Compound Identification
SMILES
[Na+].C[C@H](O)[C@H](C)[C@@H]1O[C@H]1CC1CO[C@@H](C\C(C)=C\C(=O)OCCCCCCCCC([O-])=O)[C@H](O)[C@@H]1O
InChIKey
InChIKey=YTRXFKMKCQCAHC-FLRNHDKNSA-M
Formula
C26H43NaO9
Mass
522.611
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
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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
Medium-chain fatty acids
Alternative Parents
Hydroxy fatty acids Fatty acid esters Oxanes Monosaccharides Dicarboxylic acids and derivatives Enoate esters Secondary alcohols 1,2-diols Carboxylic acid salts Oxacyclic compounds Carboxylic acids Dialkyl ethers Epoxides Hydrocarbon derivatives Organic oxides Organic sodium salts Carbonyl compounds Organic zwitterions
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Medium-chain fatty acid - Fatty acid ester - Hydroxy fatty acid - Monosaccharide - Dicarboxylic acid or derivatives - Oxane - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid salt - Secondary alcohol - Carboxylic acid ester - 1,2-diol - Ether - Oxirane - Dialkyl ether - Organic alkali metal salt - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Organic zwitterion - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Carbonyl group - Alcohol - Aliphatic heteromonocyclic 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