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Quercetin 3,4′-dimethyl ether

Quercetin 3,4′-dimethyl ether structure

CAS No:
33429-83-3
Formula:
C17H14O7
Chemical Name:
Quercetin 3,4′-dimethyl ether
Synonyms:
4H-1-Benzopyran-4-one,5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-;Flavone,3′,5,7-trihydroxy-3,4′-dimethoxy-;5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-4H-1-benzopyran-4-one;3,4′-Dimethoxy-3′,5,7-trihydroxyflavone;Quercetin 3,4′-dimethyl ether;3,4′-Dimethylquercetin;5,7,3′-Trihydroxy-3,4′-dimethoxyflavone;NSC 106970
Categories:
Natural Products > Flavonoids

Description

ChEBI: A dimethoxyflavone that is the 3,4'-dimethyl ether derivative of quercetin. Isolated from Combretum quadrangulare, it exhibits antineoplastic activity.

Quercetin 3,4'-dimethyl ether is a dimethoxyflavone that is the 3,4'-dimethyl ether derivative of quercetin. Isolated from Combretum quadrangulare, it exhibits antineoplastic activity. It has a role as a metabolite and an antineoplastic agent. It is a trihydroxyflavone and a dimethoxyflavone. It derives from a quercetin.

Quercetin 3,4′-dimethyl ether Basic Attributes

Molecular Weight：

330.29

Exact Mass：

330.29

NSC Number：

106970

DSSTox ID：

DTXSID10418970

HScode：

2914509090

Characteristics

PSA：

105

XLogP3：

1.85

Density：

1.6±0.1 g/cm3

Melting Point：

232-233 °C

Boiling Point：

607.0±55.0 °C at 760 mmHg

Flash Point：

227.3±25.0 °C

Refractive Index：

1.701

Drug Information

Metabolism/Metabolites：

3,4p-Dimethoxy-5,7,3p-trihydroxyflavone has known human metabolites that include 3,4p-Dimethoxy-5,3p-dihydroxyflavone, 7-O-glucuronide.

MeSH Entry Terms：

5,7,3'-trihydroxy-3,4'-dimethoxyflavone

Quercetin 3,4′-dimethyl ether Use and Manufacturing

Use Classification：

Polyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211]

Computed Properties

Molecular Weight:330.29
XLogP3:2.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:330.07395278
Monoisotopic Mass:330.07395278
Topological Polar Surface Area:105
Heavy Atom Count:24
Complexity:517
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Quercetin 3,4′-dimethyl ether

Description
Basic Attributes
Characteristics
Drug Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

Quercetin 3,4′-dimethyl ether

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