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ScientificNameLabel
3'-O-Methylglabridin
PHCD compound ID : 3667
Chemical Names :
3'-O-Methylglabridin
Molecular Formula : C21H22O4
Molecular Weight : 338.151809
More Details :
Names & Synonyms:
Smiles: Oc1ccc(c(c1C)O)[C@@H]1COc2c(C1)ccc1c2C=CC(O1)(C)C
InChi : InChI=1S/C21H22O4/c1-12-17(22)6-5-15(19(12)23)14-10-13-4-7-18-16(20(13)24-11-14)8-9-21(2,3)25-18/h4-9,14,22-23H,10-11H2,1-3H3/t14-/m0/s1
InChi Key : InChIKey=SOAVLVPRCDRQKI-AWEZNQCLSA-N
PubChem ID :
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 8.345690
Hydrogen bond donor count : 2 Electric dipole moment : 3.775
XLogP : 2.447 VDW volume : 317.251997
Molecular weight : 338.151809 HOMO-LUMO gap : 8.252000
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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