CHEBI:178759 - PE(17:1(9Z)/19:1(9Z))

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ChEBI Name PE(17:1(9Z)/19:1(9Z))
ChEBI ID CHEBI:178759
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C41H78NO8P
Net Charge 0
Average Mass 744.048
Monoisotopic Mass 743.54651
InChI InChI=1S/C41H78NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-41(44)50-39(38-49-51(45,46)48-36-35-42)37-47-40(43)33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h16,18-20,39H,3-15,17,21-38,42H2,1-2H3,(H,45,46)/b18-16-,20-19-/t39-/m1/s1
InChIKey GXBVDMVOYGKTIZ-MDSBFBGCSA-N
SMILES P(OC[C@H](OC(=O)CCCCCCC/C=C\CCCCCCCCC)COC(=O)CCCCCCC/C=C\CCCCCCC)(OCCN)(O)=O
ChEBI Ontology
Outgoing PE(17:1(9Z)/19:1(9Z)) (CHEBI:178759) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(Z)-heptadec-9-enoyl]oxypropan-2-yl] (Z)-nonadec-9-enoate
Manual Xref Database
LMGP02010578 LIPID MAPS
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