Compound Identification
SMILES
CCC#C[C@H](C(C)=O)C(O)=O
InChIKey
InChIKey=RXGYUTVRJQGCJI-SSDOTTSWSA-N
Formula
C8H10O3
Mass
154.165
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
Branched fatty acids Beta-keto acids and derivatives Unsaturated fatty acids Beta-hydroxy ketones 1,3-dicarbonyl compounds Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic acyclic compounds
Substituents
Medium-chain keto acid - Beta-keto acid - Branched fatty acid - Beta-hydroxy ketone - Unsaturated fatty acid - 1,3-dicarbonyl compound - Fatty acyl - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic oxide - 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