CHEBI:73121 - 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine
ChEBI ID CHEBI:73121
ChEBI ASCII Name 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine
Definition A 1,2-diacyl-sn-glycero-3-phosphoethanolamine in which the 1- and 2-acyl groups are specified as hexadecanoyl (palmitoyl) and 9Z,12Z-octadecadienoyl (linoleoyl) respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C39H74NO8P
Net Charge 0
Average Mass 715.98050
Monoisotopic Mass 715.51521
InChI InChI=1S/C39H74NO8P/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/h11,13,17-18,37H,3-10,12,14-16,19-36,40H2,1-2H3,(H,43,44)/b13-11-,18-17-/t37-/m1/s1
InChIKey HBZNVZIRJWODIB-NHCUFCNUSA-N
SMILES [H][C@@](COC(=O)CCCCCCCCCCCCCCC)(COP(O)(=O)OCCN)OC(=O)CCCCCCC\C=C/C\C=C/CCCCC
Metabolite of Species Details
Mus musculus (NCBI:txid10090) See: MetaboLights Study
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:73121) has functional parent hexadecanoic acid (CHEBI:15756)
1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:73121) has functional parent linoleic acid (CHEBI:17351)
1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:73121) has role mouse metabolite (CHEBI:75771)
1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:73121) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:73121) is tautomer of 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:73008)
Incoming 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:73008) is tautomer of 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine (CHEBI:73121)
IUPAC Name
(19R)-25-amino-22-hydroxy-22-oxido-16-oxo-17,21,23-trioxa-22λ5-phosphapentacosan-19-yl (9Z,12Z)-octadeca-9,12-dienoate
Synonyms Sources
1-16:0-2-18:2-phosphatidylethanolamine MetaCyc
1-hexadecanoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine ChEBI
1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine ChEBI
16:0-18:2-PE MetaCyc
GPEtn(16:0/18:2) HMDB
GPEtn(16:0/18:2ω6) HMDB
GPEtn(34:2) HMDB
PE(16:0/18:2(9Z,12Z)) LIPID MAPS
PE(16:0/18:2) HMDB
PE(16:0/18:2ω6) HMDB
PE(34:2) HMDB
Phosphatidylethanolamine(16:0/18:2) HMDB
Phosphatidylethanolamine(16:0/18:2ω6) HMDB
Phosphatidylethanolamine(34:2) HMDB
Manual Xrefs Databases
CPD-8284 MetaCyc
HMDB0008928 HMDB
LMGP02010042 LIPID MAPS
View more database links
Registry Number Type Source
6093281 Reaxys Registry Number Reaxys
Last Modified
03 February 2015