Compound Identification
SMILES
CC[C@H](C)C(=O)O[C@H]1CCC=C2C=C[C@H](C)[C@H](\C=C\C(=O)C[C@@H](O)CC(O)=O)[C@@H]12
InChIKey
InChIKey=LLGSEXKROFVKFM-OZNPVROVSA-N
Formula
C23H32O6
Mass
404.503
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 b'-hydroxy-alpha,beta-unsaturated ketones Beta hydroxy acids and derivatives Hydroxy fatty acids Fatty acid esters Branched fatty acids Unsaturated fatty acids Beta-hydroxy ketones Dicarboxylic acids and derivatives Acryloyl compounds Enones Secondary alcohols Carboxylic acid esters Carboxylic acids Hydrocarbon derivatives Organic oxides
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Medium-chain hydroxy acid - Medium-chain fatty acid - Beta-hydroxy acid - Branched fatty acid - Fatty acid ester - Hydroxy fatty acid - B'-hydroxy-alpha,beta-unsaturated-ketone - Unsaturated fatty acid - Fatty acyl - Beta-hydroxy ketone - Dicarboxylic acid or derivatives - Acryloyl-group - Alpha,beta-unsaturated ketone - Enone - Secondary alcohol - Ketone - Carboxylic acid ester - Carboxylic acid derivative - Carboxylic acid - Carbonyl group - Alcohol - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic homopolycyclic 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