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CHEBI:136371 - 1-[(11Z)-octadecenyl]-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:136371
ChEBI Name1-[(11Z)-octadecenyl]-sn-glycero-3-phosphocholine
Stars
ASCII Name1-[(11Z)-octadecenyl]-sn-glycero-3-phosphocholine
DefinitionA 1-alkyl-sn-glycero-3-phosphocholine in which the alkyl group is specified as (11Z)-octadecenyl.
Last Modified18 January 2018
Submittermwilliams
DownloadsMolfile
FormulaC26H54NO6P
Net Charge0
Average Mass507.693
Monoisotopic Mass507.36888
SMILESCCCCCC/C=C\CCCCCCCCCCOC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C26H54NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-31-24-26(28)25-33-34(29,30)32-23-21-27(2,3)4/h10-11,26,28H,5-9,12-25H2,1-4H3/b11-10-/t26-/m1/s1
InChIKeyHEEMBWYZIJABCR-ZXAYODBVSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
- PubMed (27635669)
- MetaboLights (MTBLS364)
Roles Classification
Biological Roles:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
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-[(11Z)-octadecenyl]-sn-glycero-3-phosphocholine (CHEBI:136371) has role human xenobiotic metabolite (CHEBI:76967)
1-[(11Z)-octadecenyl]-sn-glycero-3-phosphocholine (CHEBI:136371) is a 1-alkyl-sn-glycero-3-phosphocholine (CHEBI:30909)
1-[(11Z)-octadecenyl]-sn-glycero-3-phosphocholine (CHEBI:136371) is a lysophosphatidylcholine O-18:1 (CHEBI:64591)
IUPAC Name 
(2R)-2-hydroxy-3-{[(11Z)-octadec-11-en-1-yl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
1-(11Z-octadecenyl)-sn-glycero-3-phosphocholineLIPID MAPS
lysophosphatidylcholine O-18:1(11Z)/0:0ChEBI
PC(O-18:1(11Z)/0:0)LIPID MAPS
Manual XrefsDatabases
LMGP01060034LIPID MAPS
Registry NumbersSources
Reaxys:8660530Reaxys