Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=CC(C=CC(=O)C2=C3C=CC=C4C5=NC6=CC=CC=C6N5C(=O)C(C=C2)=C34)=C1

InChIKey

InChIKey=BEMKGTSYLVHLJP-UHFFFAOYSA-N

Formula

C27H15N3O4

Mass

445.434

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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 - Isoquinolone - Naphthalene - Isoquinoline - Nitrobenzene - Imidazo[1,2-a]pyridine - Benzimidazole - Aryl ketone - Nitroaromatic compound - Styrene - Pyridinone - N-substituted imidazole - Benzenoid - Pyridine - Monocyclic benzene moiety - Enone - Imidazole - Alpha,beta-unsaturated ketone - Azole - Acryloyl-group - Heteroaromatic compound - Organic nitro compound - Ketone - Lactam - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Organic oxoazanium - Organic oxide - Organic oxygen compound - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - Organonitrogen compound - Organooxygen 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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