+Open data
-Basic information
Entry | Database: PDB chemical components / ID: RZZ |
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Name | Name: Synonyms: 1-methyl-3H-2,1-benzoxaborole-6-carboxylic acid; 1-Hydroxy-1,3-dihydrobenzo[c][1,2]oxaborole-6-carboxylic acid; 5-Carboxybenzoboroxole; 2,1-Benzoxaborole-6-carboxylic acid, 1,3-dihydro-1-hydroxy- |
-Chemical information
Composition | Formula: C8H7BO4 / Number of atoms: 20 / Formula weight: 177.95 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: RZZ / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7ATW | ||||
History |
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External links | UniChem / BindingDB / ChEMBL / ChemicalBook / PubChem / SureChEMBL / ZINC / 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-7atw:
Structure of P. aeruginosa PBP3 in complex with a benzoxaborole (Compound 3)