Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=CC(C=CC(=O)OC2=CC=C(NC(C)=O)C=C2)=C1)C(=O)OCC1=CC=CC=C1

InChIKey

InChIKey=BQLNPVBRBGENOF-UHFFFAOYSA-N

Formula

C26H23NO6

Mass

445.471

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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 homomonocyclic compounds

Substituents

Cinnamic acid ester - Coumaric acid or derivatives - O-methoxybenzoic acid or derivatives - Benzyloxycarbonyl - Phenol ester - Benzoate ester - Acetanilide - Anilide - Benzoic acid or derivatives - N-acetylarylamine - Phenol ether - Phenoxy compound - N-arylamide - Styrene - Methoxybenzene - Benzoyl - Anisole - Alkyl aryl ether - Fatty acid ester - Benzenoid - Fatty acyl - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Acetamide - Enoate ester - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic 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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