Compound Identification
SMILES
OC(CC(=CC(I)=O)C=C(I)C(O)=O)C(O)=O
InChIKey
InChIKey=BLSISMGSPYVAPK-UHFFFAOYSA-N
Formula
C9H8I2O6
Mass
465.966
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Hydroxy acids and derivatives
Subclass
Medium-chain hydroxy acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Medium-chain hydroxy acids and derivatives
Alternative Parents
Medium-chain fatty acids Hydroxy fatty acids Halogenated fatty acids Branched fatty acids Unsaturated fatty acids Alpha hydroxy acids and derivatives Dicarboxylic acids and derivatives Alpha-halocarboxylic acids Secondary alcohols Vinyl iodides Acyl iodides Iodoalkenes Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organoiodides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Medium-chain hydroxy acid - Medium-chain fatty acid - Branched fatty acid - Halogenated fatty acid - Hydroxy fatty acid - Fatty acyl - Fatty acid - Alpha-hydroxy acid - Unsaturated fatty acid - Dicarboxylic acid or derivatives - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Secondary alcohol - Iodoalkene - Haloalkene - Vinyl iodide - Vinyl halide - Acyl iodide - Acyl halide - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Organic oxide - Organohalogen compound - Organoiodide - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as medium-chain hydroxy acids and derivatives. These are hydroxy acids with a 6 to 12 carbon atoms long side chain.
External Descriptors
Not available