Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(OCC1=C(Cl)C=CC=C1Cl)C=C2)C1=CC(OC)=C(OC)C=C1

InChIKey

InChIKey=YHUIHAGGTGPKLS-UHFFFAOYSA-N

Formula

C27H22Cl2O7

Mass

529.37

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

O-methylated isoflavonoids

Intermediate Tree Nodes

4'-O-methylated isoflavonoids

Direct Parent

4'-O-methylisoflavones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3p-methoxyisoflavone - 4p-o-methylisoflavone - Isoflavone - Chromone - Benzopyran - 1-benzopyran - Dimethoxybenzene - O-dimethoxybenzene - 1,3-dichlorobenzene - Phenol ether - Phenoxy compound - Methoxybenzene - Anisole - Chlorobenzene - Pyranone - Alkyl aryl ether - Halobenzene - Aryl chloride - Benzenoid - Pyran - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organooxygen compound - Organic oxide - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 4'-o-methylisoflavones. These are isoflavones with methoxy groups attached to the C4' atom of the isoflavone backbone.

External Descriptors

Not available

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