EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:89867 - PC(o-18:2(9Z,12Z)/20:0)

ChEBI IDCHEBI:89867
ChEBI NamePC(o-18:2(9Z,12Z)/20:0)
Stars
DownloadsMolfile
FormulaC46H90NO7P
Net Charge0
Average Mass800.200
Monoisotopic Mass799.64549
SMILES[H][C@@](COCCCCCCCC/C=C\C/C=C\CCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C46H90NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-46(48)54-45(44-53-55(49,50)52-42-40-47(3,4)5)43-51-41-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h15,17,21,23,45H,6-14,16,18-20,22,24-44H2,1-5H3/b17-15-,23-21-/t45-/m1/s1
InChIKeyMOCFTDNEKLRJLC-HRGHQQQCSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) PubMed (24023812)
ChEBI Ontology
Outgoing Relation(s)
PC(o-18:2(9Z,12Z)/20:0) (CHEBI:89867) is a glycerophosphocholine (CHEBI:36313)
Synonyms  Source
Phosphatidylcholine(18:2/20:0)HMDB
1-Linoleyl-2-arachidonyl-sn-glycero-3-phosphocholineHMDB
(2-{[(2R)-2-(icosanoyloxy)-3-[(9Z,12Z)-octadeca-9,12-dien-1-yloxy]propyl phosphonato]oxy}ethyl)trimethylazaniumHMDB
PC(18:2w6/20:0)HMDB
Phosphatidylcholine(18:2n6/20:0)HMDB
Phosphatidylcholine(18:2w6/20:0)HMDB
Manual XrefsDatabases
HMDB0013436HMDB
Citations