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CHEBI:84833 - 1-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine

ChEBI IDCHEBI:84833
ChEBI Name1-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine
Stars
ASCII Name1-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine
DefinitionA 1,2-diacyl-sn-glycero-3-phosphoethanolamine in which the 1- and 2-acyl groups are specified as hexadecanoyl (palmitoyl) and 11Z-octadecenoyl respectively.
Last Modified17 February 2015
Submitternamrata
DownloadsMolfile
FormulaC39H76NO8P
Net Charge0
Average Mass718.010
Monoisotopic Mass717.53086
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCC)(COP(=O)(O)OCCN)OC(=O)CCCCCCCCC/C=C\CCCCCC
InChIInChI=1S/C39H76NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h13,15,37H,3-12,14,16-36,40H2,1-2H3,(H,43,44)/b15-13-/t37-/m1/s1
InChIKeyLYJWNHGFGVVCAO-IEHWZJNJSA-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-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:84833) has functional parent cis-vaccenic acid (CHEBI:50464)
1-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:84833) has functional parent hexadecanoic acid (CHEBI:15756)
1-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:84833) has role mouse metabolite (CHEBI:75771)
1-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:84833) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
(19R)-25-amino-22-hydroxy-22-oxido-16-oxo-17,21,23-trioxa-22λ5-phosphapentacosan-19-yl (11Z)-octadec-11-enoate
Synonyms  Source
PE(16:0/18:1)LIPID MAPS
PE(16:0/18:1(11Z))LIPID MAPS
GPEtn(16:0/18:1n7)HMDB
1-Palmitoyl-2-vaccenoyl-sn-glycero-3-phosphoethanolamineHMDB
GPEtn(16:0/18:1)HMDB
Phophatidylethanolamine(16:0/18:1n7)HMDB
Manual XrefsDatabases
LMGP02010010LIPID MAPS