Structure Information
Structure

Compound Identification

SMILES

C[C@@H](O)[C@@H]1[C@H]2CC(=C(N2C1=O)C(O)=O)C1=CC=C(C[N+]2=CC=C(N)C=C2)C=C1

InChIKey

InChIKey=BGIDOYOPACJTAD-NXOUGTEYSA-O

Formula

C21H22N3O4

Mass

380.423

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Cinnamic acids

Intermediate Tree Nodes

Not available

Direct Parent

Cinnamic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cinnamic acid - Carbapenem - 3-phenylpyrroline - Alpha-amino acid or derivatives - Pyrroline carboxylic acid or derivatives - Pyrroline carboxylic acid - Aminopyridine - Azepine - Monocyclic benzene moiety - Benzenoid - Pyridine - Pyridinium - Heteroaromatic compound - Beta-lactam - Tertiary carboxylic acid amide - Pyrroline - Pyrrole - Amino acid or derivatives - Amino acid - Azetidine - Carboxamide group - Lactam - Tertiary amine - Secondary alcohol - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Primary amine - Carbonyl group - Alcohol - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cinnamic acids. These are organic aromatic compounds containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.

External Descriptors

Not available

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