Compound Identification
SMILES
[Na+].[O-]C(=O)CCCCC1CCSC(S1)C1=CC=NC=C1
InChIKey
InChIKey=WQPAPYLUZIXQIL-UHFFFAOYSA-M
Formula
C14H18NNaO2S2
Mass
319.41
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
Thia fatty acids Pyridines and derivatives Dithianes Heteroaromatic compounds Dithioacetals Carboxylic acid salts Azacyclic compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organic sodium salts Organic zwitterions Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Medium-chain fatty acid - Thia fatty acid - 1,3-dithiane - Pyridine - Thioacetal - Heteroaromatic compound - Carboxylic acid salt - Organic alkali metal salt - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkylthioether - Carboxylic acid - Thioether - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - Organic salt - Organic sodium salt - Aromatic 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