CHEBI:191102 - Pe(16:0e/12-hete)

ChEBI IDCHEBI:191102
ChEBI NamePe(16:0e/12-hete)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H76NO8P
Net Charge0
Average Mass742.032
Monoisotopic Mass741.53086
SMILESCCCCC/C=C\CC(O)/C=C/C=C\C/C=C\CCCC(=O)OC(COCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C41H76NO8P/c1-3-5-7-9-11-12-13-14-15-16-19-22-26-30-35-47-37-40(38-49-51(45,46)48-36-34-42)50-41(44)33-29-25-21-18-17-20-24-28-32-39(43)31-27-23-10-8-6-4-2/h18,20-21,23-24,27-28,32,39-40,43H,3-17,19,22,25-26,29-31,33-38,42H2,1-2H3,(H,45,46)/b21-18-,24-20-,27-23-,32-28+
InChIKeySTAPRPTUZGZBLD-QQGSTFQISA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) INS-1 cell (BTO:0002135) MetaboLights (MTBLS3963)
ChEBI Ontology
Outgoing Relation(s)
Pe(16:0e/12-hete) (CHEBI:191102) is a alkylacylglycerophosphoethanolamine (CHEBI:52578)
IUPAC Name 
[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-hexadecoxypropan-2-yl] (5Z,8Z,10E,14Z)-12-hydroxyicosa-5,8,10,14-tetraenoate