Structure Information
Structure

Compound Identification

SMILES

CSCCC(NC(=O)C1=C(C=C(CNC(CC2=CC=CC=C2)CC2=CC=CC=C2)C=C1)C1=CC=CC=C1C)C(O)=O

InChIKey

InChIKey=CIINYIZKZAYUTF-UHFFFAOYSA-N

Formula

C35H38N2O3S

Mass

566.76

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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 homomonocyclic compounds

Substituents

Linear 1,3-diarylpropanoid - Methionine or derivatives - Hippuric acid or derivatives - Hippuric acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Biphenyl - Alpha-amino acid or derivatives - Amphetamine or derivatives - Benzoic acid or derivatives - Benzamide - Benzylamine - Benzoyl - Phenylmethylamine - Thia fatty acid - Aralkylamine - Toluene - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Amino acid or derivatives - Dialkylthioether - Sulfenyl compound - Thioether - Secondary amine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Organonitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Amine - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Aromatic homomonocyclic 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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