Structure Information
Structure

Compound Identification

SMILES

COC1=CC(OC)=C2C=C(COC2=C1)C1=CC=C(C=C1)C1=CC2=C(OC)C=C(OC)C=C2OC1

InChIKey

InChIKey=PNTHEQDRWSPECD-UHFFFAOYSA-N

Formula

C28H26O6

Mass

458.51

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

O-methylated isoflavonoids

Intermediate Tree Nodes

Not available

Direct Parent

7-O-methylated isoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5-methoxyisoflavonoid-skeleton - 7-methoxyisoflavonoid-skeleton - Isoflav-3-ene skeleton - Benzopyran - 1-benzopyran - Anisole - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Organoheterocyclic compound - Oxacycle - Ether - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 7-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C7 atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.

External Descriptors

Not available

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