Structure Information
Structure

Compound Identification

SMILES

CCC1=C(C2=CC=C(OC)C=C2)C(C)(C)OC2=C1C=CC(OC(C)=O)=C2COC(C)=O

InChIKey

InChIKey=KHVACRWDPPJMQC-UHFFFAOYSA-N

Formula

C25H28O6

Mass

424.493

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

O-methylated isoflavonoids

Intermediate Tree Nodes

Not available

Direct Parent

4'-O-methylated isoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4p-methoxyisoflavonoid - Isoflav-3-ene skeleton - 2,2-dimethyl-1-benzopyran - Benzopyran - 1-benzopyran - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Carboxylic acid ester - Ether - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Organic oxygen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 4'-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C4' atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.

External Descriptors

CHEBI:79679 : diester - acetate ester - monomethoxybenzene - chromenes

Previous Back Next