Structure Information
Structure

Compound Identification

SMILES

CC(=O)SC(CCC1=CC=CC=C1)C(O)=O

InChIKey

InChIKey=WJCOAFCBELUOIH-UHFFFAOYSA-N

Formula

C12H14O3S

Mass

238.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acids and conjugates

Intermediate Tree Nodes

Not available

Direct Parent

Thia fatty acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Thia fatty acid - Monocyclic benzene moiety - Benzenoid - Carbothioic s-ester - Thiocarboxylic acid ester - Sulfenyl compound - Thiocarboxylic acid or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as thia fatty acids. These are fatty acid derivatives obtained by insertion of a sulfur atom at specific positions in the chain.

External Descriptors

Not available

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