Compound Identification
SMILES
CC(=O)N[C@@H]([C@@H](O)CO)[C@@H](O)CC(=O)C(O)=O
InChIKey
InChIKey=PIBJMPNYGWNNOS-APQOSEDMSA-N
Formula
C9H15NO7
Mass
249.219
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Keto acids and derivatives
Subclass
Medium-chain keto acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Medium-chain keto acids and derivatives
Alternative Parents
Hydroxy fatty acids Amino fatty acids Beta-hydroxy ketones Alpha-keto acids and derivatives Alpha-hydroxy ketones Acetamides Secondary carboxylic acid amides Secondary alcohols Polyols Monocarboxylic acids and derivatives Carboxylic acids Primary alcohols Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic acyclic compounds
Substituents
Medium-chain keto acid - Amino fatty acid - Hydroxy fatty acid - Alpha-keto acid - Beta-hydroxy ketone - Fatty acyl - Alpha-hydroxy ketone - Acetamide - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Ketone - Carboxylic acid derivative - Carboxylic acid - Polyol - Monocarboxylic acid or derivatives - Alcohol - Primary alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as medium-chain keto acids and derivatives. These are keto acids with a 6 to 12 carbon atoms long side chain.
External Descriptors
Not available