![S39 S39](https://data.pdbj.org/pdbjplus/data/cc/svg/S39.svg) | S39 | Name: | (4S)-2-{2-[(1,3-benzothiazol-5-yl)amino]-2-oxoethyl}-6-chloro-N-(isoquinolin-4-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide | Formula: | C28 H22 Cl N5 O2 S | SMILES: | Clc1ccc2CN(CC(C(=O)Nc3cncc4ccccc43)c2c1)CC(=O)Nc1cc2ncsc2cc1 | InChi: | InChI=1S/C28H22ClN5O2S/c29-19-6-5-18-13-34(15-27(35)32-20-7-8-26-24(10-20)31-16-37-26)14-23(22(18)9-19)28(36)33-25-12-30-11-17-3-1-2-4-21(17)25/h1-12,16,23H,13-15H2,(H,32,35)(H,33,36)/t23-/m1/s1 | Definition date: | 2023-08-22 | Last modified: | 2023-11-03 | Release date: | 2023-11-08 | Identifier: | (4S)-2-{2-[(1,3-benzothiazol-5-yl)amino]-2-oxoethyl}-6-chloro-N-(isoquinolin-4-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
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![YNM YNM](https://data.pdbj.org/pdbjplus/data/cc/svg/YNM.svg) | YNM | Name: | N-METHYL-L-TYROSINE | Formula: | C10 H13 N O3 | SMILES: | O=C(O)C(NC)Cc1ccc(O)cc1 | InChi: | InChI=1S/C10H13NO3/c1-11-9(10(13)14)6-7-2-4-8(12)5-3-7/h2-5,9,11-12H,6H2,1H3,(H,13,14)/t9-/m0/s1 | Definition date: | 2009-09-03 | Last modified: | 2023-11-03 | Identifier: | N-methyl-L-tyrosine |
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![Q36 Q36](https://data.pdbj.org/pdbjplus/data/cc/svg/Q36.svg) | Q36 | Name: | (2R)-2-(3-cyanophenyl)-N-(4-methylpyridin-3-yl)propanamide | Formula: | C16 H15 N3 O | SMILES: | O=C(Nc1cnccc1C)C(C)c1cccc(C#N)c1 | InChi: | InChI=1S/C16H15N3O/c1-11-6-7-18-10-15(11)19-16(20)12(2)14-5-3-4-13(8-14)9-17/h3-8,10,12H,1-2H3,(H,19,20)/t12-/m1/s1 | Definition date: | 2023-08-18 | Last modified: | 2023-11-03 | Release date: | 2023-11-08 | Identifier: | (2R)-2-(3-cyanophenyl)-N-(4-methylpyridin-3-yl)propanamide |
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![KCJ KCJ](https://data.pdbj.org/pdbjplus/data/cc/svg/KCJ.svg) | 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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![WRP WRP](https://data.pdbj.org/pdbjplus/data/cc/svg/WRP.svg) | WRP | Name: | (betaR)-beta-hydroxy-1-[(3R)-3-hydroxy-2-methylbutan-2-yl]-L-tryptophan | Formula: | C16 H22 N2 O4 | SMILES: | O=C(O)C(N)C(O)c2c1ccccc1n(c2)C(C)(C)C(O)C | InChi: | InChI=1S/C16H22N2O4/c1-9(19)16(2,3)18-8-11(14(20)13(17)15(21)22)10-6-4-5-7-12(10)18/h4-9,13-14,19-20H,17H2,1-3H3,(H,21,22)/t9-,13+,14-/m1/s1 | Definition date: | 2013-06-20 | Last modified: | 2023-11-03 | Release date: | 2013-09-18 | Identifier: | (betaR)-beta-hydroxy-1-[(3R)-3-hydroxy-2-methylbutan-2-yl]-L-tryptophan |
