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Kuwanon A

CAS No.:
62949-77-3
Catalog Number:
AG00EI6C
Molecular Formula:
C25H24O6
Molecular Weight:
420.4545
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
2mg
96%
1 week
United States
$258
- +
5mg
96%
1 week
United States
$461
- +
Product Description
Catalog Number:
AG00EI6C
Chemical Name:
Kuwanon A
CAS Number:
62949-77-3
Molecular Formula:
C25H24O6
Molecular Weight:
420.4545
MDL Number:
MFCD31382182
IUPAC Name:
5,7-dihydroxy-2-(5-hydroxy-2,2-dimethylchromen-8-yl)-3-(3-methylbut-2-enyl)chromen-4-one
InChI:
InChI=1S/C25H24O6/c1-13(2)5-6-16-22(29)21-19(28)11-14(26)12-20(21)30-23(16)17-7-8-18(27)15-9-10-25(3,4)31-24(15)17/h5,7-12,26-28H,6H2,1-4H3
InChI Key:
DBUNRZUFILGKHP-UHFFFAOYSA-N
SMILES:
CC(=CCc1c(oc2c(c1=O)c(O)cc(c2)O)c1ccc(c2c1OC(C)(C)C=C2)O)C
Properties
Complexity:
805  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
420.157g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
420.461g/mol
Monoisotopic Mass:
420.157g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
96.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5  
Literature
Title Journal
Inhibition and structural reliability of prenylated flavones from the stem bark of Morus lhou on β-secretase (BACE-1). Bioorganic & medicinal chemistry letters 20110515
Properties