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CHEBI:89973 - PC(P-18:0/18:1(11Z))

ChEBI IDCHEBI:89973
ChEBI NamePC(P-18:0/18:1(11Z))
Stars
DownloadsMolfile
FormulaC44H86NO7P
Net Charge0
Average Mass772.146
Monoisotopic Mass771.61419
SMILES[H][C@@](CO/C=C\CCCCCCCCCCCCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCC/C=C\CCCCCC
InChIInChI=1S/C44H86NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-39-49-41-43(42-51-53(47,48)50-40-38-45(3,4)5)52-44(46)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h17,19,36,39,43H,6-16,18,20-35,37-38,40-42H2,1-5H3/b19-17-,39-36-/t43-/m1/s1
InChIKeyJDTHSYITWRQVSV-CESBNGMCSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
saliva (UBERON:0001836) Article (Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation))
urine (BTO:0001419) PubMed (24023812)
ChEBI Ontology
Outgoing Relation(s)
PC(P-18:0/18:1(11Z)) (CHEBI:89973) is a glycerophosphocholine (CHEBI:36313)
Synonyms  Source
PC(18:0/18:1w7)HMDB
PC aa C36:1HMDB
Phosphatidylcholine(18:0/18:1n7)HMDB
trimethyl(2-{[(2R)-3-[(1Z)-octadec-1-en-1-yloxy]-2-[(11Z)-octadec-11-enoyloxy]propyl phosphonato]oxy}ethyl)azaniumHMDB
PC(36:1)HMDB
PC(18:0/18:1)HMDB
Manual XrefsDatabases
HMDB0011242HMDB
Citations