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![P9S P9S](https://data.pdbj.org/pdbjplus/data/cc/svg/P9S.svg) | P9S | Name: | dihydroxypropylcysteine | Formula: | C6 H13 N O4 S | SMILES: | N[CH](CSC[CH](O)CO)C(O)=O | InChi: | InChI=1S/C6H13NO4S/c7-5(6(10)11)3-12-2-4(9)1-8/h4-5,8-9H,1-3,7H2,(H,10,11)/t4-,5+/m1/s1 | Definition date: | 2016-07-26 | Last modified: | 2023-11-03 | Release date: | 2017-03-22 | Identifier: | (2~{R})-2-azanyl-3-[(2~{R})-2,3-bis(oxidanyl)propyl]sulfanyl-propanoic acid |
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![NLO NLO](https://data.pdbj.org/pdbjplus/data/cc/svg/NLO.svg) | NLO | Name: | O-METHYL-L-NORLEUCINE | Formula: | C7 H15 N O2 | SMILES: | O=C(OC)C(N)CCCC | InChi: | InChI=1S/C7H15NO2/c1-3-4-5-6(8)7(9)10-2/h6H,3-5,8H2,1-2H3/t6-/m0/s1 | Definition date: | 2004-01-27 | Last modified: | 2023-11-03 | Identifier: | methyl L-norleucinate |
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![OFM OFM](https://data.pdbj.org/pdbjplus/data/cc/svg/OFM.svg) | OFM | Name: | [(4Z)-2-{(2R,5R)-2-[(1S)-1-amino-2-phenylethyl]-2-hydroxy-5-methyl-2,5-dihydro-1,3-oxazol-4-yl}-4-(4-hydroxybenzylidene
)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid | Formula: | C24 H24 N4 O6 | SMILES: | O=C(O)CN2C(=N/C(=Cc1ccc(O)cc1)C2=O)C3=NC(O)(OC3C)C(N)Cc4ccccc4 | InChi: | InChI=1S/C24H24N4O6/c1-14-21(27-24(33,34-14)19(25)12-15-5-3-2-4-6-15)22-26-18(23(32)28(22)13-20(30)31)11-16-7-9-17(29)10-8-16/h2-11,14,19,29,33H,12-13,25H2,1H3,(H,30,31)/b18-11-/t14-,19+,24-/m1/s1 | Synonyms: | PEPTIDE DERIVED CHROMOPHORE | Definition date: | 2014-04-30 | Last modified: | 2023-11-03 | Release date: | 2014-07-08 | Identifier: | [(4Z)-2-{(2R,5R)-2-[(1S)-1-amino-2-phenylethyl]-2-hydroxy-5-methyl-2,5-dihydro-1,3-oxazol-4-yl}-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid |
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![TQZ TQZ](https://data.pdbj.org/pdbjplus/data/cc/svg/TQZ.svg) | TQZ | Name: | 2-AMINO-3-PENTASULFANYLPROPAN-1-OL | Formula: | C3 H7 N O2 S5 | SMILES: | O=C(O)C(N)CSSSSS | InChi: | InChI=1S/C3H7NO2S5/c4-2(3(5)6)1-8-10-11-9-7/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1 | Definition date: | 2013-04-23 | Last modified: | 2023-11-03 | Release date: | 2013-11-27 | Identifier: | 3-pentasulfanyl-L-alanine |
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![Z7Z Z7Z](https://data.pdbj.org/pdbjplus/data/cc/svg/Z7Z.svg) | Z7Z | Name: | biphenyl-4-carboxylic acid | Formula: | C13 H10 O2 | SMILES: | O=C(O)c2ccc(c1ccccc1)cc2 | InChi: | InChI=1S/C13H10O2/c14-13(15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H,14,15) | Definition date: | 2012-12-17 | Last modified: | 2023-11-03 | Release date: | 2021-09-01 | Identifier: | biphenyl-4-carboxylic acid |
