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CHEBI:179086 - PE(22:2(13Z,16Z)/12:0)

ChEBI IDCHEBI:179086
ChEBI NamePE(22:2(13Z,16Z)/12:0)
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FormulaC39H74NO8P
Net Charge0
Average Mass715.994
Monoisotopic Mass715.51520
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCC
InChIInChI=1S/C39H74NO8P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-24-25-27-29-31-38(41)45-35-37(36-47-49(43,44)46-34-33-40)48-39(42)32-30-28-26-23-12-10-8-6-4-2/h11,13,15-16,37H,3-10,12,14,17-36,40H2,1-2H3,(H,43,44)/b13-11-,16-15-/t37-/m1/s1
InChIKeyQTOKXCZIKCAIQA-KQVASOIBSA-N
ChEBI Ontology
Outgoing Relation(s)
PE(22:2(13Z,16Z)/12:0) (CHEBI:179086) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-dodecanoyloxypropyl] (13Z,16Z)-docosa-13,16-dienoate
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