Compound Identification
SMILES
[Na+].CCCCCCCCCCCC\C=C/[C@@H](SC[C@H](N)C([O-])=O)[C@@H](O)CCC(O)=O
InChIKey
InChIKey=BHDGEQSUVQERJW-OVEHQGONSA-M
Formula
C22H40NNaO5S
Mass
453.61
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
L-cysteine-S-conjugates L-alpha-amino acids Thia fatty acids Hydroxy fatty acids Unsaturated fatty acids Dicarboxylic acids and derivatives Amino acids Secondary alcohols Carboxylic acid salts Sulfenyl compounds Carboxylic acids Dialkylthioethers Organic sodium salts Organic zwitterions Carbonyl compounds Hydrocarbon derivatives Organic oxides Monoalkylamines
Molecular Framework
Aliphatic acyclic compounds
Substituents
Long-chain fatty acid - L-cysteine-s-conjugate - Cysteine or derivatives - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - Hydroxy fatty acid - Thia fatty acid - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Amino acid or derivatives - Amino acid - Carboxylic acid salt - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Organic alkali metal salt - Dialkylthioether - Thioether - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic salt - Organic sodium salt - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Carbonyl group - Organosulfur compound - Primary amine - Organic oxygen compound - Organic zwitterion - Amine - Organic oxide - 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