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BioLiP

PDB CCD ID: F0J
Number of entries in BioLiP: 1
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:
SoftwareSMILES
ACDLabs 12.01COc1ccc(c(OC)c1)O
OpenEye OEToolkits 2.0.6COc1ccc(c(c1)OC)O
CACTVS 3.385COc1ccc(O)c(OC)c1
Name:2,4-dimethoxyphenol
ZINC: ZINC000013376192
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L 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).

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