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Kaempferide

CAT: 0607-A3522-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-A3522-10Size:10 mg
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Description
O-methylated flavonol
CAS Number
491-54-3
Product Name Alternative
3,5,7-trihydroxy-2-(4-methoxyphenyl)chromen-4-one
Sequence
Kaempferol 4'-O-methyl ether
Field of Research
Others
Purity
0.9953
Solubility
insoluble in H2O; insoluble in EtOH; ≥16.53 mg/mL in DMSO
Smiles
COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O
Molecular Formula
C16H12O6
Molecular Weight
300.26
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Kaempferide

Kaempferide is a monomethoxyflavone that is the 4'-O-methyl derivative of kaempferol. It has a role as a metabolite and an antihypertensive agent. It is a monomethoxyflavone, a trihydroxyflavone and a 7-hydroxyflavonol. It is functionally related to a kaempferol. It is a conjugate acid of a kaempferide(1-).

CAS Number491-54-3
PubChem CID5281666
IUPAC Name3,5,7-trihydroxy-2-(4-methoxyphenyl)chromen-4-one
Molecular FormulaC16H12O6
Molecular Weight300.26
XLogP2.2
Topological Polar Surface Area96.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity465
SMILES
COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O
InChI
InChI=1S/C16H12O6/c1-21-10-4-2-8(3-5-10)16-15(20)14(19)13-11(18)6-9(17)7-12(13)22-16/h2-7,17-18,20H,1H3
InChIKey
SQFSKOYWJBQGKQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Kaempferide
CAS: 491-54-3
CID: 5281666
Formula: C16H12O6
MW: 300.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight300.26
XLogP32.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass300.06338810
Monoisotopic Mass300.06338810
Topological Polar Surface Area96.2 Ų
Heavy Atom Count22
Formal Charge0
Complexity465
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

Alternative Products

CatalogName
T3806-01Kaempferide

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