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CHEBI:188138 - PE(O-16:0/20:5(5Z,8Z,11Z,14Z,17Z))

ChEBI IDCHEBI:188138
ChEBI NamePE(O-16:0/20:5(5Z,8Z,11Z,14Z,17Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H74NO7P
Net Charge0
Average Mass724.017
Monoisotopic Mass723.52029
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C41H74NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-41(43)49-40(39-48-50(44,45)47-37-35-42)38-46-36-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,26,28,40H,3-4,6,8-10,12,14-16,18,20,23-25,27,29-39,42H2,1-2H3,(H,44,45)/b7-5-,13-11-,19-17-,22-21-,28-26-/t40-/m1/s1
InChIKeyNTBDNAWCQLUDHG-CEGBOXLASA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
ChEBI Ontology
Outgoing Relation(s)
PE(O-16:0/20:5(5Z,8Z,11Z,14Z,17Z)) (CHEBI:188138) is a alkylacylglycerophosphoethanolamine (CHEBI:52578)
IUPAC Name 
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-hexadecoxypropan-2-yl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
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