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Kaempferol-7,4'-dimethyl ether

CAT: 0931-TN2898-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-TN2898-01Size:1 mg
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CAS Number
15486-33-6
Target
Antifection, Phosphatase, Antioxidant
Related Pathways
Oxidation-Reduction, Metabolism, Microbiology/Virology
Purity
0.989
Bioactivity
Kaempferol-7,4'-dimethyl ether, isolated from the rhizomes of Zingiber phillipseae, exhibits antioxidant activity against S. aureus and E. coli with MICs of 200 and 225 μg/ml, respectively.
Smiles
O=C1C=2C(OC(=C1O)C3=CC=C(OC)C=C3)=CC(OC)=CC2O
Molecular Formula
C17H14O6
Molecular Weight
314.29
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Kaempferol-7,4'-dimethyl ether

7,4'-dimethylkaempferol is a dimethoxyflavone that is kaempferol in which the hydroxy groups at position 4' and 7 have been replaced by methoxy groups. It is a component of bee glue and has been isolated from several plant species including Betula exilis, Zingiber mekongense and Alpinia flabellata. It has a role as an antioxidant and a plant metabolite. It is a dimethoxyflavone, a member of flavonols and a dihydroxyflavone. It is functionally related to a kaempferol. It is a conjugate acid of a 7,4'-O-dimethylkaempferol 3-olate.

CAS Number15486-33-6
PubChem CID5378823
IUPAC Name3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
Molecular FormulaC17H14O6
Molecular Weight314.29
XLogP2.5
Topological Polar Surface Area85.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity479
SMILES
COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC)O)O
InChI
InChI=1S/C17H14O6/c1-21-10-5-3-9(4-6-10)17-16(20)15(19)14-12(18)7-11(22-2)8-13(14)23-17/h3-8,18,20H,1-2H3
InChIKey
KZBAXKKOXPLOBX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Kaempferol-7,4'-dimethyl ether
CAS: 15486-33-6
CID: 5378823
Formula: C17H14O6
MW: 314.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight314.29
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass314.07903816
Monoisotopic Mass314.07903816
Topological Polar Surface Area85.2 Ų
Heavy Atom Count23
Formal Charge0
Complexity479
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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