Compound Identification
SMILES
[NH4+].[NH4+].CCCCCCCCCCCCOC(=O)C(CC([O-])=O)S([O-])(=O)=O
InChIKey
InChIKey=JEHRUGGEKCUXBY-UHFFFAOYSA-N
Formula
C16H36N2O7S
Mass
400.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Thia 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
Thia fatty acids
Alternative Parents
Fatty acid esters Dicarboxylic acids and derivatives Sulfonyls Quaternary ammonium salts Organosulfonic acids Alkanesulfonic acids Carboxylic acid salts Carboxylic acid esters Carboxylic acids Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines Organic cations
Molecular Framework
Aliphatic acyclic compounds
Substituents
Fatty acid ester - Thia fatty acid - Dicarboxylic acid or derivatives - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Carboxylic acid ester - Carboxylic acid salt - Carboxylic acid derivative - Carboxylic acid - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic salt - Organic cation - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as thia fatty acids. These are fatty acid derivatives obtained by insertion of a sulfur atom at specific positions in the chain.
External Descriptors
Not available