Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=NNC23C4C5=CC=CC=C5C(C5=CC=CC=C45)C12C(=O)N(C3=O)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=HUBVDJKAYPNQDP-UHFFFAOYSA-N

Formula

C28H20ClN3O4

Mass

497.94

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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 - Alpha-amino acid or derivatives - Isoindolone - Tetralin - Isoindoline - Isoindole or derivatives - Chlorobenzene - Halobenzene - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Aryl halide - Aryl chloride - Benzenoid - Pyrrolidone - 2-pyrrolidone - Dicarboximide - Pyrazoline - Pyrrole - Pyrrolidine - Carboxylic acid imide - Carboxylic acid ester - Lactam - N-alkylated hydrazone - Carboxylic acid derivative - Hydrazone - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - 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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