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CHEBI:79110 - 1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine

ChEBI IDCHEBI:79110
ChEBI Name1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine
Stars
ASCII Name1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine
DefinitionA 1,2-diacyl-sn-glycero-3-phosphoethanolamine in which the acyl substituents at positions 1 and 2 are specified as stearoyl and arachidonoyl respectively.
Last Modified17 February 2015
SubmitterSteve
DownloadsMolfile
FormulaC43H78NO8P
Net Charge0
Average Mass768.070
Monoisotopic Mass767.54651
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C43H78NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44)39-49-42(45)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11,13,17,19,22,24,28,30,41H,3-10,12,14-16,18,20-21,23,25-27,29,31-40,44H2,1-2H3,(H,47,48)/b13-11-,19-17-,24-22-,30-28-/t41-/m1/s1
InChIKeyANRKEHNWXKCXDB-BHFWLYLHSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS143)
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine (CHEBI:79110) has functional parent arachidonic acid (CHEBI:15843)
1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine (CHEBI:79110) has functional parent octadecanoic acid (CHEBI:28842)
1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine (CHEBI:79110) has role human metabolite (CHEBI:77746)
1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine (CHEBI:79110) has role mouse metabolite (CHEBI:75771)
1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine (CHEBI:79110) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine (CHEBI:79110) is tautomer of 1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:78268)
Incoming Relation(s)
1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:78268) is tautomer of 1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine (CHEBI:79110)
IUPAC Name 
(21R)-27-amino-24-hydroxy-24-oxido-18-oxo-19,23,25-trioxa-24λ5-phosphaheptacosan-21-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
Synonyms  Source
1-octadecanoyl-2-(5Z,8Z,11Z,14Z)-icosatetraenoyl-sn-glycero-3-phosphoethanolamineChEBI
1-octadecanoyl-2-(5Z,8Z,11Z,14Z)-eicosatetraenoyl-sn-glycero-3-phosphoethanolamineChEBI
PE(18:0/20:4)LIPID MAPS
PE(18:0/20:4(5Z,8Z,11Z,14Z))LIPID MAPS
Phosphatidylethanolamine(18:0/20:4w6)HMDB
GPEtn(18:0/20:4w6)HMDB
Manual XrefsDatabases
LMGP02010118LIPID MAPS
HMDB0009003HMDB
Registry NumbersSources
Reaxys:6089816Reaxys
Citations