Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.NC(=O)C[N+]12CC[N+](CC3=CC=C(C=C3)C3=CC=C(C[C@@H]([C@H](CC4=CC=CC=C4)C(O)=O)C(O)=O)C=C3)(CC1)CC2

InChIKey

InChIKey=GZTAHSDOHSWVAF-CAZDAUFVSA-P

Formula

C37H41F6N3O9

Mass

785.736

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lignans, neolignans and related compounds

Class

Dibenzylbutane lignans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Dibenzylbutane lignans

Alternative Parents

Molecular Framework

Not available

Substituents

Dibenzylbutane lignan skeleton - Alpha-amino acid amide - Biphenyl - 3-phenylpropanoic-acid - Alpha-amino acid or derivatives - N-piperazineacetamide - Benzylamine - Phenylmethylamine - Aralkylamine - N-alkylpiperazine - Benzenoid - Piperazine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - 1,4-diazinane - Quaternary ammonium salt - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Tetraalkylammonium salt - Primary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Alkyl halide - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organofluoride - Organic oxide - Organonitrogen compound - Amine - Organooxygen compound - Alkyl fluoride - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dibenzylbutane lignans. These are lignan compounds containing a 2,3-dibenzylbutane moiety.

External Descriptors

Not available

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