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CHEBI:137309 - PE(20:0/22:5(4Z,7Z,10Z,13Z,16Z))

ChEBI IDCHEBI:137309
ChEBI NamePE(20:0/22:5(4Z,7Z,10Z,13Z,16Z))
Stars
ASCII NamePE(20:0/22:5(4Z,7Z,10Z,13Z,16Z))
Last Modified5 June 2017
Submittermwilliams
DownloadsMolfile
FormulaC47H84NO8P
Net Charge0
Average Mass822.162
Monoisotopic Mass821.59346
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCCCCCC)(COP(=O)(O)OCCN)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC
InChIInChI=1S/C47H84NO8P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-47(50)56-45(44-55-57(51,52)54-42-41-48)43-53-46(49)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,22,24,28,30,34,36,45H,3-10,12,14-16,18,20-21,23,25-27,29,31-33,35,37-44,48H2,1-2H3,(H,51,52)/b13-11-,19-17-,24-22-,30-28-,36-34-/t45-/m1/s1
InChIKeyHCNMKFZEQIRLQX-BYKGOJQSSA-N
ChEBI Ontology
Outgoing Relation(s)
PE(20:0/22:5(4Z,7Z,10Z,13Z,16Z)) (CHEBI:137309) is a phosphatidylethanolamine 42:5 zwitterion (CHEBI:71752)
Synonym  Source
1-eicosanoyl-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-glycero-3-phosphoethanolamineChEBI
Manual XrefsDatabases
HMDB0009241HMDB