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CHEBI:138222 - N-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine(1−)

ChEBI IDCHEBI:138222
ChEBI NameN-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine(1−)
Stars
ASCII NameN-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine(1-)
DefinitionAn N-oleoylphosphatidylethanolamine(1−) in which the acyl groups at positions 1 and 2 are both specified as heptadecanoyl.
Last Modified23 November 2020
Submitterlaimo
DownloadsMolfile
FormulaC57H109NO9P
Net Charge-1
Average Mass983.471
Monoisotopic Mass982.78454
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)NCCOP(=O)([O-])OC[C@@H](COC(=O)CCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCC
InChIInChI=1S/C57H110NO9P/c1-4-7-10-13-16-19-22-25-28-29-32-35-38-41-44-47-55(59)58-50-51-65-68(62,63)66-53-54(67-57(61)49-46-43-40-37-34-31-27-24-21-18-15-12-9-6-3)52-64-56(60)48-45-42-39-36-33-30-26-23-20-17-14-11-8-5-2/h25,28,54H,4-24,26-27,29-53H2,1-3H3,(H,58,59)(H,62,63)/p-1/b28-25-/t54-/m1/s1
InChIKeyPCUGWEAIXCPPIT-JRTFMWKKSA-M
ChEBI Ontology
Outgoing Relation(s)
N-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:138222) has functional parent margarate (CHEBI:32366)
N-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:138222) has functional parent oleate (CHEBI:30823)
N-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:138222) is a N-oleoyl-1,2-diacyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:137429)
N-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:138222) is conjugate base of N-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine (CHEBI:138930)
Incoming Relation(s)
N-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine (CHEBI:138930) is conjugate acid of N-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:138222)
IUPAC Name 
(2R)-2,3-bis(heptadecanoyloxy)propyl 2-{[(9Z)-octadec-9-enoyl]amino}ethyl phosphate
Synonym  Source
N-(9Z)18:1-PE(17:0/17:0)(1−)SUBMITTER
UniProt Name  Source
1,2-diheptadecanoyl-sn-glycero-3-phospho-N-(9Z-octadecenoyl)-ethanolamineUniProt
Citations