Structure Information
Structure

Compound Identification

SMILES

C[C@@H](CS[C@@H](CCC1=CC=CC=C1C(C)=O)C1=CC=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=C1)C(O)=O

InChIKey

InChIKey=FVOPYCZWKWGZIS-YKSMYIBCSA-N

Formula

C32H30ClNO3S

Mass

544.11

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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 - Alkyl-phenylketone - Haloquinoline - Chloroquinoline - Quinoline - Acetophenone - Phenylketone - Benzoyl - Styrene - Aryl ketone - Aryl alkyl ketone - Aryl halide - Aryl chloride - Benzenoid - Pyridine - Monocyclic benzene moiety - Heteroaromatic compound - Ketone - Dialkylthioether - Sulfenyl compound - Thioether - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - 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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