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CHEBI:89458 - PC(P-18:1(9Z)/18:3(9Z,12Z,15Z))

ChEBI IDCHEBI:89458
ChEBI NamePC(P-18:1(9Z)/18:3(9Z,12Z,15Z))
Stars
DownloadsMolfile
FormulaC44H80NO7P
Net Charge0
Average Mass766.098
Monoisotopic Mass765.56724
SMILES[H][C@@](CO/C=C\CCCCCC/C=C\CCCCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC
InChIInChI=1S/C44H80NO7P/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/h9,11,15,17,20-23,36,39,43H,6-8,10,12-14,16,18-19,24-35,37-38,40-42H2,1-5H3/b11-9-,17-15-,22-20-,23-21-,39-36-/t43-/m1/s1
InChIKeyACSIRQPNAYTBRW-CBOVKQJBSA-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-18:1(9Z)/18:3(9Z,12Z,15Z)) (CHEBI:89458) is a glycerophosphocholine (CHEBI:36313)
Synonyms  Source
PC(18:1w9/18:3w3)HMDB
GPCho(18:1/18:3)HMDB
PC(36:4)HMDB
GPCho(18:1n9/18:3n3)HMDB
Phosphatidylcholine(36:4)HMDB
PC(18:1n9/18:3n3)HMDB
Manual XrefsDatabases
HMDB0011312HMDB
Citations