Compound Identification
SMILES
[Cl-].CCCCCCCCCCCCCCCC(=O)C[N+](CC)(CCO)C(=O)CCCCCCCCCCCCCCC
InChIKey
InChIKey=UGASZZARFOADIF-UHFFFAOYSA-M
Formula
C37H74ClNO3
Mass
616.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
-
Subclass
Quaternary ammonium salts
- Level 5 Cholines
-
Subclass
Quaternary ammonium salts
-
Class
Organonitrogen compounds
-
Superclass
Organic nitrogen compounds
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Quaternary ammonium salts
Intermediate Tree Nodes
Not available
Direct Parent
Cholines
Alternative Parents
Ketones Carboxylic acids and derivatives Alkanolamines Primary alcohols Organic zwitterions Organic oxides Organic chloride salts Hydrocarbon derivatives
Molecular Framework
Aliphatic acyclic compounds
Substituents
Choline - Ketone - Carboxylic acid derivative - Alkanolamine - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organic zwitterion - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as cholines. These are organic compounds containing a N,N,N-trimethylethanolammonium cation.
External Descriptors
Not available