Compound Identification
SMILES
COS([O-])(=O)=O.COS([O-])(=O)=O.CCCCCCCCCCCCCCC(=O)OCC[N+](C)(CCO)CCCCCC[N+](C)(CCO)CCOC(=O)CCCCCCCCCCCCCC
InChIKey
InChIKey=LFILNDFHNNAYKG-UHFFFAOYSA-L
Formula
C48H100N2O14S2
Mass
993.45
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
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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 Sulfuric acid monoesters Dicarboxylic acids and derivatives Alkyl sulfates Tetraalkylammonium salts Carboxylic acid esters 1,2-aminoalcohols Primary alcohols Organic zwitterions Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Hexamethonium - Acyl choline - Choline - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Tetraalkylammonium salt - Organic sulfuric acid or derivatives - 1,2-aminoalcohol - Carboxylic acid ester - Carboxylic acid derivative - Alkanolamine - Organic oxygen compound - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Carbonyl group - Amine - Alcohol - Organooxygen compound - Primary alcohol - 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