Compound Identification
SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC(COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCNC(=O)CC1=C(C)N(C(=O)C2=CC=C(Cl)C=C2)C2=C1C=C(OC)C=C2
InChIKey
InChIKey=LJFRRCUULHFARV-UHFFFAOYSA-N
Formula
C51H79ClN3O11P
Mass
976.63
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
Benzoylindoles Indolecarboxylic acids and derivatives Phosphocholines 4-halobenzoic acids and derivatives 3-alkylindoles Anisoles Benzoyl derivatives Alkyl aryl ethers Fatty acid esters Dialkyl phosphates Chlorobenzenes Substituted pyrroles Aryl chlorides Dicarboxylic acids and derivatives Tetraalkylammonium salts Heteroaromatic compounds Carboxylic acid esters Secondary carboxylic acid amides Azacyclic compounds Organochlorides Hydrocarbon derivatives Organic oxides Amines Organic salts Organic zwitterions Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diacylglycero-3-phosphocholine - Benzoylindole - Indolecarboxylic acid derivative - Phosphocholine - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - Benzoic acid or derivatives - Benzoyl - Anisole - Phenol ether - Fatty acid ester - Halobenzene - Alkyl aryl ether - Dialkyl phosphate - Chlorobenzene - Aryl chloride - Aryl halide - Organic phosphoric acid derivative - Monocyclic benzene moiety - Substituted pyrrole - Alkyl phosphate - Benzenoid - Phosphoric acid ester - Fatty acyl - Dicarboxylic acid or derivatives - Heteroaromatic compound - Pyrrole - Quaternary ammonium salt - Tetraalkylammonium salt - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Ether - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organohalogen compound - Amine - Organic nitrogen compound - Carbonyl group - Organic zwitterion - Organic salt - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Aromatic heteropolycyclic 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