Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C1=COC2=C(C=CC(OCC#CCN3CCN(CC4=CC=CC=C4)CC3)=C2)C1=O

InChIKey

InChIKey=KJHQHCRUKNTCJR-UHFFFAOYSA-N

Formula

C31H30N2O4

Mass

494.591

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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

4p-o-methylisoflavone - Isoflavone - Chromone - Benzopyran - 1-benzopyran - Phenoxy compound - Anisole - Benzylamine - Phenol ether - Methoxybenzene - Phenylmethylamine - Alkyl aryl ether - Aralkylamine - Pyranone - N-alkylpiperazine - Pyran - Benzenoid - Piperazine - Monocyclic benzene moiety - 1,4-diazinane - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Ether - Oxacycle - Hydrocarbon derivative - Organic oxide - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen 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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