Compound Identification
SMILES
[Na+].CCCCCCCCCCCCCCC(O)CC(CC([O-])=O)NC(=O)CO
InChIKey
InChIKey=JKTTVYOGYWYYDA-UHFFFAOYSA-M
Formula
C21H40NNaO5
Mass
409.543
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Long-chain fatty acids
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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
Long-chain fatty acids
Alternative Parents
Beta amino acids and derivatives Hydroxy fatty acids Secondary carboxylic acid amides Secondary alcohols Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Primary alcohols Organonitrogen compounds Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Long-chain fatty acid - Beta amino acid or derivatives - Hydroxy fatty acid - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid derivative - Organic alkali metal salt - Carboxylic acid - Monocarboxylic acid or derivatives - Alcohol - Organooxygen compound - Organonitrogen compound - Primary alcohol - Organic zwitterion - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms.
External Descriptors
Not available