EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:184273 - PC(22:1(11Z)/0:0)

ChEBI IDCHEBI:184273
ChEBI NamePC(22:1(11Z)/0:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H60NO7P
Net Charge0
Average Mass577.784
Monoisotopic Mass577.41074
SMILESCCCCCCCCCC/C=C\CCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C30H60NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-30(33)36-27-29(32)28-38-39(34,35)37-26-25-31(2,3)4/h14-15,29,32H,5-13,16-28H2,1-4H3/b15-14-/t29-/m1/s1
InChIKeyDNYZTHZOYQPAPM-BMAUTABQSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) serum (BTO:0001239) MetaboLights (MTBLS3725)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
PC(22:1(11Z)/0:0) (CHEBI:184273) is a 1-O-acyl-sn-glycero-3-phosphocholine (CHEBI:58168)
IUPAC Name 
[(2R)-3-[(Z)-docos-11-enoyl]oxy-2-hydroxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
113375411ChemSpider
LMGP01050134LIPID MAPS