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CHEBI:84846 - 1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine

ChEBI IDCHEBI:84846
ChEBI Name1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine
Stars
ASCII Name1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine
DefinitionA 1,2-diacyl-sn-glycero-3-phosphoethanolamine in which the acyl substituent both at positions 1 and 2 is specified as (9Z,12Z)-octadecadienoyl respectively.
Last Modified17 February 2015
Submitternamrata
DownloadsMolfile
FormulaC41H74NO8P
Net Charge0
Average Mass740.016
Monoisotopic Mass739.51520
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
InChIInChI=1S/C41H74NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42)50-41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,39H,3-10,15-16,21-38,42H2,1-2H3,(H,45,46)/b13-11-,14-12-,19-17-,20-18-/t39-/m1/s1
InChIKeySSCDRSKJTAQNNB-DWEQTYCFSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS143)
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:84846) has functional parent linoleic acid (CHEBI:17351)
1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:84846) has role mouse metabolite (CHEBI:75771)
1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:84846) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:84846) is tautomer of 1,2-dilinoleoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:172403)
Incoming Relation(s)
1,2-dilinoleoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:172403) is tautomer of 1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:84846)
IUPAC Name 
(2R)-3-{[(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl (9Z,12Z)-octadeca-9,12-dienoate
Synonyms  Source
PE(18:2/18:2)LIPID MAPS
PE(18:2(9Z,12Z)/18:2(9Z,12Z))LIPID MAPS
Phophatidylethanolamine(18:2w6/18:2w6)HMDB
GPEtn(18:2w6/18:2w6)HMDB
1,2-di-linoleoyl-sn-glycero-3-phosphoethanolamineChEBI
Phophatidylethanolamine(18:2n6/18:2n6)HMDB
Manual XrefsDatabases
LMGP02010111LIPID MAPS
HMDB0009093HMDB