Structure Information
Structure

Compound Identification

SMILES

CCCC1=C(OCCCOC2=CC(=O)\C(C=C2CC)=C2/NNC=C2)C=C(CCC(O)=O)C=C1

InChIKey

InChIKey=ICCOHHGWTROUNQ-DQRAZIAOSA-N

Formula

C26H32N2O5

Mass

452.551

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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 - Phenylpropane - Phenoxy compound - O-quinomethane - Phenol ether - Quinomethane - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Pyrazoline - Vinylogous ester - Vinylogous amide - Cyclic ketone - Ketone - Carboxylic acid derivative - Carboxylic acid - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Azacycle - Carbonyl group - Hydrazine derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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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