Compound Identification
SMILES
C[N+](C)(C)CCOS([O-])(=O)=O
InChIKey
InChIKey=WXCQAWGXWVRCGP-UHFFFAOYSA-N
Formula
C5H13NO4S
Mass
183.22
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Organic sulfuric acids and derivatives
-
Subclass
Sulfuric acid esters
- Level 5 Sulfuric acid monoesters
-
Subclass
Sulfuric acid esters
-
Class
Organic sulfuric acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic sulfuric acids and derivatives
Subclass
Sulfuric acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Sulfuric acid monoesters
Alternative Parents
Alkyl sulfates Tetraalkylammonium salts Organopnictogen compounds Organooxygen compounds Organic salts Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aliphatic acyclic compounds
Substituents
Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Tetraalkylammonium salt - Quaternary ammonium salt - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organonitrogen compound - Amine - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as sulfuric acid monoesters. These are organic compounds containing the sulfuric acid monoester functional group, with the generic structure ROS(O)(=O)=O, (R=organyl group).
External Descriptors
CHEBI:16822 :
ammonium betaine - choline sulfates
META CYC (CPD-543) :
a small molecule