EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:178399 - PC(O-2:0/2:0)

Default Structure
ChEBI IDCHEBI:178399
ChEBI NamePC(O-2:0/2:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H26NO7P
Net Charge0
Average Mass327.314
Monoisotopic Mass327.14469
SMILESCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(C)=O
InChIInChI=1S/C12H26NO7P/c1-6-17-9-12(20-11(2)14)10-19-21(15,16)18-8-7-13(3,4)5/h12H,6-10H2,1-5H3/t12-/m1/s1
InChIKeyOLGKYSVSAKLUHK-GFCCVEGCSA-N
ChEBI Ontology
Outgoing Relation(s)
PC(O-2:0/2:0) (CHEBI:178399) is a alkylacylglycero-3-phosphocholine (CHEBI:78189)
IUPAC Name 
[(2R)-2-acetyloxy-3-ethoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
406078ChemSpider
LMGP01020121LIPID MAPS
Registry NumbersSources
CAS:65154-06-5ChemIDplus