Structure Information
Structure

Compound Identification

SMILES

CC(=O)N1C[C@H]2CC(C3=CC=C(CCCOC4=C(F)C=CC(F)=C4F)C=C3)=C([C@@H](C1)N2)C(=O)N(CC1=CC(F)=CC(F)=C1)C1CC1

InChIKey

InChIKey=KNSARYZDVQPQFX-MXBOTTGLSA-N

Formula

C35H34F5N3O3

Mass

639.667

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Cinnamic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cinnamic acid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Piperazine - Acetamide - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid derivative - Azacycle - Secondary amine - Ether - Organoheterocyclic compound - Secondary aliphatic amine - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.

External Descriptors

Not available

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