Structure Information
Structure

Compound Identification

SMILES

CCCCC1=CC=C(N[C@@H](CC(=O)C2=CC=C(OC)C=C2)C2=CC=C(Br)C=C2)C=C1

InChIKey

InChIKey=QWZFVQQWZZPKGK-VWLOTQADSA-N

Formula

C26H28BrNO2

Mass

466.419

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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 homomonocyclic compounds

Substituents

Retro-dihydrochalcone - Alkyl-phenylketone - Butyrophenone - Phenylketone - Anisole - Benzoyl - Phenol ether - Phenoxy compound - Aryl ketone - Aryl alkyl ketone - Aniline or substituted anilines - Phenylalkylamine - Methoxybenzene - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Aralkylamine - Bromobenzene - Halobenzene - Benzenoid - Beta-aminoketone - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Ketone - Secondary amine - Ether - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxide - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic homomonocyclic 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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