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![KCQ KCQ](https://data.pdbj.org/pdbjplus/data/cc/svg/KCQ.svg) | KCQ | Name: | (3S)-3-[(2S)-2-AMINO-3-OXOBUTYL]PYRROLIDIN-2-ONE | Formula: | C8 H14 N2 O2 | SMILES: | O=C1NCCC1CC(N)C(=O)C | InChi: | InChI=1S/C8H14N2O2/c1-5(11)7(9)4-6-2-3-10-8(6)12/h6-7H,2-4,9H2,1H3,(H,10,12)/t6-,7-/m0/s1 | Definition date: | 2007-06-07 | Last modified: | 2023-11-03 | Identifier: | (3S)-3-[(2S)-2-amino-3-oxobutyl]pyrrolidin-2-one |
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![POK POK](https://data.pdbj.org/pdbjplus/data/cc/svg/POK.svg) | POK | Name: | 2-[[~{N}-[(4~{S})-4-azanyl-5-oxidanylidene-pentyl]carbamimidoyl]amino]ethanoic acid | Formula: | C8 H16 N4 O4 | SMILES: | N[CH](CCCNC(=N)NCC(O)=O)C(O)=O | InChi: | InChI=1S/C8H16N4O4/c9-5(7(15)16)2-1-3-11-8(10)12-4-6(13)14/h5H,1-4,9H2,(H,13,14)(H,15,16)(H3,10,11,12)/t5-/m0/s1 | Definition date: | 2020-04-27 | Last modified: | 2023-11-03 | Release date: | 2020-06-03 | Identifier: | (2~{S})-2-azanyl-5-[[~{N}-(2-hydroxy-2-oxoethyl)carbamimidoyl]amino]pentanoic acid |
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![KCR KCR](https://data.pdbj.org/pdbjplus/data/cc/svg/KCR.svg) | KCR | Name: | N-6-crotonyl-L-lysine | Formula: | C10 H18 N2 O3 | SMILES: | NC(C(O)=O)CCCCNC(=O)[C@H]=[C@H]C | InChi: | InChI=1S/C10H18N2O3/c1-2-5-9(13)12-7-4-3-6-8(11)10(14)15/h2,5,8H,3-4,6-7,11H2,1H3,(H,12,13)(H,14,15)/b5-2+/t8-/m0/s1 | Definition date: | 2015-03-26 | Last modified: | 2023-11-03 | Release date: | 2015-09-16 | Identifier: | N~6~-[(2E)-but-2-enoyl]-L-lysine |
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![POM POM](https://data.pdbj.org/pdbjplus/data/cc/svg/POM.svg) | POM | Name: | CIS-5-METHYL-4-OXOPROLINE | Formula: | C6 H9 N O3 | SMILES: | O=C1C(NC(C(=O)O)C1)C | InChi: | InChI=1S/C6H9NO3/c1-3-5(8)2-4(7-3)6(9)10/h3-4,7H,2H2,1H3,(H,9,10)/t3-,4-/m0/s1 | Definition date: | 1999-07-08 | Last modified: | 2023-11-03 | Identifier: | (5S)-5-methyl-4-oxo-L-proline |
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![NLY NLY](https://data.pdbj.org/pdbjplus/data/cc/svg/NLY.svg) | NLY | Name: | N-(4-aminobutyl)glycine | Formula: | C6 H14 N2 O2 | SMILES: | O=C(O)CNCCCCN | InChi: | InChI=1S/C6H14N2O2/c7-3-1-2-4-8-5-6(9)10/h8H,1-5,7H2,(H,9,10) | Definition date: | 2012-10-18 | Last modified: | 2023-11-03 | Release date: | 2013-10-09 | Identifier: | N-(4-aminobutyl)glycine |
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![VEF VEF](https://data.pdbj.org/pdbjplus/data/cc/svg/VEF.svg) | VEF | Name: | (3S)-3-azanyl-2,2-bis(oxidanyl)butanoic acid | Formula: | C4 H9 N O4 | SMILES: | C[CH](N)C(O)(O)C(O)=O | InChi: | InChI=1S/C4H9NO4/c1-2(5)4(8,9)3(6)7/h2,8-9H,5H2,1H3,(H,6,7)/t2-/m0/s1 | Synonyms: | (3S)-3-azanyl-2-oxidanylidene-butanoic acid (precursor) | Definition date: | 2023-03-03 | Last modified: | 2023-11-03 | Release date: | 2023-07-19 | Identifier: | (3~{S})-3-azanyl-2,2-bis(oxidanyl)butanoic acid |
