Structure Information
Structure

Compound Identification

SMILES

CC1=CC(NC2=CC(C(=O)NC3(CCC4=CC(F)=CC=C4)CCOCC3)=C(CCC(O)=O)C=C2)=CC(C)=C1

InChIKey

InChIKey=WIFNRHGNFXBUEF-UHFFFAOYSA-N

Formula

C31H35FN2O4

Mass

518.629

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Phenylpropanoic acids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpropanoic acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

3-phenylpropanoic-acid - Aminobenzamide - Aminobenzoic acid or derivatives - Benzoic acid or derivatives - Benzamide - M-xylene - Xylene - Benzoyl - Aniline or substituted anilines - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Oxane - Benzenoid - Monocyclic benzene moiety - Primary aromatic amine - Amino acid or derivatives - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Oxacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organofluoride - Organic oxide - Hydrocarbon derivative - Amine - Organohalogen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.

External Descriptors

Not available

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