Compound Identification
SMILES
OC(=O)C(=O)CC(=CC(I)=O)C=C(I)C(O)=O
InChIKey
InChIKey=NJKVVEHBAJIVON-UHFFFAOYSA-N
Formula
C9H6I2O6
Mass
463.95
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
Halogenated fatty acids Branched fatty acids Unsaturated fatty acids Dicarboxylic acids and derivatives Alpha-keto acids and derivatives Alpha-hydroxy ketones Alpha-halocarboxylic acids Vinyl iodides Iodoalkenes Carboxylic acids Acyl iodides Organoiodides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic acyclic compounds
Substituents
Medium-chain keto acid - Branched fatty acid - Halogenated fatty acid - Alpha-keto acid - Fatty acyl - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Alpha-hydroxy ketone - Ketone - Acyl halide - Vinyl halide - Vinyl iodide - Carboxylic acid - Carboxylic acid derivative - Haloalkene - Iodoalkene - Acyl iodide - Organohalogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organoiodide - 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