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![OFX OFX](https://data.pdbj.org/pdbjplus/data/cc/svg/OFX.svg) | OFX | Name: | 2-(1H-benzotriazol-1-yl)-N-[4-(dimethylamino)phenyl]-N-[(1H-pyrazol-5-yl)methyl]acetamide | Formula: | C20 H21 N7 O | SMILES: | O=C(Cn1nnc2ccccc21)N(Cc1ccn[NH]1)c1ccc(cc1)N(C)C | InChi: | InChI=1S/C20H21N7O/c1-25(2)16-7-9-17(10-8-16)26(13-15-11-12-21-22-15)20(28)14-27-19-6-4-3-5-18(19)23-24-27/h3-12H,13-14H2,1-2H3,(H,21,22) | Definition date: | 2023-08-17 | Last modified: | 2023-11-03 | Release date: | 2023-11-08 | Identifier: | 2-(1H-benzotriazol-1-yl)-N-[4-(dimethylamino)phenyl]-N-[(1H-pyrazol-5-yl)methyl]acetamide |
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![KCX KCX](https://data.pdbj.org/pdbjplus/data/cc/svg/KCX.svg) | KCX | Name: | LYSINE NZ-CARBOXYLIC ACID | Formula: | C7 H14 N2 O4 | SMILES: | O=C(O)NCCCCC(C(=O)O)N | InChi: | InChI=1S/C7H14N2O4/c8-5(6(10)11)3-1-2-4-9-7(12)13/h5,9H,1-4,8H2,(H,10,11)(H,12,13)/t5-/m0/s1 | Definition date: | 1999-07-08 | Last modified: | 2023-11-03 | Identifier: | N~6~-carboxy-L-lysine |
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![08M 08M](https://data.pdbj.org/pdbjplus/data/cc/svg/08M.svg) | 08M | Name: | N~5~-(pyrazin-2-ylcarbonyl)-L-ornithine | Formula: | C10 H14 N4 O3 | SMILES: | O=C(NCCCC(C(=O)O)N)c1nccnc1 | InChi: | InChI=1S/C10H14N4O3/c11-7(10(16)17)2-1-3-14-9(15)8-6-12-4-5-13-8/h4-7H,1-3,11H2,(H,14,15)(H,16,17)/t7-/m0/s1 | Definition date: | 2011-10-13 | Last modified: | 2023-11-03 | Identifier: | N~5~-(pyrazin-2-ylcarbonyl)-L-ornithine |
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![KCY KCY](https://data.pdbj.org/pdbjplus/data/cc/svg/KCY.svg) | KCY | Name: | D-homocysteine | Formula: | C4 H9 N O2 S | SMILES: | C(C(N)CCS)(=O)O | InChi: | InChI=1S/C4H9NO2S/c5-3(1-2-8)4(6)7/h3,8H,1-2,5H2,(H,6,7)/t3-/m1/s1 | Definition date: | 2015-03-10 | Last modified: | 2023-11-03 | Release date: | 2015-04-15 | Identifier: | D-homocysteine |
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![VTN VTN](https://data.pdbj.org/pdbjplus/data/cc/svg/VTN.svg) | VTN | Name: | N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenyl]ethyl}prop-2-enamide | Formula: | C18 H14 Cl2 N2 O2 | SMILES: | Clc1ccc(cc1Oc1cc(C#N)cc(Cl)c1)CCNC(=O)C=C | InChi: | InChI=1S/C18H14Cl2N2O2/c1-2-18(23)22-6-5-12-3-4-16(20)17(9-12)24-15-8-13(11-21)7-14(19)10-15/h2-4,7-10H,1,5-6H2,(H,22,23) | Definition date: | 2023-09-18 | Last modified: | 2023-11-03 | Release date: | 2023-11-08 | Identifier: | N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenyl]ethyl}prop-2-enamide |
