SEQ2FUN

BioLiP

PDB CCD ID: A1BDD
Number of entries in BioLiP: 5
Chemical formula: C8 H10 O2
InChI: InChI=1S/C8H10O2/c1-10-8-4-2-7(6-9)3-5-8/h2-5,9H,6H2,1H3
InChIKey: MSHFRERJPWKJFX-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 14.52
CACTVS 3.385		COc1ccc(CO)cc1
OpenEye OEToolkits 3.1.0.0COc1ccc(cc1)CO
Name:(4-methoxyphenyl)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).