SEQ2FUN

BioLiP

PDB CCD ID: CUH
Number of entries in BioLiP: 2
Chemical formula: C13 H10 O4
InChI: InChI=1S/C13H10O4/c14-10-7-6-9(12(16)13(10)17)11(15)8-4-2-1-3-5-8/h1-7,14,16-17H
InChIKey: HTQNYBBTZSBWKL-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Oc1ccc(c(O)c1O)C(=O)c2ccccc2
OpenEye OEToolkits 2.0.6c1ccc(cc1)C(=O)c2ccc(c(c2O)O)O
Name:2,3,4-Trihydroxybenzophenone
ChEMBL: CHEMBL1527
ZINC: ZINC000000225866
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).