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CHEBI:179094 - PE(12:0/22:2(13Z,16Z))

ChEBI IDCHEBI:179094
ChEBI NamePE(12:0/22:2(13Z,16Z))
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FormulaC39H74NO8P
Net Charge0
Average Mass715.994
Monoisotopic Mass715.51520
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C39H74NO8P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-12-10-8-6-4-2/h11,13,15-16,37H,3-10,12,14,17-36,40H2,1-2H3,(H,43,44)/b13-11-,16-15-/t37-/m1/s1
InChIKeyRPFLIISVDLXAHU-KQVASOIBSA-N
ChEBI Ontology
Outgoing Relation(s)
PE(12:0/22:2(13Z,16Z)) (CHEBI:179094) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-dodecanoyloxypropan-2-yl] (13Z,16Z)-docosa-13,16-dienoate
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