Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@@H]1CC[C@@H](C)C2=C(N(N=C12)C(=O)[C@@H](CC1=CC=CC=C1)[C@@H](NS(=O)(=O)C1=CC=C(C)C=C1)C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=PYRYKFBWIMIZDH-DFNPXYMUSA-N

Formula

C40H43N3O3S

Mass

645.86

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Linear 1,3-diarylpropanoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Linear 1,3-diarylpropanoid - P-toluenesulfonamide - Beta amino acid or derivatives - Phenylpyrazole - Benzenesulfonamide - Tosyl compound - Benzenesulfonyl group - Toluene - Monocyclic benzene moiety - Organosulfonic acid amide - Benzenoid - Azole - Pyrazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Aminosulfonyl compound - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.

External Descriptors

Not available

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