![I2F I2F](https://data.pdbj.org/pdbjplus/data/cc/svg/I2F.svg) | I2F | Name: | (2~{S},4~{R},5~{E})-5-[(5~{S})-5-azanyl-6-oxidanyl-hexyl]iminohexane-1,2,4-triol | Formula: | C12 H26 N2 O5 | SMILES: | CC(=NCCCC[CH](N)C(O)O)[CH](O)C[CH](O)CO | InChi: | InChI=1S/C12H26N2O5/c1-8(11(17)6-9(16)7-15)14-5-3-2-4-10(13)12(18)19/h9-12,15-19H,2-7,13H2,1H3/b14-8+/t9-,10-,11+/m0/s1 | Definition date: | 2022-02-08 | Last modified: | 2023-11-03 | Release date: | 2023-02-08 | Identifier: | (2~{S},4~{R},5~{E})-5-[(5~{S})-5-azanyl-6,6-bis(oxidanyl)hexyl]iminohexane-1,2,4-triol |
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![I2J I2J](https://data.pdbj.org/pdbjplus/data/cc/svg/I2J.svg) | I2J | Name: | 2-(2-aminoethoxy)ethan-1-ol | Formula: | C4 H11 N O2 | SMILES: | NCCOCCO | InChi: | InChI=1S/C4H11NO2/c5-1-3-7-4-2-6/h6H,1-5H2 | Definition date: | 2022-01-07 | Last modified: | 2023-11-03 | Release date: | 2022-08-03 | Identifier: | 2-(2-aminoethoxy)ethan-1-ol |
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![I3D I3D](https://data.pdbj.org/pdbjplus/data/cc/svg/I3D.svg) | I3D | Name: | 5,6-difluoro-tryptophan | Formula: | C11 H10 F2 N2 O2 | SMILES: | N[CH](Cc1c[nH]c2cc(F)c(F)cc12)C(O)=O | InChi: | InChI=1S/C11H10F2N2O2/c12-7-2-6-5(1-9(14)11(16)17)4-15-10(6)3-8(7)13/h2-4,9,15H,1,14H2,(H,16,17)/t9-/m0/s1 | Synonyms: | (2S)-2-azanyl-3-[5,6-bis(fluoranyl)-1H-indol-3-yl]propanoic acid | Definition date: | 2022-02-10 | Last modified: | 2023-11-03 | Release date: | 2022-11-23 | Identifier: | (2~{S})-2-azanyl-3-[5,6-bis(fluoranyl)-1~{H}-indol-3-yl]propanoic acid |
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![I4O I4O](https://data.pdbj.org/pdbjplus/data/cc/svg/I4O.svg) | I4O | Name: | Histidine oxo-vanadium complex | Formula: | C6 H8 N3 O6 V | SMILES: | N[CH](Cc1cn(cn1)[V]([O-])([O-])([O-])=O)C(O)=O | InChi: | InChI=1S/C6H9N3O2.4O.V/c7-5(6(10)11)1-4-2-8-3-9-4 | Synonyms: | [4-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]imidazol-1-yl]-tris(oxidanidyl)-oxidanylidene-vanadium | Definition date: | 2022-02-11 | Last modified: | 2023-11-03 | Release date: | 2023-02-01 | Identifier: | [4-[(2~{S})-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]imidazol-1-yl]-tris(oxidanidyl)-oxidanylidene-vanadium |
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![I7X I7X](https://data.pdbj.org/pdbjplus/data/cc/svg/I7X.svg) | I7X | Name: | 6-imidazol-1-ylhexanoic acid | Formula: | C9 H14 N2 O2 | SMILES: | OC(=O)CCCCCn1ccnc1 | InChi: | InChI=1S/C9H14N2O2/c12-9(13)4-2-1-3-6-11-7-5-10-8-11/h5,7-8H,1-4,6H2,(H,12,13) | Definition date: | 2022-06-14 | Last modified: | 2023-11-03 | Release date: | 2023-06-14 | Identifier: | 6-imidazol-1-ylhexanoic acid |
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![IAE IAE](https://data.pdbj.org/pdbjplus/data/cc/svg/IAE.svg) | IAE | Name: | (2S)-2-azanyl-4-[4-(trifluoromethyl)phenyl]butanoic acid | Formula: | C11 H12 F3 N O2 | SMILES: | N[CH](CCc1ccc(cc1)C(F)(F)F)C(O)=O | InChi: | InChI=1S/C11H12F3NO2/c12-11(13,14)8-4-1-7(2-5-8)3-6-9(15)10(16)17/h1-2,4-5,9H,3,6,15H2,(H,16,17)/t9-/m0/s1 | Definition date: | 2022-06-23 | Last modified: | 2023-11-03 | Release date: | 2023-07-26 | Identifier: | (2~{S})-2-azanyl-4-[4-(trifluoromethyl)phenyl]butanoic acid |
