Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC=C1\C=C\C(=O)N1C[C@@H]2[C@](C1)([C@H]1CC[C@]2(C2=CC=C(C=C2)C(F)(F)F)C2=CC=CC=C12)C(O)=O

InChIKey

InChIKey=WGYGRAUSRYUADS-FSYUWSIYSA-N

Formula

C32H28F3NO4

Mass

547.574

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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 - 2-naphthalenecarboxylic acid - 2-naphthalenecarboxylic acid or derivatives - Cinnamic acid or derivatives - Coumaric acid or derivatives - Trifluoromethylbenzene - Tetralin - Isoindoline - Isoindole or derivatives - Methoxybenzene - Anisole - Styrene - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Phenol ether - Phenoxy compound - N-acylpyrrolidine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Organic oxide - Carbonyl group - Organonitrogen compound - Organofluoride - Alkyl fluoride - Organohalogen compound - Organic oxygen 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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