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CHEBI:85250 - N-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphoethanolamine(1−)

ChEBI IDCHEBI:85250
ChEBI NameN-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphoethanolamine(1−)
Stars
ASCII NameN-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphoethanolamine(1-)
DefinitionAn N-acyl-sn-glycero-3-phosphoethanolamine(1−) in which the N-acyl group is specified as (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl; major species at pH 7.3.
Last Modified18 May 2015
Submitternhn
DownloadsMolfile
FormulaC27H43NO7P
Net Charge-1
Average Mass524.615
Monoisotopic Mass524.27826
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@H](O)CO
InChIInChI=1S/C27H44NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27(31)28-22-23-34-36(32,33)35-25-26(30)24-29/h3-4,6-7,9-10,12-13,15-16,18-19,26,29-30H,2,5,8,11,14,17,20-25H2,1H3,(H,28,31)(H,32,33)/p-1/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-/t26-/m1/s1
InChIKeyYLEKZMUIJDSEKO-PAUXXPOVSA-M
ChEBI Ontology
Outgoing Relation(s)
N-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85250) is a N-acyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85225)
N-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85250) is conjugate base of N-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85780)
Incoming Relation(s)
N-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85780) is conjugate acid of N-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85250)
IUPAC Name 
(2R)-2,3-dihydroxypropyl 2-{[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]amino}ethyl phosphate
UniProt Name  Source
N-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphoethanolamineUniProt
Citations