CHEBI:89978 - PC(P-16:0/18:3(9Z,12Z,15Z))

ChEBI IDCHEBI:89978
ChEBI NamePC(P-16:0/18:3(9Z,12Z,15Z))
Stars
DownloadsMolfile
FormulaC42H78NO7P
Net Charge0
Average Mass740.060
Monoisotopic Mass739.55159
SMILES[H][C@@](CO/C=C\CCCCCCCCCCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC
InChIInChI=1S/C42H78NO7P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-42(44)50-41(40-49-51(45,46)48-38-36-43(3,4)5)39-47-37-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,34,37,41H,6-7,9,11-13,15,17-19,21,23-33,35-36,38-40H2,1-5H3/b10-8-,16-14-,22-20-,37-34-/t41-/m1/s1
InChIKeyWXQJKOUXCWEMOK-LUPMRSKMSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
urine (BTO:0001419) PubMed (24023812)
saliva (UBERON:0001836) Article (Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation))
ChEBI Ontology
Outgoing Relation(s)
PC(P-16:0/18:3(9Z,12Z,15Z)) (CHEBI:89978) is a glycerophosphocholine (CHEBI:36313)
Synonyms  Source
Phosphatidylcholine(16:0/18:3w3)HMDB
PC(16:0/18:3)HMDB
PC aa C34:3HMDB
Phosphatidylcholine(34:3)HMDB
GPCho(16:0/18:3n3)HMDB
(2-{[(2R)-3-[(1Z)-hexadec-1-en-1-yloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazaniumHMDB
Manual XrefsDatabases
HMDB0011213HMDB
Citations