Compound Identification
SMILES
C[C@]1(CS(=O)(=O)C[C@H]1S(O)(=O)=O)NC(=O)CC[N+](C)(C)CCO
InChIKey
InChIKey=SZMYHYPYZPRCIX-ZYHUDNBSSA-O
Formula
C12H25N2O7S2
Mass
373.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
-
Subclass
Quaternary ammonium salts
- Level 5 Cholines
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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
Cholines
Alternative Parents
Thiolanes Tetraalkylammonium salts Sulfones Organosulfonic acids Alkanesulfonic acids Secondary carboxylic acid amides 1,2-aminoalcohols Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Choline - Sulfone - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Thiolane - Alkanesulfonic acid - Tetraalkylammonium salt - 1,2-aminoalcohol - Secondary carboxylic acid amide - Carboxamide group - Alkanolamine - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Amine - Carbonyl group - Primary alcohol - Alcohol - Organic cation - Aliphatic heteromonocyclic 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