Structure Information
Structure

Compound Identification

SMILES

COC1=CC(OC)=C(C(CO)=C1)C1=CC2=C(O[C@@H]1C1=CC(OC)=C(OC)C=C1)C=C(CO)C=C2OC

InChIKey

InChIKey=JBJKVMWDNUMNRH-MUUNZHRXSA-N

Formula

C28H30O8

Mass

494.54

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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

5-O-methylated isoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2p-methoxyisoflavonoid-skeleton - 3p-methoxyflavonoid-skeleton - 4p-methoxyflavonoid-skeleton - 4p-methoxyisoflavonoid - 5-methoxyflavonoid-skeleton - 5-methoxyisoflavonoid-skeleton - Flav-3-ene - Isoflav-3-ene skeleton - Stilbene - M-dimethoxybenzene - O-dimethoxybenzene - Dimethoxybenzene - Benzopyran - 1-benzopyran - Phenoxy compound - Methoxybenzene - Anisole - Benzyl alcohol - Phenol ether - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Oxacycle - Organoheterocyclic compound - Ether - Hydrocarbon derivative - Alcohol - Aromatic alcohol - Organooxygen compound - Organic oxygen compound - Primary alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 5-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C5 atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.

External Descriptors

Not available

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