Structure Information
Structure

Compound Identification

SMILES

COC1=C(OCC#N)C=CC(\C=C\C(=O)O[C@H](C)C(=O)C2=C(C)NC3=CC=CC=C23)=C1

InChIKey

InChIKey=NIPUJIDZEORYOB-PXUDHTSWSA-N

Formula

C24H22N2O5

Mass

418.449

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Hydroxycinnamic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Coumaric acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Coumaric acid or derivatives - Cinnamic acid ester - Indole - Indole or derivatives - Anisole - Phenoxy compound - Phenol ether - Styrene - Aryl ketone - Aryl alkyl ketone - Methoxybenzene - Fatty acid ester - Alpha-acyloxy ketone - Alkyl aryl ether - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Substituted pyrrole - Vinylogous amide - Heteroaromatic compound - Pyrrole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Organoheterocyclic compound - Nitrile - Carbonitrile - Ether - Monocarboxylic acid or derivatives - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Cyanide - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as coumaric acids and derivatives. These are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring.

External Descriptors

Not available

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