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BioLiP

PDB CCD ID: A1D7Y
Number of entries in BioLiP: 1
Chemical formula: C8 H10 O3
InChI: InChI=1S/C8H10O3/c1-5-3-6(9)4-7(11-2)8(5)10/h3-4,9-10H,1-2H3
InChIKey: RNDWEMBYMPZABZ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385COc1cc(O)cc(C)c1O
OpenEye OEToolkits 2.0.7Cc1cc(cc(c1O)OC)O
Name:2-methoxy-6-methyl-benzene-1,4-diol;
62AA03E1HR
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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