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cudraflavone C
PHCD compound ID : 3453
Chemical Names :
cudraflavone C
Molecular Formula : C25H26O6
Molecular Weight : 422.172939
More Details :
Names & Synonyms: 2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3,6-bis(3-methylbut-2-enyl)chromen-4-one , 2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3,6-bis(3-methylbut-2-enyl)-1-benzopyran-4-one , 2-[2,4-bis(oxidanyl)phenyl]-3,6-bis(3-methylbut-2-enyl)-5,7-bis(oxidanyl)chromen-4-one , 2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3,6-bis(3-methylbut-2-enyl)chromone
Smiles: CC(=CCc1c(oc2c(c1=O)c(O)c(c(c2)O)CC=C(C)C)c1ccc(cc1O)O)C
InChi : InChI=1S/C25H26O6/c1-13(2)5-8-16-20(28)12-21-22(23(16)29)24(30)18(9-6-14(3)4)25(31-21)17-10-7-15(26)11-19(17)27/h5-7,10-12,26-29H,8-9H2,1-4H3
InChi Key : InChIKey=MUUDYSFWQUSAOO-UHFFFAOYSA-N
PubChem ID : 5319924
Rotatable bond count : 5 Rule of five : 0
Hydrogen bond acceptor count : 6 Ionization potential : 9.038991
Hydrogen bond donor count : 4 Electric dipole moment : 2.157
XLogP : 4.303 VDW volume : 408.463471
Molecular weight : 422.172939 HOMO-LUMO gap : 8.601000
Herb list :
Refrences & Litretures:
  
482.      Journal:'J. Agric. Food Chem'      Year:'2010'      Volume:'58'      Page:'5368'      DOI:'10.1021/jf1003607'      Title:'Tyrosinase Inhibitory Constituents from the Roots of Morus nigra: A Structure-Activity Relationship Study'
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