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CHEBI:84570 - 1-palmitoleoyl-2-stearoyl-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:84570
ChEBI Name1-palmitoleoyl-2-stearoyl-sn-glycero-3-phosphocholine
Stars
ASCII Name1-palmitoleoyl-2-stearoyl-sn-glycero-3-phosphocholine
DefinitionA 1,2-diacyl-sn-glycero-3-phosphocholine in which the acyl groups specified at positions 1 and 2 are palmitoleoyl and stearoyl respectively.
Last Modified23 October 2015
Submitternamrata
DownloadsMolfile
FormulaC42H82NO8P
Net Charge0
Average Mass760.091
Monoisotopic Mass759.57781
SMILESCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C42H82NO8P/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/h17,19,40H,6-16,18,20-39H2,1-5H3/b19-17-/t40-/m1/s1
InChIKeyLJUDFFWSOQEQKW-QCFYSATCSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS143)
Roles Classification
Biological Roles:
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.
ChEBI Ontology
Outgoing Relation(s)
1-palmitoleoyl-2-stearoyl-sn-glycero-3-phosphocholine (CHEBI:84570) has functional parent octadecanoic acid (CHEBI:28842)
1-palmitoleoyl-2-stearoyl-sn-glycero-3-phosphocholine (CHEBI:84570) has functional parent palmitoleic acid (CHEBI:28716)
1-palmitoleoyl-2-stearoyl-sn-glycero-3-phosphocholine (CHEBI:84570) has role mouse metabolite (CHEBI:75771)
1-palmitoleoyl-2-stearoyl-sn-glycero-3-phosphocholine (CHEBI:84570) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
1-palmitoleoyl-2-stearoyl-sn-glycero-3-phosphocholine (CHEBI:84570) is a phosphatidylcholine 34:1 (CHEBI:64517)
IUPAC Name 
(2R)-3-[(9Z)-hexadec-9-enoyloxy]-2-(octadecyloxy)propyl 2-(trimethylammonio)ethyl phosphate
Synonyms  Source
1-(9Z-hexadecenoyl)-2-octadecanoyl-sn-glycero-3-phosphocholineChEBI
GPCho(16:1/18:0)HMDB
GPCho(16:1n7/18:0)HMDB
GPCho(16:1w7/18:0)HMDB
PC(16:1/18:0)HMDB
PC(16:1/18:0)LIPID MAPS
Manual XrefsDatabases
HMDB0008003HMDB
LMGP01011483LIPID MAPS