4-O-methylbutein

Inquiry

For Research Use Only.

Category

Chalcones

Cat.No.

NP0940

CAS

13323-67-6

Product Name

4-O-methylbutein

Structure

Product Details

Description

4-O-Methylbutein is extracted from the flower heads of Dahlia tenuicaulis Sorensen. It is a potent heme oxygenase-1 (HO-1) inducer. It may have anti-inflammatory activity and is used for fighting inflammation.

Synonyms

Butein 4-methyl ether; (E)-1-(2,4-dihydroxyphenyl)-3-(3-hydroxy-4-methoxyphenyl)prop-2-en-1-one; 3,4',6'-Trihydroxy-4-methoxychalcone; 3,2',4'-Trihydroxy-4-methoxychalcone; 1-(2,4-Dihydroxyphenyl)-3-(3-hydroxy-4-methoxyphenyl)-2-propen-1-one

IUPAC Name

(E)-1-(2,4-dihydroxyphenyl)-3-(3-hydroxy-4-methoxyphenyl)prop-2-en-1-one

Molecular Weight

286.28

Molecular Formula

C16H14O5

Canonical SMILES

COC1=C(C=C(C=C1)C=CC(=O)C2=C(C=C(C=C2)O)O)O

InChI

InChI=1S/C16H14O5/c1-21-16-7-3-10(8-15(16)20)2-6-13(18)12-5-4-11(17)9-14(12)19/h2-9,17,19-20H,1H3/b6-2+

InChIKey

WGVFVBIJKULVHA-QHHAFSJGSA-N

Boiling Point

555.6±50.0°C (Predicted)

Melting Point

198.5-200.5°C

Purity

98.5%

Density

1.369±0.06 g/cm3(Predicted)

Appearance

Yellow powder

Form

Powder

pKa

7.33±0.35(Predicted)

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