Compound Identification
SMILES
CC[C@H](N1CCCC1=O)C(=O)NC(=O)OC(C)OC(=O)CCCC[C@]1(C)CCSS1
InChIKey
InChIKey=WSFNTERDPAMWAQ-VSUHRXMYSA-N
Formula
C20H32N2O6S2
Mass
460.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Dithiolanes
- Subclass Lipoic acids and derivatives
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Class
Dithiolanes
-
Superclass
Organoheterocyclic compounds
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
Alpha amino acids and derivatives Fatty acid esters Pyrrolidine-2-ones N-alkylpyrrolidines N-acyl amines Tertiary carboxylic acid amides 1,2-dithiolanes Dicarboximides Carbamate esters Organic disulfides Lactams Carboxylic acid esters Acetals Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Lipoic_acid_derivative - Alpha-amino acid or derivatives - Fatty acid ester - N-acyl-amine - Pyrrolidone - 2-pyrrolidone - Fatty acyl - N-alkylpyrrolidine - Dicarboximide - Pyrrolidine - Tertiary carboxylic acid amide - Carbamic acid ester - 1,2-dithiolane - Carboxamide group - Organic disulfide - Carboxylic acid ester - Lactam - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Acetal - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - 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
Not available