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![UKY UKY](https://data.pdbj.org/pdbjplus/data/cc/svg/UKY.svg) | UKY | Name: | 3-(5-phosphono-1H-1,2,3-triazol-1-yl)-L-alanine | Formula: | C5 H9 N4 O5 P | SMILES: | C(O)(C(N)Cn1c(P(=O)(O)O)cnn1)=O | InChi: | InChI=1S/C5H9N4O5P/c6-3(5(10)11)2-9-4(1-7-8-9)15(12,13)14/h1,3H,2,6H2,(H,10,11)(H2,12,13,14)/t3-/m0/s1 | Definition date: | 2020-05-20 | Last modified: | 2023-11-03 | Release date: | 2021-02-03 | Identifier: | 3-(5-phosphono-1H-1,2,3-triazol-1-yl)-L-alanine |
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![O0R O0R](https://data.pdbj.org/pdbjplus/data/cc/svg/O0R.svg) | O0R | Name: | 2-(3-chlorophenyl)-N-(4-cyclopropylpyridin-3-yl)acetamide | Formula: | C16 H15 Cl N2 O | SMILES: | O=C(Nc1cnccc1C1CC1)Cc1cccc(Cl)c1 | InChi: | InChI=1S/C16H15ClN2O/c17-13-3-1-2-11(8-13)9-16(20)19-15-10-18-7-6-14(15)12-4-5-12/h1-3,6-8,10,12H,4-5,9H2,(H,19,20) | Definition date: | 2023-08-16 | Last modified: | 2023-11-03 | Release date: | 2023-11-08 | Identifier: | 2-(3-chlorophenyl)-N-(4-cyclopropylpyridin-3-yl)acetamide |
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![TCQ TCQ](https://data.pdbj.org/pdbjplus/data/cc/svg/TCQ.svg) | TCQ | Name: | (1S,2R)-N-{(1E)-5-[(2S)-2-amino-2-carboxyethyl]-2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene}-2-phenylcyclopropanaminium | Formula: | C18 H19 N2 O4 | SMILES: | O=C(O)C(N)CC=3C(=O)C=C(O)C(=[NH+]C2CC2c1ccccc1)C=3 | InChi: | InChI=1S/C18H18N2O4/c19-13(18(23)24)6-11-7-15(17(22)9-16(11)21)20-14-8-12(14)10-4-2-1-3-5-10/h1-5,7,9,12-14,22H,6,8,19H2,(H,23,24)/p+1/b20-15+/t12-,13+,14+/m1/s1 | Definition date: | 2004-07-27 | Last modified: | 2023-11-03 | Identifier: | (1S,2R)-N-{(1E)-5-[(2S)-2-amino-2-carboxyethyl]-2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene}-2-phenylcyclopropanaminium |
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![VTS VTS](https://data.pdbj.org/pdbjplus/data/cc/svg/VTS.svg) | VTS | Name: | N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenoxy]ethyl}-N-methylprop-2-enamide | Formula: | C19 H16 Cl2 N2 O3 | SMILES: | Clc1ccc(cc1Oc1cc(C#N)cc(Cl)c1)OCCN(C)C(=O)C=C | InChi: | InChI=1S/C19H16Cl2N2O3/c1-3-19(24)23(2)6-7-25-15-4-5-17(21)18(11-15)26-16-9-13(12-22)8-14(20)10-16/h3-5,8-11H,1,6-7H2,2H3 | Definition date: | 2023-09-18 | Last modified: | 2023-11-03 | Release date: | 2023-11-08 | Identifier: | N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenoxy]ethyl}-N-methylprop-2-enamide |
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