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Kuwanon G

CAT: 1407-AB0277Size: 20 mgDry Ice: NoHazardous: No
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CAT#:1407-AB0277Size:20 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
75629-19-5
Purity
98% (HPLC)
Molecular Formula
C40H36O11
Molecular Weight
692.717

Chemical Information

Kuwanon G

Kuwanone G is a tetrahydroxyflavone isolated from the root barks of Morus alba and has been shown to exhibit anti-inflammatory activity. It has a role as an anti-inflammatory agent and a plant metabolite. It is a member of resorcinols and a tetrahydroxyflavone.

CAS Number75629-19-5
PubChem CID5281667
IUPAC Name8-[(1S,5R,6S)-6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methylbut-2-enyl)chromen-4-one
Molecular FormulaC40H36O11
Molecular Weight692.7
XLogP7.3
Topological Polar Surface Area205
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Heavy Atom Count51
Formal Charge0
Complexity1380
SMILES
CC1=C[C@@H]([C@H]([C@@H](C1)C2=C(C=C(C=C2)O)O)C(=O)C3=C(C=C(C=C3)O)O)C4=C(C=C(C5=C4OC(=C(C5=O)CC=C(C)C)C6=C(C=C(C=C6)O)O)O)O
InChI
InChI=1S/C40H36O11/c1-18(2)4-8-26-38(50)36-33(48)17-32(47)35(40(36)51-39(26)25-11-7-22(43)16-31(25)46)28-13-19(3)12-27(23-9-5-20(41)14-29(23)44)34(28)37(49)24-10-6-21(42)15-30(24)45/h4-7,9-11,13-17,27-28,34,41-48H,8,12H2,1-3H3/t27-,28-,34-/m0/s1
InChIKey
APPXYONGBIXGRO-AIQWNVMPSA-N
Chemical Structure
2D Structure
2D structure of Kuwanon G
CAS: 75629-19-5
CID: 5281667
Formula: C40H36O11
MW: 692.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight692.7
XLogP37.3
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Exact Mass692.22576196
Monoisotopic Mass692.22576196
Topological Polar Surface Area205 Ų
Heavy Atom Count51
Formal Charge0
Complexity1380
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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