SEQ2FUN

BioLiP

PDB CCD ID: HHF
Number of entries in BioLiP: 2
Chemical formula: C15 H10 O4
InChI: InChI=1S/C15H10O4/c16-10-6-7-11-12(8-10)19-15(14(18)13(11)17)9-4-2-1-3-5-9/h1-8,16,18H
InChIKey: UWQJWDYDYIJWKY-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01O=C1c3c(OC(=C1O)c2ccccc2)cc(O)cc3
OpenEye OEToolkits 1.7.6c1ccc(cc1)C2=C(C(=O)c3ccc(cc3O2)O)O
CACTVS 3.370Oc1ccc2C(=O)C(=C(Oc2c1)c3ccccc3)O
Name:3,7-dihydroxy-2-phenyl-4H-chromen-4-one
ChEMBL: CHEMBL210276
ZINC: ZINC000006116596
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).