Compound Identification
SMILES
CCCCCCCCCCCCCCC(=O)OCC[N+](C)(CCO)CCCCCC[N+](C)(CCO)CCOC(=O)CCCCCCCCCCCCCC
InChIKey
InChIKey=JJETUAHSDUNHHF-UHFFFAOYSA-N
Formula
C46H94N2O6
Mass
771.265
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
-
Subclass
Quaternary ammonium salts
- Level 5 Hexamethonium compounds
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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
Hexamethonium compounds
Alternative Parents
Acyl cholines Fatty acid esters Dicarboxylic acids and derivatives Tetraalkylammonium salts Carboxylic acid esters 1,2-aminoalcohols Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aliphatic acyclic compounds
Substituents
Hexamethonium - Acyl choline - Choline - Fatty acid ester - Fatty acyl - Dicarboxylic acid or derivatives - Tetraalkylammonium salt - 1,2-aminoalcohol - Carboxylic acid ester - Alkanolamine - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Primary alcohol - Carbonyl group - Amine - Hydrocarbon derivative - Alcohol - Organic cation - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as hexamethonium compounds. These are organic compounds containing a N,N,N,N',N',N'-hexamethylhexane-1,6-diaminium moiety.
External Descriptors
Not available