Compound Identification
SMILES
COC(=O)CCCCCCCC(O)C=CC(O)=O
InChIKey
InChIKey=DRBDRRDKWBXSMR-UHFFFAOYSA-N
Formula
C13H22O5
Mass
258.314
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 Fatty acid methyl esters Unsaturated fatty acids Dicarboxylic acids and derivatives Methyl esters Secondary alcohols Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Medium-chain hydroxy acid - Medium-chain fatty acid - Fatty acid ester - Fatty acid methyl ester - Hydroxy fatty acid - Dicarboxylic acid or derivatives - Fatty acyl - Unsaturated fatty acid - Methyl ester - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Organic oxide - Organic oxygen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - 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