CHEBI:85222 - N,1-dioleoyl-sn-glycero-3-phosphoethanolamine(1−)

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ChEBI Name N,1-dioleoyl-sn-glycero-3-phosphoethanolamine(1−)
ChEBI ID CHEBI:85222
ChEBI ASCII Name N,1-dioleoyl-sn-glycero-3-phosphoethanolamine(1-)
Definition An N-acyllysophosphatidylethanolamine(1−) in which both the N- and O-acyl group are specified as oleoyl (9Z-octadecenoyl); major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information ZINC000263614187
Download Molfile XML SDF
Formula C41H77NO8P
Net Charge -1
Average Mass 743.02630
Monoisotopic Mass 742.53923
InChI InChI=1S/C41H78NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)42-35-36-49-51(46,47)50-38-39(43)37-48-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,39,43H,3-16,21-38H2,1-2H3,(H,42,44)(H,46,47)/p-1/b19-17-,20-18-/t39-/m1/s1
InChIKey UQJFAJZAVYKPEN-NYVOMTAGSA-M
SMILES CCCCCCCC\C=C/CCCCCCCC(=O)NCCOP([O-])(=O)OC[C@H](O)COC(=O)CCCCCCC\C=C/CCCCCCCC
ChEBI Ontology
Outgoing N,1-dioleoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85222) is a N-acyllysophosphatidylethanolamine(1−) (CHEBI:85216)
N,1-dioleoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85222) is conjugate base of N,1-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85664)
Incoming N,1-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85664) is conjugate acid of N,1-dioleoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85222)
IUPAC Name
(2R)-2-hydroxy-3-{[(9Z)-octadec-9-enoyl]oxy}propyl 2-{[(9Z)-octadec-9-enoyl]amino}ethyl phosphate
Synonym Source
N,1-di-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine UniProt
Citation
Last Modified
11 April 2018