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Kuwanon B

CAT: 0804-HY-N8783-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N8783-01Size:1 mg
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Description
Kuwanon B is a flavone derivative that can be found in the root bark of the cultivated mulberry tree (a variety of Morus alba L.) [1].
CAS Number
62949-78-4
UNSPSC
12352005
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/kuwanon-b.html
Solubility
10 mM in DMSO
Smiles
O=C1C(C/C=C(C)\C)=C(C2=CC=C3C(C=CC(C)(C)O3)=C2O)OC4=CC(O)=CC(O)=C14
Molecular Formula
C25H24O6
Molecular Weight
420.45
References & Citations
[1]Nomura T, et, al. Kuwanon A, B, C and Oxydihydromorusin, Four New Flavones from the Root Bark of the Cultivated Mulberry Tree (Morus alba L.) . Chemical & Pharmaceutical Bulletin. Published 25 March 1977.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

5,7-Dihydroxy-2-(5-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-3-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one

Kuwanon B is a member of flavones.

CAS Number62949-78-4
PubChem CID44258295
IUPAC Name5,7-dihydroxy-2-(5-hydroxy-2,2-dimethylchromen-6-yl)-3-(3-methylbut-2-enyl)chromen-4-one
Molecular FormulaC25H24O6
Molecular Weight420.5
XLogP5.5
Topological Polar Surface Area96.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count31
Formal Charge0
Complexity805
SMILES
CC(=CCC1=C(OC2=CC(=CC(=C2C1=O)O)O)C3=C(C4=C(C=C3)OC(C=C4)(C)C)O)C
InChI
InChI=1S/C25H24O6/c1-13(2)5-6-17-23(29)21-18(27)11-14(26)12-20(21)30-24(17)16-7-8-19-15(22(16)28)9-10-25(3,4)31-19/h5,7-12,26-28H,6H2,1-4H3
InChIKey
GHYDRKXFHRBWGZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5,7-Dihydroxy-2-(5-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-3-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one
CAS: 62949-78-4
CID: 44258295
Formula: C25H24O6
MW: 420.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight420.5
XLogP35.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass420.15728848
Monoisotopic Mass420.15728848
Topological Polar Surface Area96.2 Ų
Heavy Atom Count31
Formal Charge0
Complexity805
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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