CHEBI:79097 - 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine
ChEBI ID CHEBI:79097
ChEBI ASCII Name 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine
Definition A 1,2-diacyl-sn-glycero-3-phosphoethanolamine in which the acyl substituents at positions 1 and 2 are specified as hexadecanoyl and (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C43H74NO8P
Net Charge 0
Average Mass 764.02330
Monoisotopic Mass 763.51521
InChI InChI=1S/C43H74NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44)39-49-42(45)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,24,26,30,32,41H,3-4,6,8-10,12,14-16,19,22-23,25,27-29,31,33-40,44H2,1-2H3,(H,47,48)/b7-5-,13-11-,18-17-,21-20-,26-24-,32-30-/t41-/m1/s1
InChIKey MPWUZHVZZKSTPV-MADBQMNMSA-N
SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(O)(=O)OCCN)OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC
ChEBI Ontology
Outgoing 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:79097) has functional parent all-cis-docosa-4,7,10,13,16,19-hexaenoic acid (CHEBI:28125)
1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:79097) has functional parent hexadecanoic acid (CHEBI:15756)
1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:79097) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:79097) is tautomer of 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:78261)
Incoming 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:78261) is tautomer of 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:79097)
IUPAC Name
(19R)-25-amino-22-hydroxy-22-oxido-16-oxo-17,21,23-trioxa-22λ5-phosphapentacosan-19-yl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
Synonyms Sources
1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine LIPID MAPS
1-Hexadecanoyl-2-docosahexanoyl-sn-glycero-3-phosphoethanolamine ChemIDplus
1-palmitoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine ChEBI
1-Palmitoyl-2-docosahexanoyl-sn-glycero-3-phosphoethanolamine ChemIDplus
GPEtn(16:0/22:6) HMDB
GPEtn(16:0/22:6n3) HMDB
GPEtn(16:0/22:6w3) HMDB
GPEtn(38:6) HMDB
PE(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) LIPID MAPS
PE(16:0/22:6) LIPID MAPS
PE(16:0/22:6n3) HMDB
PE(16:0/22:6w3) HMDB
PE(38:6) HMDB
Phophatidylethanolamine(38:6) HMDB
Phosphatidylethanolamine(16:0/22:6) HMDB
Phosphatidylethanolamine(16:0/22:6n3) HMDB
Phosphatidylethanolamine(16:0/22:6w3) HMDB
Manual Xrefs Databases
HMDB0008946 HMDB
LMGP02010095 LIPID MAPS
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Registry Number Type Source
7789266 Reaxys Registry Number Reaxys
Last Modified
09 December 2019