Structure Information
Structure

Compound Identification

SMILES

COC1=C(F)C=C(C\C(C(=O)C2=CC=C(OC(C)C)C=C2)=C(/C(O)=O)C2=CC3=NSN=C3C=C2)C=C1

InChIKey

InChIKey=ZLQNICVDHLLBOA-LKUDQCMESA-N

Formula

C27H23FN2O5S

Mass

506.55

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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 heteropolycyclic compounds

Substituents

Retrochalcone - Retro-dihydrochalcone - Cinnamic acid or derivatives - Butyrophenone - 2,1,3-benzothiadiazole - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Benzoyl - Aryl ketone - Alkyl aryl ether - Halobenzene - Fluorobenzene - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Acryloyl-group - Azole - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Thiadiazole - Enone - Ketone - Monocarboxylic acid or derivatives - Ether - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Organohalogen compound - Organofluoride - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic 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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