CHEBI:178456 - PE(19:0/18:1(9Z))

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name PE(19:0/18:1(9Z))
ChEBI ID CHEBI:178456
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C42H82NO8P
Net Charge 0
Average Mass 760.091
Monoisotopic Mass 759.57781
InChI InChI=1S/C42H82NO8P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43)51-42(45)35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h18,20,40H,3-17,19,21-39,43H2,1-2H3,(H,46,47)/b20-18-/t40-/m1/s1
InChIKey IEXMVEPNTXOSEP-VDLQPGGRSA-N
SMILES P(OC[C@H](OC(=O)CCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCC)(OCCN)(O)=O
ChEBI Ontology
Outgoing PE(19:0/18:1(9Z)) (CHEBI:178456) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(Z)-octadec-9-enoyl]oxypropyl] nonadecanoate
Manual Xref Database
LMGP02010775 LIPID MAPS
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