Structure Information
Structure

Compound Identification

SMILES

COC1=CC(\C=C\C([O-])=O)=C(C=C1)C1=CC2=C(C=C3CCNCCN23)C=C1

InChIKey

InChIKey=WBUUBYQOMFXTIR-QPJJXVBHSA-M

Formula

C22H21N2O3

Mass

361.422

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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 - Indole or derivatives - Indole - Phenol ether - Phenoxy compound - Styrene - Anisole - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Pyrrole - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid salt - Amino acid - Carboxylic acid derivative - Azacycle - Carboxylic acid - Organoheterocyclic compound - Secondary aliphatic amine - Ether - Secondary amine - Monocarboxylic acid or derivatives - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Organonitrogen compound - Organic anion - 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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