | InChi: | InChI=1S/C5H7NO5/c6-3(5(9)10)1-4(8)11-2-7/h2-3H,1,6H2,(H,9,10)/t3-/m0/s1 | | Definition date: | 2007-12-11 | | Last modified: | 2023-11-03 | | Identifier: | (2S)-2-amino-4-(formyloxy)-4-oxobutanoic acid (non-preferred name) |
|
 | | A0G | | Name: | (2Z)-2-amino-3-hydroxyprop-2-enoic acid | | Formula: | C3 H5 N O3 | | SMILES: | C(=O)(/C(N)=C/O)O | | InChi: | InChI=1S/C3H5NO3/c4-2(1-5)3(6)7/h1,5H,4H2,(H,6,7)/b2-1- | | Definition date: | 2017-06-30 | | Last modified: | 2023-11-03 | | Release date: | 2019-09-18 | | Identifier: | (2Z)-2-amino-3-hydroxyprop-2-enoic acid |
|
 | | A1G | | Name: | (2S)-amino[(3R,5R,7R)-tricyclo[3.3.1.1~3,7~]decan-1-yl]acetic acid | | Formula: | C12 H19 N O2 | | SMILES: | O=C(O)C(C13CC2CC(C1)CC(C2)C3)N | | InChi: | InChI=1S/C12H19NO2/c13-10(11(14)15)12-4-7-1-8(5-12)3-9(2-7)6-12/h7-10H,1-6,13H2,(H,14,15)/t7-,8+,9-,10-,12-/m1/s1 | | Definition date: | 2016-04-28 | | Last modified: | 2023-11-03 | | Release date: | 2017-05-10 | | Identifier: | (2S)-amino[(3R,5R,7R)-tricyclo[3.3.1.1~3,7~]decan-1-yl]acetic acid |
|
 | | 4AF | | Name: | 4-ACETYL-L-PHENYLALANINE | | Formula: | C11 H13 N O3 | | SMILES: | O=C(O)C(N)Cc1ccc(cc1)C(=O)C | | InChi: | InChI=1S/C11H13NO3/c1-7(13)9-4-2-8(3-5-9)6-10(12)11(14)15/h2-5,10H,6,12H2,1H3,(H,14,15)/t10-/m0/s1 | | Synonyms: | P-ACETYLPHENYLALANINE | | Definition date: | 2005-05-04 | | Last modified: | 2023-11-03 | | Identifier: | 4-acetyl-L-phenylalanine |
|
 | | FBE | | Name: | (3E)-5-aminopent-3-enoic acid | | Formula: | C5 H9 N O2 | | SMILES: | O=C(O)C/C=C/CN | | InChi: | InChI=1S/C5H9NO2/c6-4-2-1-3-5(7)8/h1-2H,3-4,6H2,(H,7,8)/b2-1+ | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | (3E)-5-aminopent-3-enoic acid |
|
 | | 4AK | | Name: | N~6~-sulfo-L-lysine | | Formula: | C6 H14 N2 O5 S | | SMILES: | O=S(=O)(O)NCCCCC(C(=O)O)N | | InChi: | InChI=1S/C6H14N2O5S/c7-5(6(9)10)3-1-2-4-8-14(11,12)13/h5,8H,1-4,7H2,(H,9,10)(H,11,12,13)/t5-/m0/s1 | | Definition date: | 2015-02-20 | | Last modified: | 2023-11-03 | | Release date: | 2015-07-15 | | Identifier: | N~6~-sulfo-L-lysine |
|
 | | 4AR | | Name: | amino({(4S)-4-amino-6-[(2,6-dimethylbenzoyl)oxy]-5-oxohexyl}amino)methaniminium | | Formula: | C16 H25 N4 O3 | | SMILES: | O=C(OCC(=O)C(N)CCCNC(=[NH2+])N)c1c(cccc1C)C | | InChi: | InChI=1S/C16H24N4O3/c1-10-5-3-6-11(2)14(10)15(22)23-9-13(21)12(17)7-4-8-20-16(18)19/h3,5-6,12H,4,7-9,17H2,1-2H3,(H4,18,19,20)/p+1/t12-/m0/s1 | | Definition date: | 2013-01-09 | | Last modified: | 2023-11-03 | | Identifier: | amino({(4S)-4-amino-6-[(2,6-dimethylbenzoyl)oxy]-5-oxohexyl}amino)methaniminium |
|
 | | 4AW | | Name: | 4-AZATRYPTOPHAN | | Formula: | C10 H11 N3 O2 | | SMILES: | O=C(O)C(N)Cc2c1ncccc1nc2 | | InChi: | InChI=1S/C10H11N3O2/c11-7(10(14)15)4-6-5-13-8-2-1-3-12-9(6)8/h1-3,5,7,13H,4,11H2,(H,14,15)/t7-/m0/s1 | | Definition date: | 2012-07-16 | | Last modified: | 2023-11-03 | | Release date: | 2013-05-29 | | Identifier: | 3-(1H-pyrrolo[3,2-b]pyridin-3-yl)-L-alanine |
