Compound Identification
SMILES
CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NCCCCCCCCCCCOC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(C)=O
InChIKey
InChIKey=YAPFSBLBPKYOIX-GDLZYMKVSA-N
Formula
C33H56N3O9PS
Mass
701.86
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Glycerophospholipids
- Subclass Glycerophosphocholines
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Class
Glycerophospholipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Glycerophospholipids
Subclass
Glycerophosphocholines
Intermediate Tree Nodes
1-alkyl,2-acylglycero-3-phosphocholines
Direct Parent
1-alkyl,2-acetylglycero-3-phosphocholines
Alternative Parents
1-naphthalene sulfonamides 1-naphthalene sulfonic acids and derivatives Phosphocholines Dialkylarylamines Glycerol ethers Dialkyl phosphates Organosulfonamides Tetraalkylammonium salts Aminosulfonyl compounds Amino acids and derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Dialkyl ethers Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
1-alkyl,2-acetylglycero-3-phosphocholine - 1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - Naphthalene sulfonic acid or derivatives - Phosphocholine - Naphthalene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Glycerol ether - Dialkyl phosphate - Organic phosphoric acid derivative - Phosphoric acid ester - Organosulfonic acid amide - Alkyl phosphate - Benzenoid - Tetraalkylammonium salt - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Quaternary ammonium salt - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Carbonyl group - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-alkyl,2-acetylglycero-3-phosphocholines. These are glycerophosphocholines that carry exactly one acetyl chain attached to the glycerol moiety through an ester linkage at the O2-position, and one alkyl chain attached through an ether linkage at the O1-position.
External Descriptors
Not available