SEQ2FUN

BioLiP

PDB CCD ID: A1CUY
Number of entries in BioLiP: 1
Chemical formula: C14 H14 O2
InChI: InChI=1S/C14H14O2/c15-10-12-6-4-5-7-13(12)11-16-14-8-2-1-3-9-14/h1-9,15H,10-11H2
InChIKey: RMRTWBZKENSMCI-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 3.1.0.0c1ccc(cc1)OCc2ccccc2CO
CACTVS 3.385OCc1ccccc1COc2ccccc2
ACDLabs 14.52OCc1ccccc1COc1ccccc1
Name:[2-(phenoxymethyl)phenyl]methanol
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).