SEQ2FUN

BioLiP

PDB CCD ID: V6P
Number of entries in BioLiP: 7
Chemical formula: C12 H10 O2
InChI: InChI=1S/C12H10O2/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-9,13H
InChIKey: HBUCPZGYBSEEHF-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Oc1cccc(Oc2ccccc2)c1
OpenEye OEToolkits 2.0.7c1ccc(cc1)Oc2cccc(c2)O
ACDLabs 12.01c1c(cccc1O)Oc2ccccc2
Name:3-phenoxyphenol
ChEMBL: CHEMBL2163966
ZINC: ZINC000000261807
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).