Compound Identification
SMILES
CCCCCCCCCCCCCCCCCCN(CCC(O)OP(O)(=O)OCC[N+](C)(C)C)C(=O)OCC1=CC=CC=C1
InChIKey
InChIKey=JMRJISYDWVBGPO-UHFFFAOYSA-O
Formula
C34H64N2O7P
Mass
643.866
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
-
Subclass
Quaternary ammonium salts
-
Level 5
Cholines
- Level 6 Phosphocholines
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Level 5
Cholines
-
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
Cholines
Direct Parent
Phosphocholines
Alternative Parents
Benzyloxycarbonyls Dialkyl phosphates Tetraalkylammonium salts Carbamate esters Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phosphocholine - Benzyloxycarbonyl - Dialkyl phosphate - Monocyclic benzene moiety - Organic phosphoric acid derivative - Phosphoric acid ester - Benzenoid - Alkyl phosphate - Tetraalkylammonium salt - Carbamic acid ester - Hydrocarbon derivative - Organooxygen compound - Amine - Carbonyl group - Organic oxide - Organic oxygen compound - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phosphocholines. These are compounds containing a [2-(trimethylazaniumyl)ethoxy]phosphonic acid or derivative.
External Descriptors
Not available