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CHEBI:179036 - PE(17:2(9Z,12Z)/20:0)

ChEBI IDCHEBI:179036
ChEBI NamePE(17:2(9Z,12Z)/20:0)
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FormulaC42H80NO8P
Net Charge0
Average Mass758.075
Monoisotopic Mass757.56216
SMILESCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C42H80NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43)38-48-41(44)34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h10,12,16,18,40H,3-9,11,13-15,17,19-39,43H2,1-2H3,(H,46,47)/b12-10-,18-16-/t40-/m1/s1
InChIKeyRQTQHKBDEPCSDD-WTUORFMBSA-N
ChEBI Ontology
Outgoing Relation(s)
PE(17:2(9Z,12Z)/20:0) (CHEBI:179036) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxypropan-2-yl] icosanoate
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