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CHEBI:196810 - PE(21:0/14:1(9Z))

ChEBI IDCHEBI:196810
ChEBI NamePE(21:0/14:1(9Z))
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FormulaC40H78NO8P
Net Charge0
Average Mass732.037
Monoisotopic Mass731.54651
SMILESCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C40H78NO8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41)49-40(43)33-31-29-27-25-22-14-12-10-8-6-4-2/h10,12,38H,3-9,11,13-37,41H2,1-2H3,(H,44,45)/b12-10-/t38-/m1/s1
InChIKeyRCMKIUKOJUTRGR-UAQMVCKTSA-N
ChEBI Ontology
Outgoing Relation(s)
PE(21:0/14:1(9Z)) (CHEBI:196810) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(Z)-tetradec-9-enoyl]oxypropyl] henicosanoate
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