Structure Information
Structure

Compound Identification

SMILES

OC(=O)\C=C\C1=CC(CCC(=O)C2=CC(NC3=NCCCN3)=CC=C2)=CC=C1

InChIKey

InChIKey=JADURDFRHXVWKC-PKNBQFBNSA-N

Formula

C22H23N3O3

Mass

377.444

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Chalcones and dihydrochalcones

Intermediate Tree Nodes

Not available

Direct Parent

Retro-dihydrochalcones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Retro-dihydrochalcone - Alkyl-phenylketone - Cinnamic acid - Cinnamic acid or derivatives - Butyrophenone - Phenylketone - Benzoyl - Styrene - Aryl ketone - Aryl alkyl ketone - Aniline or substituted anilines - Benzenoid - Monocyclic benzene moiety - 1,4,5,6-tetrahydropyrimidine - Hydropyrimidine - Ketone - Guanidine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Carboximidamide - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Amine - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as retro-dihydrochalcones. These are a form of normal dihydrochalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.

External Descriptors

Not available

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