2',4'-Dihydroxy-4,6'-diMethoxydihydrochalcone

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For Research Use Only.

Category

Chalcones

Cat.No.

NP0963

CAS

75679-58-2

Product Name

2',4'-Dihydroxy-4,6'-diMethoxydihydrochalcone

Structure

Product Details

Description

2',4'-Dihydroxy-4,6'-dimethoxydihydrochalcone belongs to a kind of chalcones, which is extracted from the herbs of Cedrus deodara. It is a predicted metabolite generated by BioTransformer. It is generated through an o-dealkylation reaction, which occurs in humans and is generated by cyp2a6, cyp2c9, and cyp2c19 enzymes.

Synonyms

1-(2,4-dihydroxy-6-methoxyphenyl)-3-(4-methoxyphenyl)propan-1-one

IUPAC Name

1-(2,4-dihydroxy-6-methoxyphenyl)-3-(4-methoxyphenyl)propan-1-one

Molecular Weight

302.32

Molecular Formula

C17H18O5

Canonical SMILES

COC1=CC=C(C=C1)CCC(=O)C2=C(C=C(C=C2OC)O)O

InChI

InChI=1S/C17H18O5/c1-21-13-6-3-11(4-7-13)5-8-14(19)17-15(20)9-12(18)10-16(17)22-2/h3-4,6-7,9-10,18,20H,5,8H2,1-2H3

InChIKey

SGAQUVXWXIVPKX-UHFFFAOYSA-N

Boiling Point

503.5±29.0°C (Predicted)

Melting Point

169-170°C

Density

1.243±0.06 g/cm3(Predicted)

Appearance

Powder

Form

Powder

pKa

7.31±0.40(Predicted)

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