Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1CCN(CC1)C(=O)\C=C\C1=C(C2=CC3=C(OOCC3)C=C2)C(=C(SC2=C(C(=C(\C=C\C(=O)N3CCC(CC3)C(=O)OCC)C=C2)C2=CC3=C(OOCC3)C=C2)C(F)(F)F)C=C1)C(F)(F)F

InChIKey

InChIKey=JTRQBMXCLBMXBN-KAVGSWPWSA-N

Formula

C52H50F6N2O10S

Mass

1009.03

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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 - Diarylthioether - Benzo-1,2-dioxane - Benzodioxane - Trifluoromethylbenzene - N-acyl-piperidine - Piperidinecarboxylic acid - Aryl thioether - Styrene - Thiophenol ether - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Ortho-dioxin - Piperidine - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azacycle - Sulfenyl compound - Oxacycle - Organoheterocyclic compound - Thioether - Carboxylic acid derivative - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Alkyl fluoride - 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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