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BioLiP

PDB CCD ID: BDB
Number of entries in BioLiP: 2
Chemical formula: C12 H12 B2 O4
InChI: InChI=1S/C12H12B2O4/c15-13(16)11-5-1-9(2-6-11)10-3-7-12(8-4-10)14(17)18/h1-8,15-18H
InChIKey: SLHKDOGTVUCXKX-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0B(c1ccc(cc1)c2ccc(cc2)B(O)O)(O)O
ACDLabs 10.04
CACTVS 3.341		OB(O)c1ccc(cc1)c2ccc(cc2)B(O)O
Name:4,4'-BIPHENYLDIBORONIC ACID
ChEMBL: CHEMBL109227
DrugBank: DB02627
ZINC: ZINC000169747015
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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