SEQ2FUN

BioLiP

PDB CCD ID: 3DM
Number of entries in BioLiP: 12
Chemical formula: C8 H10 O3
InChI: InChI=1S/C8H10O3/c1-10-6-4-3-5-7(11-2)8(6)9/h3-5,9H,1-2H3
InChIKey: KLIDCXVFHGNTTM-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0COc1cccc(c1O)OC
CACTVS 3.341COc1cccc(OC)c1O
ACDLabs 10.04O(c1cccc(OC)c1O)C
Name:2,6-dimethoxyphenol
ChEMBL: CHEMBL109652
ZINC: ZINC000000154666
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).