Structure Information
Structure

Compound Identification

SMILES

[O-][Cl](=O)(=O)=O.COC1=CC=C(C=CC2=C(C=C3C=C(OC)C=CC3=[O+]2)C2=CC=CC=C2)C=C1

InChIKey

InChIKey=YDDOSMVKZWJWAU-UHFFFAOYSA-M

Formula

C25H21ClO7

Mass

468.89

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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

6-O-methylated isoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

6-methoxyisoflavonoid-skeleton - Benzopyran - 1-benzopyran - Phenoxy compound - Anisole - Phenol ether - Styrene - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Organic perchlorate salt - Organic perchlorate - Benzenoid - Heteroaromatic compound - Organic chlorate - Organoheterocyclic compound - Oxacycle - Ether - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 6-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C6 atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.

External Descriptors

Not available

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