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CHEBI:85796 - N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine

ChEBI IDCHEBI:85796
ChEBI NameN-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine
Stars
ASCII NameN-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine
DefinitionAn N-acylphosphatidylethanolamine in which the N-acyl group is specified as capryl (decanoyl) while the phosphatidyl acyl groups at position 1 and 2 are specified as palmitoyl (hexadecanoyl) and linoleoyl (9Z,12Z-octadecadienoyl) respectively.
Last Modified20 May 2015
SubmitterSteve
DownloadsMolfile
FormulaC49H92NO9P
Net Charge0
Average Mass870.247
Monoisotopic Mass869.65097
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCCNC(=O)CCCCCCCCC
InChIInChI=1S/C49H92NO9P/c1-4-7-10-13-16-18-20-22-23-25-27-29-32-35-38-41-49(53)59-46(44-56-48(52)40-37-34-31-28-26-24-21-19-17-14-11-8-5-2)45-58-60(54,55)57-43-42-50-47(51)39-36-33-30-15-12-9-6-3/h16,18,22-23,46H,4-15,17,19-21,24-45H2,1-3H3,(H,50,51)(H,54,55)/b18-16-,23-22-/t46-/m1/s1
InChIKeyCRESRYICDIWDAA-WAKCMLBPSA-N
ChEBI Ontology
Outgoing Relation(s)
N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85796) has functional parent decanoic acid (CHEBI:30813)
N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85796) has functional parent hexadecanoic acid (CHEBI:15756)
N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85796) has functional parent linoleic acid (CHEBI:17351)
N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85796) is a N-acylphosphatidylethanolamine (CHEBI:61232)
N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85796) is conjugate acid of N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85295)
Incoming Relation(s)
N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85295) is conjugate base of N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85796)
IUPAC Name 
(18R)-15-hydroxy-10,15,21-trioxo-14,16,20-trioxa-11-aza-15λ5-phosphahexatriacontan-18-yl (9Z,12Z)-octadeca-9,12-dienoate
Synonym  Source
N-decanoyl-1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamineChEBI
Registry NumbersSources
Reaxys:19897982Reaxys