Structure Information
Structure

Compound Identification

SMILES

CCCOC1=CC(OCCC)=C(C=CC(=O)C2=CC3=C(SC4=CC=CC=C4N3)C=C2)C=C1

InChIKey

InChIKey=BSXCEIFYZAJMOI-UHFFFAOYSA-N

Formula

C27H27NO3S

Mass

445.58

Export to:

JSON SDF CSV

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 - Phenothiazine - Cinnamic acid or derivatives - Diarylthioether - Benzothiazine - Phenol ether - Phenoxy compound - Aryl thioether - Styrene - Aryl ketone - Alkyl aryl ether - Para-thiazine - Primary aromatic amine - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Ketone - Azacycle - Organoheterocyclic compound - Thioether - Ether - Secondary amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - 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

Previous Back Next