Structure Information
Structure

Compound Identification

SMILES

CSCC[C@H](N1C(=O)[C@H]2[C@@H](C3C4=CC=CC=C4C2C2=CC=CC=C32)C1=O)C(=O)N1CCCCC1

InChIKey

InChIKey=NGEXPXBTNLOQIS-MQEXIPMMSA-N

Formula

C28H30N2O3S

Mass

474.62

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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

Anthracenes Methionine and derivatives Tetralins Isoindolones N-acylpiperidines Pyrrolidine-2-ones N-substituted carboxylic acid imides N-alkylpyrrolidines Tertiary carboxylic acid amides Dicarboximides Lactams Sulfenyl compounds Azacyclic compounds Dialkylthioethers Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organic oxides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-aryltetralin lignan - Anthracene - Methionine or derivatives - Alpha-amino acid or derivatives - Isoindolone - Tetralin - Isoindoline - Isoindole or derivatives - N-acyl-piperidine - Carboxylic acid imide, n-substituted - Piperidine - Pyrrolidone - 2-pyrrolidone - Benzenoid - N-alkylpyrrolidine - Tertiary carboxylic acid amide - Pyrrolidine - Carboxylic acid imide - Dicarboximide - Carboxamide group - Lactam - Carboxylic acid derivative - Sulfenyl compound - Thioether - Dialkylthioether - Azacycle - Organoheterocyclic compound - Organic oxide - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic nitrogen compound - 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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