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CHEBI:138547 - 1-O-(1Z-octadecenyl)-2-(14-hydroxy-4Z,7Z,10Z,12E,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine

Default Structure
ChEBI IDCHEBI:138547
ChEBI Name1-O-(1Z-octadecenyl)-2-(14-hydroxy-4Z,7Z,10Z,12E,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine
Stars
ASCII Name1-O-(1Z-octadecenyl)-2-(14-hydroxy-4Z,7Z,10Z,12E,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine
Last Modified28 September 2017
Submittermwilliams
DownloadsMolfile
FormulaC45H78NO8P
Net Charge0
Average Mass792.092
Monoisotopic Mass791.54651
SMILES[H][C@@](CO/C=C\CCCCCCCCCCCCCCCC)(COP(=O)(O)OCCN)OC(=O)CC/C=C\C/C=C\C/C=C\C=C\C(O)C/C=C\C/C=C\CC
InChIInChI=1S/C45H78NO8P/c1-3-5-7-9-11-12-13-14-15-16-17-20-23-26-30-34-39-51-41-44(42-53-55(49,50)52-40-38-46)54-45(48)37-33-29-25-22-19-18-21-24-28-32-36-43(47)35-31-27-10-8-6-4-2/h6,8,18-19,24-25,27-29,31-32,34,36,39,43-44,47H,3-5,7,9-17,20-23,26,30,33,35,37-38,40-42,46H2,1-2H3,(H,49,50)/b8-6-,19-18-,28-24-,29-25-,31-27-,36-32+,39-34-/t43?,44-/m1/s1
InChIKeyJLRGEXVZRFPGSD-DZAZWCTESA-N
ChEBI Ontology
Outgoing Relation(s)
1-O-(1Z-octadecenyl)-2-(14-hydroxy-4Z,7Z,10Z,12E,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:138547) is a oxidized glycerophosphoethanolamine (CHEBI:138545)
Synonyms  Source
18:0p/14-HDOHE-PELIPID MAPS
PE(P-18:0/22:6(4Z,7Z,10Z,12E,16Z,19Z)(14OH))LIPID MAPS
Manual XrefsDatabases
LMGP20020015LIPID MAPS