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![IB9 IB9](https://data.pdbj.org/pdbjplus/data/cc/svg/IB9.svg) | IB9 | Name: | Beta-tyrosine | Formula: | C9 H11 N O3 | SMILES: | N[CH](CC(O)=O)c1ccc(O)cc1 | InChi: | InChI=1S/C9H11NO3/c10-8(5-9(12)13)6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1 | Synonyms: | (3S)-3-azanyl-3-(4-hydroxyphenyl)propanoic acid | Definition date: | 2022-03-08 | Last modified: | 2023-11-03 | Release date: | 2023-01-18 | Identifier: | (3~{S})-3-azanyl-3-(4-hydroxyphenyl)propanoic acid |
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![IC0 IC0](https://data.pdbj.org/pdbjplus/data/cc/svg/IC0.svg) | IC0 | Name: | Fmoc-(S)-2-(4-pentenyl)-glycine | Formula: | C7 H13 N O2 | SMILES: | N[CH](CCCC=C)C(O)=O | InChi: | InChI=1S/C7H13NO2/c1-2-3-4-5-6(8)7(9)10/h2,6H,1,3-5,8H2,(H,9,10)/t6-/m0/s1 | Synonyms: | (2S)-2-azanylhept-6-enoic acid | Definition date: | 2022-03-08 | Last modified: | 2023-11-03 | Release date: | 2022-05-18 | Identifier: | (2~{S})-2-azanylhept-6-enoic acid |
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![0FL 0FL](https://data.pdbj.org/pdbjplus/data/cc/svg/0FL.svg) | 0FL | Name: | 3-amino-N-formyl-L-alanine | Formula: | C4 H8 N2 O3 | SMILES: | O=CNC(C(=O)O)CN | InChi: | InChI=1S/C4H8N2O3/c5-1-3(4(8)9)6-2-7/h2-3H,1,5H2,(H,6,7)(H,8,9)/t3-/m0/s1 | Definition date: | 2010-09-24 | Last modified: | 2023-11-03 | Identifier: | 3-amino-N-formyl-L-alanine |
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![IEY IEY](https://data.pdbj.org/pdbjplus/data/cc/svg/IEY.svg) | IEY | Name: | {5-hydroxy-4-(4-hydroxybenzyl)-2-[(E)-2-(1H-imidazol-4-yl)ethenyl]-1H-imidazol-1-yl}acetic acid | Formula: | C17 H16 N4 O4 | SMILES: | O=C(O)Cn2c(O)c(nc2C=Cc1ncnc1)Cc3ccc(O)cc3 | InChi: | InChI=1S/C17H16N4O4/c22-13-4-1-11(2-5-13)7-14-17(25)21(9-16(23)24)15(20-14)6-3-12-8-18-10-19-12/h1-6,8,10,14,22H,7,9H2,(H,18,19)(H,23,24)/b6-3+/t14-/m0/s1 | Synonyms: | CHROMOPHORE (HIS-TYR-GLY) | Definition date: | 2005-06-01 | Last modified: | 2023-11-03 | Identifier: | {5-hydroxy-4-(4-hydroxybenzyl)-2-[(E)-2-(1H-imidazol-4-yl)ethenyl]-1H-imidazol-1-yl}acetic acid |
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![0HQ 0HQ](https://data.pdbj.org/pdbjplus/data/cc/svg/0HQ.svg) | 0HQ | Name: | diazomethane | Formula: | C H2 N2 | SMILES: | [N-]=[N+]=C | InChi: | InChI=1S/CH2N2/c1-3-2/h1H2 | Synonyms: | DIAZOMETHYL GROUP | Definition date: | 2008-12-09 | Last modified: | 2023-11-03 | Identifier: | diazomethane |
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![0JU 0JU](https://data.pdbj.org/pdbjplus/data/cc/svg/0JU.svg) | 0JU | Name: | (4S,5Z)-4-amino-5-iminopentanamide | Formula: | C5 H11 N3 O | SMILES: | O=C(N)CCC(C=[N@H])N | InChi: | InChI=1S/C5H11N3O/c6-3-4(7)1-2-5(8)9/h3-4,6H,1-2,7H2,(H2,8,9)/b6-3-/t4-/m0/s1 | Definition date: | 2012-01-27 | Last modified: | 2023-11-03 | Release date: | 2012-12-07 | Identifier: | (4S,5Z)-4-amino-5-iminopentanamide |
