EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:196743 - PC(18:1(9Z)/12:0)

ChEBI IDCHEBI:196743
ChEBI NamePC(18:1(9Z)/12:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H74NO8P
Net Charge0
Average Mass703.983
Monoisotopic Mass703.51520
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCC
InChIInChI=1S/C38H74NO8P/c1-6-8-10-12-14-16-17-18-19-20-21-23-24-26-28-30-37(40)44-34-36(35-46-48(42,43)45-33-32-39(3,4)5)47-38(41)31-29-27-25-22-15-13-11-9-7-2/h18-19,36H,6-17,20-35H2,1-5H3/b19-18-/t36-/m1/s1
InChIKeyKVJSTSHUTARPIN-UAIAYBLDSA-N
ChEBI Ontology
Outgoing Relation(s)
PC(18:1(9Z)/12:0) (CHEBI:196743) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name 
[(2R)-2-dodecanoyloxy-3-[(Z)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
LMGP01011595LIPID MAPS
75319949ChemSpider