Structure Information
Structure

Compound Identification

SMILES

OC(=O)CCCCC1CCSS1

InChIKey

InChIKey=AGBQKNBQESQNJD-UHFFFAOYSA-N

Formula

C8H14O2S2

Mass

206.32

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Dithiolanes

Subclass

Lipoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Lipoic acids and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

Lipoic_acid_derivative - Medium-chain fatty acid - Heterocyclic fatty acid - Thia fatty acid - Fatty acyl - Fatty acid - 1,2-dithiolane - Organic disulfide - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as lipoic acids and derivatives. These are compounds containing a lipoic acid moiety (or a derivative thereof), which consists of a pentanoic acid (or derivative) attached to the C3 carbon atom of a 1,2-dithiolane ring.

External Descriptors

CHEBI:16494 : dithiolanes - thia fatty acid - heterocyclic fatty acid
KEGG (C00725) : Prosthetic group [Fig]

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