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BioLiP

PDB CCD ID: PBC
Number of entries in BioLiP: 14
Chemical formula: C6 H7 B O2
InChI: InChI=1S/C6H7BO2/c8-7(9)6-4-2-1-3-5-6/h1-5,8-9H
InChIKey: HXITXNWTGFUOAU-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0B(c1ccccc1)(O)O
ACDLabs 10.04
CACTVS 3.341		OB(O)c1ccccc1
Name:PHENYL BORONIC ACID
ChEMBL: CHEMBL21485
DrugBank: DB01795
ZINC: ZINC000169743014
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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