|
 | | FC0 | | Name: | N-CARBOXY-L-PHENYLALANINE | | Formula: | C10 H11 N O4 | | SMILES: | O=C(O)C(NC(=O)O)Cc1ccccc1 | | InChi: | InChI=1S/C10H11NO4/c12-9(13)8(11-10(14)15)6-7-4-2-1-3-5-7/h1-5,8,11H,6H2,(H,12,13)(H,14,15)/t8-/m0/s1 | | Definition date: | 2010-05-11 | | Last modified: | 2023-11-03 | | Identifier: | N-carboxy-L-phenylalanine |
|
 | | 4BA | | Name: | 4-[(2-CARBOXY-ETHYLAMINO)-METHYL]-BENZOIC ACID | | Formula: | C11 H13 N O4 | | SMILES: | O=C(O)c1ccc(cc1)CNCCC(=O)O | | InChi: | InChI=1S/C11H13NO4/c13-10(14)5-6-12-7-8-1-3-9(4-2-8)11(15)16/h1-4,12H,5-7H2,(H,13,14)(H,15,16) | | Definition date: | 2000-08-08 | | Last modified: | 2023-11-03 | | Identifier: | 4-{[(2-carboxyethyl)amino]methyl}benzoic acid |
|
 | | 4BF | | Name: | 4-BROMO-L-PHENYLALANINE | | Formula: | 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 | | Synonyms: | P-BROMO-L-PHENYLALANINE | | Definition date: | 2005-08-22 | | Last modified: | 2023-11-03 | | Identifier: | 4-bromo-L-phenylalanine |
|
 | | FCL | | Name: | 3-CHLORO-L-PHENYLALANINE | | Formula: | C9 H10 Cl N O2 | | SMILES: | Clc1cc(ccc1)CC(C(=O)O)N | | InChi: | InChI=1S/C9H10ClNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1 | | Definition date: | 2003-07-31 | | Last modified: | 2023-11-03 | | Identifier: | 3-chloro-L-phenylalanine |
|
 | | 4CF | | Name: | 4-cyano-L-phenylalanine | | Formula: | 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 | | Definition date: | 2010-09-07 | | Last modified: | 2023-11-03 | | Identifier: | 4-cyano-L-phenylalanine |
|
 | | 4CG | | Name: | (1R,2Z)-2-[(2R)-2-amino-3-(phosphonooxy)propylidene]cyclopentanecarboxylic acid | | Formula: | 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 | | Definition date: | 2015-02-27 | | Last modified: | 2023-11-03 | | Release date: | 2015-09-16 | | Identifier: | (1R,2Z)-2-[(2R)-2-amino-3-(phosphonooxy)propylidene]cyclopentanecarboxylic acid |
|
 | | 4CY | | Name: | nitrilo-L-methionine | | Formula: | C5 H8 N2 O2 S | | SMILES: | N#CSCCC(C(=O)O)N | | InChi: | InChI=1S/C5H8N2O2S/c6-3-10-2-1-4(7)5(8)9/h4H,1-2,7H2,(H,8,9)/t4-/m0/s1 | | Definition date: | 2010-09-07 | | Last modified: | 2023-11-03 | | Identifier: | nitrilo-L-methionine |
|
 | | 4D4 | | Name: | (2S,3R)-2-azanyl-5-carbamimidamido-3-oxidanyl-pentanoic acid | | Formula: | 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 | | Definition date: | 2015-03-02 | | Last modified: | 2023-11-03 | | Release date: | 2015-03-18 | | Identifier: | (2S,3R)-2-amino-5-carbamimidamido-3-hydroxypentanoic acid (non-preferred name) |
|
