EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:168572 - 2-Oleoylglycerophosphocholine

ChEBI IDCHEBI:168572
ChEBI Name2-Oleoylglycerophosphocholine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H53NO7P
Net Charge+1
Average Mass522.684
Monoisotopic Mass522.35542
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC(CO)COP(=O)(O)OCC[N+](C)(C)C
InChIInChI=1S/C26H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)34-25(23-28)24-33-35(30,31)32-22-21-27(2,3)4/h12-13,25,28H,5-11,14-24H2,1-4H3/p+1/b13-12-
InChIKeySULIDBRAXVDKBU-SEYXRHQNSA-O
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
2-Oleoylglycerophosphocholine (CHEBI:168572) is a 2-acyl-sn-glycero-3-phosphocholine(1+) (CHEBI:16728)
IUPAC Name 
2-[hydroxy-[3-hydroxy-2-[(Z)-octadec-9-enoyl]oxypropoxy]phosphoryl]oxyethyl-trimethylazanium
Manual XrefsDatabases
HMDB0061701HMDB
7825625ChemSpider