Structure Information
Structure

Compound Identification

SMILES

CC(C)C1=CC=C(C=CC(=O)C2=CC=C(OS(=O)(=O)C3=C(C)C=C(C)C=C3C)C=C2)C=C1

InChIKey

InChIKey=PWOSTUOCBMDMHG-UHFFFAOYSA-N

Formula

C27H28O4S

Mass

448.58

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 homomonocyclic compounds

Substituents

Retrochalcone - Cinnamic acid or derivatives - Benzenesulfonate ester - P-methylbenzenesulfonate - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Cumene - Phenylpropane - Phenoxy compound - Benzoyl - Aryl ketone - Styrene - Benzenoid - Monocyclic benzene moiety - Organosulfonic acid ester - Sulfonyl - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Ketone - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic 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