Structure Information
Structure

Compound Identification

SMILES

CCCCOC1=CC=C(C=C1)C(=O)C(=CC1=CC=C(Br)C=C1)C1=NC2=CC=CC=C2O1

InChIKey

InChIKey=YVGABCPTUCGRLY-UHFFFAOYSA-N

Formula

C26H22BrNO3

Mass

476.37

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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

Retrochalcones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Retrochalcone - Cinnamic acid or derivatives - Benzoxazole - Phenoxy compound - Benzoyl - Phenol ether - Aryl ketone - Halobenzene - Alkyl aryl ether - Bromobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Alpha-branched alpha,beta-unsaturated-ketone - Benzenoid - Acryloyl-group - Alpha,beta-unsaturated ketone - Oxazole - Heteroaromatic compound - Azole - Enone - Ketone - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Organooxygen compound - Organic oxygen compound - Aldehyde - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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