Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-18 01:38:06 UTC
Update Date2024-04-30 19:51:01 UTC
Metabolite IDMMDBc0031534
Metabolite Identification
Common Name1-Acyl-sn-glycero-3-phosphoethanolamine (N-C16:0)
Description1-acyl-sn-glycero-3-phosphoethanolamine (n-c16:0) belongs to the class of Lysophosphatidylethanolamines. These are glycerophosphoetahnolamines (molecules containing an ethanolamine moiety attached to the phosphate group linked to a glycerol) with one saturated fatty acid bonded to the glycerol moiety through an ester linkage. (inferred from compound structure)
Structure
Synonyms
ValueSource
(2-Aminoethoxy)[3-(hexadecanoyloxy)-2-hydroxypropoxy]phosphinateGenerator
1-Palmitoyl-sn-glycerophosphoethanolamineMeSH
1-PPEMMeSH
1-Palmitoylphosphatidylethanolamine, (R)-isomerMeSH
3-Palmitoyl-DL-glycero-1-phosphorylethanolamineMeSH
N-PalmitoylphosphatidylethanolamineMeSH
1-PalmitoylphosphatidylethanolamineMeSH
1-Palmitoylphosphatidylethanolamine, (+-)-isomerMeSH
Molecular FormulaC21H44NO7P
Average Mass453.5503
Monoisotopic Mass453.285539279
IUPAC Name(2-aminoethoxy)[3-(hexadecanoyloxy)-2-hydroxypropoxy]phosphinic acid
Traditional Name2-aminoethoxy(3-(hexadecanoyloxy)-2-hydroxypropoxy)phosphinic acid
CAS Registry NumberNot Available
SMILES
CCCCCCCCCCCCCCCC(=O)OCC(O)COP(O)(=O)OCCN
InChI Identifier
InChI=1S/C21H44NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(24)27-18-20(23)19-29-30(25,26)28-17-16-22/h20,23H,2-19,22H2,1H3,(H,25,26)
InChI KeyYVYMBNSKXOXSKW-UHFFFAOYSA-N