Compound Identification
SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC[N+](C)(C)C)OC(=O)CCCCCNC(=O)CC1=CC=CC=C1NC1=C(Cl)C=CC=C1Cl
InChIKey
InChIKey=PWRRWKWKVIROBL-UHFFFAOYSA-O
Formula
C46H75Cl2N3O9P
Mass
915.99
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 Phenylacetamides Aniline and substituted anilines Dichlorobenzenes Dialkyl phosphates Fatty acid esters Aryl chlorides Primary aromatic amines Dicarboxylic acids and derivatives Tetraalkylammonium salts Amino acids and derivatives Secondary carboxylic acid amides Carboxylic acid esters Secondary amines Organochlorides Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Diacylglycero-3-phosphocholine - Phosphocholine - Phenylacetamide - 1,3-dichlorobenzene - Aniline or substituted anilines - Chlorobenzene - Choline - Fatty acid ester - Halobenzene - Dialkyl phosphate - Alkyl phosphate - Fatty acyl - Benzenoid - Primary aromatic amine - Aryl halide - Monocyclic benzene moiety - Phosphoric acid ester - Dicarboxylic acid or derivatives - Aryl chloride - Organic phosphoric acid derivative - Tetraalkylammonium salt - Quaternary ammonium salt - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Amino acid or derivatives - Secondary amine - Carboxylic acid derivative - Organic nitrogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organohalogen compound - Organochloride - Organic cation - Aromatic homomonocyclic 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
Not available