Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C\C(C(=O)C2=CC=C(OC)C=C2)=C(/C(O)=O)C2=CC3=NSN=C3C=C2)S1

InChIKey

InChIKey=DKJNAAUUFQGFKC-HEHNFIMWSA-N

Formula

C23H18N2O5S2

Mass

466.53

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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 - Butyrophenone - 2,1,3-benzothiadiazole - Benzoyl - Phenoxy compound - Phenol ether - Anisole - Aryl ketone - Methoxybenzene - Alkyl aryl ether - 2,5-disubstituted thiophene - Alpha-branched alpha,beta-unsaturated-ketone - Benzenoid - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Enone - Alpha,beta-unsaturated ketone - Acryloyl-group - Thiadiazole - Thiophene - Ketone - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Azacycle - Ether - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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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