Compound Identification
SMILES
CCCCOP(O)([O-])=O.CCCCCCCCCCCCC[N+](C)(C)CCO
InChIKey
InChIKey=ZFKUPTNMPDPLHN-UHFFFAOYSA-M
Formula
C21H48NO5P
Mass
425.591
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
Alkyl phosphates Tetraalkylammonium salts 1,2-aminoalcohols Primary alcohols Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Choline - Organic phosphoric acid derivative - Alkyl phosphate - Phosphoric acid ester - Tetraalkylammonium salt - 1,2-aminoalcohol - Alkanolamine - Organic oxygen compound - Primary alcohol - Organooxygen compound - Organic zwitterion - Hydrocarbon derivative - Amine - Organic oxide - 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