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Hispaglabridin B
PHCD compound ID : 3671
Chemical Names :
Hispaglabridin B
Molecular Formula : C25H26O4
Molecular Weight : 390.183109
More Details :
Names & Synonyms: 6-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[2,3-f]chromen-3-yl]-2,2-dimethyl-chromen-5-ol , 6-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[2,3-f][1]benzopyran-3-yl]-2,2-dimethyl-1-benzopyran-5-ol , 6-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[2,3-f]chromen-3-yl]-2,2-dimethylchromen-5-ol
Smiles: Oc1c(ccc2c1C=CC(O2)(C)C)[C@@H]1COc2c(C1)ccc1c2C=CC(O1)(C)C
InChi : InChI=1S/C25H26O4/c1-24(2)11-9-18-20(28-24)8-6-17(22(18)26)16-13-15-5-7-21-19(23(15)27-14-16)10-12-25(3,4)29-21/h5-12,16,26H,13-14H2,1-4H3/t16-/m0/s1
InChi Key : InChIKey=CJUFYKORDZSOLF-INIZCTEOSA-N
PubChem ID : 15228661
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 8.311303
Hydrogen bond donor count : 1 Electric dipole moment : 4.197
XLogP : 3.431 VDW volume : 371.443018
Molecular weight : 390.183109 HOMO-LUMO gap : 7.881000
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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