 | | FE3 | | Name: | 4-(2-aminoethyl)-3-chlorobenzoic acid | | Formula: | C9 H10 Cl N O2 | | SMILES: | Clc1cc(ccc1CCN)C(=O)O | | InChi: | InChI=1S/C9H10ClNO2/c10-8-5-7(9(12)13)2-1-6(8)3-4-11/h1-2,5H,3-4,11H2,(H,12,13) | | Definition date: | 2008-03-14 | | Last modified: | 2023-11-03 | | Identifier: | 4-(2-aminoethyl)-3-chlorobenzoic acid |
|
 | | 4DB | | Name: | (2S)-2-amino-4-[5-(dimethylamino)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]butanoic acid | | Formula: | C14 H17 N3 O4 | | SMILES: | O=C(O)C(N)CCN2C(=O)c1ccc(cc1C2=O)N(C)C | | InChi: | InChI=1S/C14H17N3O4/c1-16(2)8-3-4-9-10(7-8)13(19)17(12(9)18)6-5-11(15)14(20)21/h3-4,7,11H,5-6,15H2,1-2H3,(H,20,21)/t11-/m0/s1 | | Definition date: | 2009-09-23 | | Last modified: | 2023-11-03 | | Identifier: | (2S)-2-amino-4-[5-(dimethylamino)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]butanoic acid |
|
 | | 4DP | | Name: | 3-[5-(DIMETHYLAMINO)-1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL]-L-ALANINE | | Formula: | C13 H15 N3 O4 | | SMILES: | O=C(O)C(N)CN2C(=O)c1ccc(cc1C2=O)N(C)C | | InChi: | InChI=1S/C13H15N3O4/c1-15(2)7-3-4-8-9(5-7)12(18)16(11(8)17)6-10(14)13(19)20/h3-5,10H,6,14H2,1-2H3,(H,19,20)/t10-/m0/s1 | | Synonyms: | 4-(N,N-DIMETHYLAMINO)PHTHALIMIDOALANYL | | Definition date: | 2006-10-25 | | Last modified: | 2023-11-03 | | Identifier: | 3-[5-(dimethylamino)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]-L-alanine |
|
 | | FF9 | | Name: | (2S)-2-azanyl-6-[(E)-(1-oxidanyl-1-oxidanylidene-butan-2-ylidene)amino]hexanoic acid | | Formula: | C10 H18 N2 O4 | | SMILES: | CCC(=NCCCC[CH](N)C(O)=O)C(O)=O | | InChi: | InChI=1S/C10H18N2O4/c1-2-8(10(15)16)12-6-4-3-5-7(11)9(13)14/h7H,2-6,11H2,1H3,(H,13,14)(H,15,16)/b12-8+/t7-/m0/s1 | | Definition date: | 2020-05-08 | | Last modified: | 2023-11-03 | | Release date: | 2020-08-05 | | Identifier: | (2~{S})-2-azanyl-6-[(~{E})-(1-oxidanyl-1-oxidanylidene-butan-2-ylidene)amino]hexanoic acid |
|
 | | FFL | | Name: | 5,5'-difluoroleucines | | Formula: | C6 H11 F2 N O2 | | SMILES: | N[CH](CC(CF)CF)C(O)=O | | InChi: | InChI=1S/C6H11F2NO2/c7-2-4(3-8)1-5(9)6(10)11/h4-5H,1-3,9H2,(H,10,11)/t5-/m0/s1 | | Synonyms: | (2S)-2-azanyl-5-fluoranyl-4-(fluoranylmethyl)pentanoic acid | | Definition date: | 2021-11-10 | | Last modified: | 2023-11-03 | | Release date: | 2022-11-16 | | Identifier: | (2~{S})-2-azanyl-5-fluoranyl-4-(fluoranylmethyl)pentanoic acid |
|
 | | 4F3 | | Name: | [2-(1-AMINO-2-HYDROXY-PROPYL)-4-(4-FLUORO-1H-INDOL-3-YLMETHYL)-5-HYDROXY-IMIDAZOL-1-YL]-ACETIC ACID | | Formula: | C17 H19 F N4 O4 | | SMILES: | O=C(O)Cn1c(O)c(nc1C(N)C(O)C)Cc3c2c(F)cccc2nc3 | | InChi: | InChI=1S/C17H19FN4O4/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/h2-4,6,8,15,20,23,26H,5,7,19H2,1H3,(H,24,25)/t8-,15-/m0/s1 | | Definition date: | 2003-12-16 | | Last modified: | 2023-11-03 | | Identifier: | {2-[(1R,2S)-1-amino-2-hydroxypropyl]-4-[(4-fluoro-1H-indol-3-yl)methyl]-5-hydroxy-1H-imidazol-1-yl}acetic acid |
|
