BioLiP

PDB

BioLiP

PDB CCD ID:

F0J

Number of entries in BioLiP:

Chemical formula:

C8 H10 O3

InChI:

InChI=1S/C8H10O3/c1-10-6-3-4-7(9)8(5-6)11-2/h3-5,9H,1-2H3

InChIKey:

MNVMYTVDDOXZLS-UHFFFAOYSA-N

SMILES:

Software	SMILES
ACDLabs 12.01	COc1ccc(c(OC)c1)O
OpenEye OEToolkits 2.0.6	COc1ccc(c(c1)OC)O
CACTVS 3.385	COc1ccc(O)c(OC)c1

Name:

2,4-dimethoxyphenol

ZINC:

ZINC000013376192

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).