Compound Identification
SMILES
CCCCCCCCCCCCCCCC(=O)OCC(COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC1OC1CCCCC
InChIKey
InChIKey=HZKBHRZARZUXPO-UHFFFAOYSA-N
Formula
C42H80NO9P
Mass
774.074
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Glycerophospholipids
-
Subclass
Glycerophosphocholines
- Level 5 Phosphatidylcholines
-
Subclass
Glycerophosphocholines
-
Class
Glycerophospholipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Glycerophospholipids
Subclass
Glycerophosphocholines
Intermediate Tree Nodes
Not available
Direct Parent
Phosphatidylcholines
Alternative Parents
Phosphocholines Fatty acid esters Dialkyl phosphates Dicarboxylic acids and derivatives Tetraalkylammonium salts Carboxylic acid esters Oxacyclic compounds Epoxides Dialkyl ethers Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines Organic cations
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Diacylglycero-3-phosphocholine - Phosphocholine - Fatty acid ester - Dialkyl phosphate - Dicarboxylic acid or derivatives - Organic phosphoric acid derivative - Phosphoric acid ester - Fatty acyl - Alkyl phosphate - Tetraalkylammonium salt - Quaternary ammonium salt - Carboxylic acid ester - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Organic salt - Organic cation - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phosphatidylcholines. These are glycerophosphocholines in which the two free -OH are attached to one fatty acid each through an ester linkage.
External Descriptors
META CYC (CPD-12644) : a phosphatidylcholine