Compound Identification
SMILES
CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(Cl)=C)CC(O)=O
InChIKey
InChIKey=BCSFKZIATNWEEL-DOADOZAASA-N
Formula
C21H36ClNO5
Mass
417.97
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Medium-chain fatty acids
-
Subclass
Fatty acids and conjugates
-
Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Fatty acids and conjugates
Intermediate Tree Nodes
Not available
Direct Parent
Medium-chain fatty acids
Alternative Parents
Branched fatty acids Halogenated fatty acids Hydroxy fatty acids Unsaturated fatty acids N-acyl amines 1,2-diols Secondary carboxylic acid amides Secondary alcohols Vinyl chlorides Carboxylic acids Chloroalkenes Monocarboxylic acids and derivatives Carbonyl compounds Organochlorides Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Medium-chain fatty acid - Branched fatty acid - Halogenated fatty acid - Hydroxy fatty acid - Fatty amide - N-acyl-amine - Unsaturated fatty acid - 1,2-diol - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Chloroalkene - Haloalkene - Monocarboxylic acid or derivatives - Vinyl halide - Vinyl chloride - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.
External Descriptors
Not available