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Structure Information
Structure

Compound Identification

SMILES

CC(=O)C12C3C(C(C4=CC=CC=C14)C1=CC=CC=C21)C(=O)N(C3=O)C1=CC=C(C=C1)C#N

InChIKey

InChIKey=TXIYWLPFZMIPQM-UHFFFAOYSA-N

Formula

C27H18N2O3

Mass

418.452

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lignans, neolignans and related compounds

Class

Aryltetralin lignans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Aryltetralin lignans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-aryltetralin lignan - Anthracene - 1-phenylpyrrolidine - Isoindolone - Tetralin - Isoindoline - Isoindole or derivatives - Benzonitrile - Benzenoid - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Dicarboximide - Pyrrolidine - Pyrrole - Lactam - Ketone - Nitrile - Carbonitrile - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Cyanide - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aryltetralin lignans. These are lignans with a structure based on the 1-phenyltetralin skeleton.

External Descriptors

Not available

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