Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H](SC(C)=O)[C@H](C)O

InChIKey

InChIKey=GNVDYVMVWHSGGY-NJGYIYPDSA-N

Formula

C7H12O4S

Mass

192.23

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Hydroxy acids and derivatives

Subclass

Beta hydroxy acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Beta hydroxy acids and derivatives

Alternative Parents

Molecular Framework

Aliphatic acyclic compounds

Substituents

Beta-hydroxy acid - Fatty acid ester - Fatty acyl - Methyl ester - Carboxylic acid ester - Secondary alcohol - Thiocarboxylic acid ester - Carbothioic s-ester - Thiocarboxylic acid or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organic oxide - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as beta hydroxy acids and derivatives. These are compounds containing a carboxylic acid substituted with a hydroxyl group on the C3 carbon atom.

External Descriptors

Not available

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