Structure Information
Structure

Compound Identification

SMILES

OC(=O)CCC(CC(S)C1=CC=CC=C1)C(O)=O

InChIKey

InChIKey=CCYMZXAGFYPCLX-UHFFFAOYSA-N

Formula

C13H16O4S

Mass

268.33

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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

Medium-chain fatty acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Medium-chain fatty acid - Branched fatty acid - Thia fatty acid - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Alkylthiol - Carboxylic acid derivative - Carboxylic acid - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.

External Descriptors

Not available

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