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BioLiP Library

PDB CCD ID: A1D7Z
Number of entries in BioLiP: 1
Chemical formula: C9 H12 O2
InChI: InChI=1S/C9H12O2/c1-5-4-8(10)6(2)7(3)9(5)11/h4,10-11H,1-3H3
InChIKey: AUFZRCJENRSRLY-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Cc1cc(O)c(C)c(C)c1O
OpenEye OEToolkits 2.0.7Cc1cc(c(c(c1O)C)C)O
Name:2,3,5-trimethylbenzene-1,4-diol;
Trimethylhydroquinone
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)(download the PDF file).
  • 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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