Structure Information
Structure

Compound Identification

SMILES

OC1CN=CNC2=C1N=CN2CCCCC(CC1=CC=CC=C1)C(O)=O

InChIKey

InChIKey=KENABUKLZKAHBP-UHFFFAOYSA-N

Formula

C19H24N4O3

Mass

356.426

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Phenylpropanoic acids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpropanoic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-phenylpropanoic-acid - Imidazodiazepine - Imidazo-meta-diazepine - Medium-chain fatty acid - Meta-diazepine - Amino fatty acid - Hydroxy fatty acid - Heterocyclic fatty acid - Branched fatty acid - N-substituted imidazole - Monocyclic benzene moiety - Benzenoid - Fatty acid - Fatty acyl - Azole - Heteroaromatic compound - Imidazole - Secondary alcohol - Amidine - Formamidine - Carboxylic acid amidine - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic nitrogen compound - Amine - Alcohol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.

External Descriptors

Not available

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