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ScientificNameLabel
Glabridin
PHCD compound ID : 3666
Chemical Names :
Glabridin
Molecular Formula : C20H20O4
Molecular Weight : 324.136159
More Details :
Names & Synonyms: 4-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[2,3-f]chromen-3-yl]benzene-1,3-diol , 4-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[2,3-f][1]benzopyran-3-yl]benzene-1,3-diol , 4-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[2,3-f]chromen-3-yl]resorcinol
Smiles: Oc1ccc(c(c1)O)[C@@H]1COc2c(C1)ccc1c2C=CC(O1)(C)C
InChi : InChI=1S/C20H20O4/c1-20(2)8-7-16-18(24-20)6-3-12-9-13(11-23-19(12)16)15-5-4-14(21)10-17(15)22/h3-8,10,13,21-22H,9,11H2,1-2H3/t13-/m0/s1
InChi Key : InChIKey=LBQIJVLKGVZRIW-ZDUSSCGKSA-N
PubChem ID : 124052
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 8.367771
Hydrogen bond donor count : 2 Electric dipole moment : 3.126
XLogP : 2.266 VDW volume : 299.956012
Molecular weight : 324.136159 HOMO-LUMO gap : 8.173000
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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