SEQ2FUN

BioLiP

PDB CCD ID: Y4T
Number of entries in BioLiP: 2
Chemical formula: C18 H18 O2
InChI: InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,7-12,19-20H,1-2,5-6H2
InChIKey: FVYXIJYOAGAUQK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Oc1ccc(cc1CC=C)c2cc(CC=C)ccc2O
ACDLabs 12.01Oc1ccc(cc1CC=C)c1cc(CC=C)ccc1O
OpenEye OEToolkits 2.0.7C=CCc1ccc(c(c1)c2ccc(c(c2)CC=C)O)O
Name:(1P)-3',5-di(prop-2-en-1-yl)[1,1'-biphenyl]-2,4'-diol;
Honokiol
ChEMBL: CHEMBL16901
ZINC: ZINC000000001536
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).