Compound Identification
SMILES
CCCCCC(=O)O[C@@H]1CC[C@H](OP([O-])(=O)OCC[N+](C)(C)C)[C@H]1OC(=O)CCCCC
InChIKey
InChIKey=YDWZHMDKWNAPFJ-DXIQSLLYSA-N
Formula
C22H42NO8P
Mass
479.551
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
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Class
Organonitrogen compounds
-
Subclass
Quaternary ammonium salts
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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
Fatty acid esters Dicarboxylic acids and derivatives Cyclitols and derivatives Alkyl phosphates Tetraalkylammonium salts Carboxylic acid esters Organopnictogen compounds Organic salts Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Phosphocholine - Fatty acid ester - Fatty acyl - Alkyl phosphate - Phosphoric acid ester - Organic phosphoric acid derivative - Dicarboxylic acid or derivatives - Cyclitol or derivatives - Tetraalkylammonium salt - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Amine - Aliphatic 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