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ScientificNameLabel
Coumestan
PHCD compound ID : 3688
Chemical Names :
Coumestan
Molecular Formula : C15H8O3
Molecular Weight : 236.047344
More Details :
Names & Synonyms: benzofuro[3,2-c]chromen-6-one , 6-benzofuro[3,2-c][1]benzopyranone , [1]benzofuro[3,2-c]chromen-6-one
Smiles: O=c1oc2ccccc2c2c1c1ccccc1o2
InChi : InChI=1S/C15H8O3/c16-15-13-9-5-1-3-7-11(9)17-14(13)10-6-2-4-8-12(10)18-15/h1-8H
InChi Key : InChIKey=JBIZUYWOIKFETJ-UHFFFAOYSA-N
PubChem ID : 638309
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 9.103132
Hydrogen bond donor count : 0 Electric dipole moment : 3.941
XLogP : 1.912 VDW volume : 191.149404
Molecular weight : 236.047344 HOMO-LUMO gap : 7.736000
Herb list :
Refrences & Litretures:
  
512.      Journal:'Food Chemistry'      Year:'1990'      Volume:'38'      Page:'119'      DOI:''      Title:'Liquorice, Glycyrrhiza glabra L. - Composition, Uses and Analysis'
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