3WL

5,6,7-trihydroxy-2-phenyl-4H-chromen-4-one



Chemical Component Summary

Name5,6,7-trihydroxy-2-phenyl-4H-chromen-4-one
SynonymsBaicalein
Identifiers5,6,7-tris(oxidanyl)-2-phenyl-chromen-4-one
FormulaC15 H10 O5
Molecular Weight270.237
TypeNON-POLYMER
Isomeric SMILESc1ccc(cc1)C2=CC(=O)c3c(cc(c(c3O)O)O)O2
InChIInChI=1S/C15H10O5/c16-9-6-11(8-4-2-1-3-5-8)20-12-7-10(17)14(18)15(19)13(9)12/h1-7,17-19H
InChIKeyFXNFHKRTJBSTCS-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count30
Chiral Atom Count0
Bond Count32
Aromatic Bond Count12

Drug Info: DrugBank

DrugBank IDDB16101 
NameBaicalein
Groups investigational
DescriptionBaicalein is under investigation in clinical trial NCT03830684 (A Randomized, Double-blind, Placebo-controlled, Multicenter and Phase ⅡA Clinical Trial for the Effectiveness and Safety of Baicalein Tablets in the Treatment of Improve Other Aspects of Healthy Adult With Influenza Fever).
Synonyms
  • Noroxylin
  • Baicalein
Categories
  • Antioxidants
  • Benzopyrans
  • Biological Factors
  • Chromones
  • Compounds used in a research, industrial, or household setting
CAS number491-67-8

Related Resource References

Resource NameReference
Pharos CHEMBL8260
PubChem 5281605
ChEMBL CHEMBL8260
ChEBI CHEBI:2979
CCDC/CSD RAMGOB01, JIJWIL, ZUNHOH01, KAMRAU, TOHZIC, GAZWUB, RAMGOB, KAMQOH, ZUNHIB, KAMQIB, ZUNHOH, KAMQUN, RAMGOB02, OQOGIN, ETATOL, LAYTOY, LAYTOY01, KAMQIB01, ODAJOW
COD 4513681, 2018531, 4513555, 4513554