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![0JY 0JY](https://data.pdbj.org/pdbjplus/data/cc/svg/0JY.svg) | 0JY | Name: | 4-methyl-L-leucine | Formula: | C7 H15 N O2 | SMILES: | O=C(O)C(N)CC(C)(C)C | InChi: | InChI=1S/C7H15NO2/c1-7(2,3)4-5(8)6(9)10/h5H,4,8H2,1-3H3,(H,9,10)/t5-/m0/s1 | Definition date: | 2012-08-16 | Last modified: | 2023-11-03 | Release date: | 2012-10-26 | Identifier: | 4-methyl-L-leucine |
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![0LF 0LF](https://data.pdbj.org/pdbjplus/data/cc/svg/0LF.svg) | 0LF | Name: | (4R)-4-(4-phenylbutoxy)-L-proline | Formula: | C15 H21 N O3 | SMILES: | O=C(O)C2NCC(OCCCCc1ccccc1)C2 | InChi: | InChI=1S/C15H21NO3/c17-15(18)14-10-13(11-16-14)19-9-5-4-8-12-6-2-1-3-7-12/h1-3,6-7,13-14,16H,4-5,8-11H2,(H,17,18)/t13-,14+/m1/s1 | Definition date: | 2012-02-14 | Last modified: | 2023-11-03 | Identifier: | (4R)-4-(4-phenylbutoxy)-L-proline |
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![0MG 0MG](https://data.pdbj.org/pdbjplus/data/cc/svg/0MG.svg) | 0MG | Name: | amino{[(4S)-4-amino-5-carboxy-5-oxopentyl]amino}methaniminium | Formula: | C7 H15 N4 O3 | SMILES: | O=C(C(=O)O)C(N)CCCNC(=[NH2+])N | InChi: | InChI=1S/C7H14N4O3/c8-4(5(12)6(13)14)2-1-3-11-7(9)10/h4H,1-3,8H2,(H,13,14)(H4,9,10,11)/p+1/t4-/m0/s1 | Definition date: | 2010-09-24 | Last modified: | 2023-11-03 | Identifier: | amino{[(4S)-4-amino-5-carboxy-5-oxopentyl]amino}methaniminium |
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![KAC KAC](https://data.pdbj.org/pdbjplus/data/cc/svg/KAC.svg) | KAC | Name: | 4-(benzoylamino)butanoic acid | Formula: | C11 H13 N O3 | SMILES: | O=C(NCCCC(=O)O)c1ccccc1 | InChi: | InChI=1S/C11H13NO3/c13-10(14)7-4-8-12-11(15)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,12,15)(H,13,14) | Definition date: | 2014-10-07 | Last modified: | 2023-11-03 | Release date: | 2014-12-03 | Identifier: | 4-(benzoylamino)butanoic acid |
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![0OB 0OB](https://data.pdbj.org/pdbjplus/data/cc/svg/0OB.svg) | 0OB | Name: | 3-(1-benzothiophen-2-yl)propanoic acid | Formula: | C11 H10 O2 S | SMILES: | O=C(O)CCc2sc1ccccc1c2 | InChi: | InChI=1S/C11H10O2S/c12-11(13)6-5-9-7-8-3-1-2-4-10(8)14-9/h1-4,7H,5-6H2,(H,12,13) | Definition date: | 2012-03-30 | Last modified: | 2023-11-03 | Release date: | 2012-10-05 | Identifier: | 3-(1-benzothiophen-2-yl)propanoic acid |
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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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![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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![KEO KEO](https://data.pdbj.org/pdbjplus/data/cc/svg/KEO.svg) | KEO | Name: | e(R)-beta-lysyl-hydroxylysine | Formula: | C12 H26 N4 O4 | SMILES: | NCCC[CH](N)CC(=O)NCC[CH](O)C[CH](N)C(O)=O | InChi: | InChI=1S/C12H26N4O4/c13-4-1-2-8(14)6-11(18)16-5-3-9(17)7-10(15)12(19)20/h8-10,17H,1-7,13-15H2,(H,16,18)(H,19,20)/t8-,9-,10-/m0/s1 | Definition date: | 2017-10-05 | Last modified: | 2023-11-03 | Release date: | 2017-11-22 | Identifier: | (2~{S},4~{S})-2-azanyl-6-[[(3~{S})-3,6-bis(azanyl)hexanoyl]amino]-4-oxidanyl-hexanoic acid |
