Compound Identification
SMILES
CC1(C)CC(CC(C)(C)[NH+]1[O-])[N+](C)(C)CCO
InChIKey
InChIKey=UALDNNNTDSYFFQ-UHFFFAOYSA-N
Formula
C13H29N2O2
Mass
245.386
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
Aminopiperidines Tetraalkylammonium salts Disubstituted amine oxides and derivatives 1,2-aminoalcohols Azacyclic compounds Primary alcohols Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
4-aminopiperidine - Choline - Piperidine - Tetraalkylammonium salt - 1,2-aminoalcohol - Disubstituted n-oxide - Alkanolamine - N-oxide - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Alcohol - Primary alcohol - Organooxygen compound - Organic salt - Amine - Hydrocarbon derivative - Organic oxide - 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