SEQ2FUN

BioLiP

PDB CCD ID: H48
Number of entries in BioLiP: 3
Chemical formula: C14 H14 O2
InChI: InChI=1S/C14H14O2/c1-10(11-2-6-13(15)7-3-11)12-4-8-14(16)9-5-12/h2-10,15-16H,1H3
InChIKey: HCNHNBLSNVSJTJ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6CC(c1ccc(cc1)O)c2ccc(cc2)O
CACTVS 3.385CC(c1ccc(O)cc1)c2ccc(O)cc2
Name:4-[1-(4-hydroxyphenyl)ethyl]phenol
ChEMBL: CHEMBL2392656
ZINC: ZINC000000057029
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).