CHEBI:180892 - PE-NMe2(24:0/22:4(7Z,10Z,13Z,16Z))

ChEBI IDCHEBI:180892
ChEBI NamePE-NMe2(24:0/22:4(7Z,10Z,13Z,16Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC53H98NO8P
Net Charge0
Average Mass908.340
Monoisotopic Mass907.70301
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN(C)C
InChIInChI=1S/C53H98NO8P/c1-5-7-9-11-13-15-17-19-21-23-25-26-28-29-31-33-35-37-39-41-43-45-52(55)59-49-51(50-61-63(57,58)60-48-47-54(3)4)62-53(56)46-44-42-40-38-36-34-32-30-27-24-22-20-18-16-14-12-10-8-6-2/h14,16,20,22,27,30,34,36,51H,5-13,15,17-19,21,23-26,28-29,31-33,35,37-50H2,1-4H3,(H,57,58)/b16-14-,22-20-,30-27-,36-34-
InChIKeyXTAZYFOSAVSFAQ-NWUDSAAZSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) MetaboLights (MTBLS2150)
ChEBI Ontology
Outgoing Relation(s)
PE-NMe2(24:0/22:4(7Z,10Z,13Z,16Z)) (CHEBI:180892) is a phosphatidylethanolamine (CHEBI:16038)
IUPAC Name 
[3-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyl]oxypropyl] tetracosanoate
Manual XrefsDatabases
74851414ChemSpider
HMDB0114627HMDB