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Yorodumi- ChemComp-S08: 2-(6-(((R)-2-amino-2-oxo-1-phenylethyl)carbamoyl)-1-hydroxy-1,3-d... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: S08 |
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Name | Name: Synonyms: 2-[(3S)-6-[[(1R)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl]carbamoyl]-1-oxidanyl-3H-2,1-benzoxaborol-3-yl]ethanoic acid |
-Chemical information
Composition | Formula: C18H17BN2O6 / Number of atoms: 44 / Formula weight: 368.148 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: S08 / Model coordinates PDB-ID: 7AU1 | ||||
History |
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External links | UniChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-PDB entries
Showing all 1 items
PDB-7au1:
Structure of P. aeruginosa PBP3 in complex with a benzoxaborole (Compound 12)