Compound Identification
SMILES
[O-]C(=O)CC(=O)CC(=O)\C=C/C([O-])=O
InChIKey
InChIKey=GACSIVHAIFQKTC-UPHRSURJSA-L
Formula
C8H6O6
Mass
198.131
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
Beta-keto acids and derivatives Beta-diketones Unsaturated fatty acids Dicarboxylic acids and derivatives Enones Acryloyl compounds Ketones Carboxylic acids Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aliphatic acyclic compounds
Substituents
Medium-chain keto acid - Beta-keto acid - 1,3-diketone - Dicarboxylic acid or derivatives - Fatty acyl - 1,3-dicarbonyl compound - Unsaturated fatty acid - Acryloyl-group - Alpha,beta-unsaturated ketone - Enone - Ketone - Carboxylic acid derivative - Carboxylic acid - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organic anion - 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
CHEBI:17105 : oxo dicarboxylate