Structure Information
Structure

Compound Identification

SMILES

CC1=C(O)C=CC(\C=C\C(=O)NC2=C(C=C(O)C=C2)C(O)=O)=C1

InChIKey

InChIKey=BTPVANIPAHYAFI-XVNBXDOJSA-N

Formula

C17H15NO5

Mass

313.309

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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

Hydroxycinnamic acids

Direct Parent

Avenanthramides

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Avenanthramide - N-cinnamoylanthranilic acid - Acylaminobenzoic acid or derivatives - Cinnamic acid amide - Coumaric acid or derivatives - Hydroxybenzoic acid - Benzoic acid or derivatives - Benzoic acid - Anilide - Benzoyl - O-cresol - N-arylamide - Styrene - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Toluene - Benzenoid - Monocyclic benzene moiety - Vinylogous amide - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as avenanthramides. These are a group of phenolic alkaloids consisting of conjugate of three phenylpropanoids (ferulic, caffeic, or p-coumaric acid) and anthranilic acid.

External Descriptors

Not available

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