CHEBI:84810 - 1-[(9Z)-hexadecenoyl]-2-[(11Z)-octadecenoyl]-sn-glycero-3-phosphocholine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-[(9Z)-hexadecenoyl]-2-[(11Z)-octadecenoyl]-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:84810
ChEBI ASCII Name 1-[(9Z)-hexadecenoyl]-2-[(11Z)-octadecenoyl]-sn-glycero-3-phosphocholine
Definition A phosphatidylcholine 34:2 in which the 1- and 2-acyl groups are specified as (9Z)-hexadecenoyl and (11Z)-octadecenoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C42H80NO8P
Net Charge 0
Average Mass 758.06030
Monoisotopic Mass 757.56216
InChI InChI=1S/C42H80NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h16-19,40H,6-15,20-39H2,1-5H3/b18-16-,19-17-/t40-/m1/s1
InChIKey JUVGBPLHSDPAMK-JSLHZOBYSA-N
SMILES CCCCCC\C=C/CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC\C=C/CCCCCC)COP([O-])(=O)OCC[N+](C)(C)C
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).
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via phosphatidylcholine 34:2 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-[(9Z)-hexadecenoyl]-2-[(11Z)-octadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:84810) has functional parent cis-vaccenic acid (CHEBI:50464)
1-[(9Z)-hexadecenoyl]-2-[(11Z)-octadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:84810) has functional parent palmitoleic acid (CHEBI:28716)
1-[(9Z)-hexadecenoyl]-2-[(11Z)-octadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:84810) has role mouse metabolite (CHEBI:75771)
1-[(9Z)-hexadecenoyl]-2-[(11Z)-octadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:84810) is a phosphatidylcholine 34:2 (CHEBI:64516)
IUPAC Name
(2R)-3-[(9Z)-hexadec-9-enoyloxy]-2-[(11Z)-octadec-11-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate
Synonyms Sources
1-Palmitoleoyl-2-vaccenoyl-sn-glycero-3-phosphocholine HMDB
GPCho(16:1/18:1) HMDB
GPCho(16:1n7/18:1n7) HMDB
GPCho(16:1w7/18:1w7) HMDB
GPCho(34:2) HMDB
PC(16:1(9Z)/18:1(11Z)) LIPID MAPS
PC(16:1/18:1) LIPID MAPS
PC(16:1n7/18:1n7) HMDB
PC(16:1w7/18:1w7) HMDB
Phosphatidylcholine(16:1n7/18:1n7) HMDB
Phosphatidylcholine(16:1w7/18:1w7) HMDB
Manual Xrefs Databases
HMDB0008004 HMDB
LMGP01010687 LIPID MAPS
View more database links
Last Modified
23 October 2015