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CHEBI:176503 - 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:176503
ChEBI Name1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H57NO7P
Net Charge+1
Average Mass550.738
Monoisotopic Mass550.38672
SMILESCCCCCCCCC=CCCCCCCCCOCC(COP(=O)(O)OCC[N+](C)(C)C)OC(C)=O
InChIInChI=1S/C28H56NO7P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-33-25-28(36-27(2)30)26-35-37(31,32)34-24-22-29(3,4)5/h13-14,28H,6-12,15-26H2,1-5H3/p+1
InChIKeyZBOQHUSCQCEBGK-UHFFFAOYSA-O
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) MetaboLights (MTBLS2714)
ChEBI Ontology
Outgoing Relation(s)
1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine (CHEBI:176503) is a alkylacylglycero-3-phosphocholine (CHEBI:78189)
IUPAC Name 
2-[(2-acetyloxy-3-octadec-9-enoxypropoxy)-hydroxyphosphoryl]oxyethyl-trimethylazanium
Manual XrefsDatabases
2409ChemSpider