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![KF2 KF2](https://data.pdbj.org/pdbjplus/data/cc/svg/KF2.svg) | KF2 | Name: | [(1~{R})-1-azanyl-3-phenyl-propyl]-[(2~{S})-2-methanoyl-4-methyl-pentyl]phosphinic acid | Formula: | C16 H26 N O3 P | SMILES: | CC(C)C[CH](C[P](O)(=O)[CH](N)CCc1ccccc1)C=O | InChi: | InChI=1S/C16H26NO3P/c1-13(2)10-15(11-18)12-21(19,20)16(17)9-8-14-6-4-3-5-7-14/h3-7,11,13,15-16H,8-10,12,17H2,1-2H3,(H,19,20)/t15-,16+/m0/s1 | Definition date: | 2019-05-16 | Last modified: | 2023-11-03 | Release date: | 2019-12-18 | Identifier: | [(1~{R})-1-azanyl-3-phenyl-propyl]-[(2~{S})-2-methanoyl-4-methyl-pentyl]phosphinic acid |
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![0TD 0TD](https://data.pdbj.org/pdbjplus/data/cc/svg/0TD.svg) | 0TD | Name: | (3S)-3-(methylsulfanyl)-L-aspartic acid | Formula: | C5 H9 N O4 S | SMILES: | O=C(O)C(N)C(SC)C(=O)O | InChi: | InChI=1S/C5H9NO4S/c1-11-3(5(9)10)2(6)4(7)8/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3-/m0/s1 | Definition date: | 2012-02-22 | Last modified: | 2023-11-03 | Release date: | 2012-11-09 | Identifier: | (3S)-3-(methylsulfanyl)-L-aspartic acid |
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![KFB KFB](https://data.pdbj.org/pdbjplus/data/cc/svg/KFB.svg) | KFB | Name: | 5-Aminovaleric Acid | Formula: | C5 H11 N O2 | SMILES: | NCCCCC(O)=O | InChi: | InChI=1S/C5H11NO2/c6-4-2-1-3-5(7)8/h1-4,6H2,(H,7,8) | Synonyms: | 5-aminopentanoic acid | Definition date: | 2019-05-17 | Last modified: | 2023-11-03 | Release date: | 2019-10-23 | Identifier: | 5-azanylpentanoic acid |
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![KFU KFU](https://data.pdbj.org/pdbjplus/data/cc/svg/KFU.svg) | KFU | Name: | (3S)-5-chloro-N-(isoquinolin-4-yl)-2,3-dihydro-1-benzofuran-3-carboxamide | Formula: | C18 H13 Cl N2 O2 | SMILES: | Clc1cc2c(cc1)OCC2C(=O)Nc1cncc2ccccc21 | InChi: | InChI=1S/C18H13ClN2O2/c19-12-5-6-17-14(7-12)15(10-23-17)18(22)21-16-9-20-8-11-3-1-2-4-13(11)16/h1-9,15H,10H2,(H,21,22)/t15-/m1/s1 | Definition date: | 2023-08-11 | Last modified: | 2023-11-03 | Release date: | 2023-11-08 | Identifier: | (3S)-5-chloro-N-(isoquinolin-4-yl)-2,3-dihydro-1-benzofuran-3-carboxamide |
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![KG9 KG9](https://data.pdbj.org/pdbjplus/data/cc/svg/KG9.svg) | KG9 | Name: | (4S)-6-chloro-2-[(1-cyanocyclopropyl)methanesulfonyl]-N-(isoquinolin-4-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide | Formula: | C24 H21 Cl N4 O3 S | SMILES: | N#CC1(CC1)CS(=O)(=O)N1Cc2ccc(Cl)cc2C(C1)C(=O)Nc1cncc2ccccc21 | InChi: | InChI=1S/C24H21ClN4O3S/c25-18-6-5-17-12-29(33(31,32)15-24(14-26)7-8-24)13-21(20(17)9-18)23(30)28-22-11-27-10-16-3-1-2-4-19(16)22/h1-6,9-11,21H,7-8,12-13,15H2,(H,28,30)/t21-/m1/s1 | Definition date: | 2023-08-11 | Last modified: | 2023-11-03 | Release date: | 2023-11-08 | Identifier: | (4S)-6-chloro-2-[(1-cyanocyclopropyl)methanesulfonyl]-N-(isoquinolin-4-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
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