SEQ2FUN

BioLiP

PDB CCD ID: T1I
Number of entries in BioLiP: 1
Chemical formula: C12 H10 O2
InChI: InChI=1S/C12H10O2/c13-11-5-1-3-9(7-11)10-4-2-6-12(14)8-10/h1-8,13-14H
InChIKey: VZQSBJKDSWXLKX-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc(cc(c1)O)c2cccc(c2)O
CACTVS 3.385Oc1cccc(c1)c2cccc(O)c2
ACDLabs 12.01Oc1cc(ccc1)c1cc(O)ccc1
Name:(1P)-[1,1'-biphenyl]-3,3'-diol;
3,3'-Biphenol
ChEMBL: CHEMBL3815102
ZINC: ZINC000000400271
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).