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CHEBI:89535 - PC(18:3(6Z,9Z,12Z)/P-18:1(9Z))

ChEBI IDCHEBI:89535
ChEBI NamePC(18:3(6Z,9Z,12Z)/P-18:1(9Z))
Stars
DownloadsMolfile
FormulaC44H80NO7P
Net Charge0
Average Mass766.098
Monoisotopic Mass765.56724
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)O/C=C\CCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C44H80NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-39-49-43(42-52-53(47,48)51-40-38-45(3,4)5)41-50-44(46)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h15,17,20-23,27,29,36,39,43H,6-14,16,18-19,24-26,28,30-35,37-38,40-42H2,1-5H3/b17-15-,22-20-,23-21-,29-27-,39-36-
InChIKeyKNUHCOXKVDQBIW-UPRXZTSASA-N
Wikipedia
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(18:3(6Z,9Z,12Z)/P-18:1(9Z)) (CHEBI:89535) is a glycerophosphocholine (CHEBI:36313)
Synonyms  Source
PC(18:3w6/18:1w9)HMDB
PC(18:3n6/18:1n9)HMDB
PC aa C36:4HMDB
Phosphatidylcholine(18:3w6/18:1w9)HMDB
trimethyl[2-({2-[(1Z,9Z)-octadeca-1,9-dien-1-yloxy]-3-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propyl phosphonato}oxy)ethyl]azaniumHMDB
GPCho(18:3n6/18:1n9)HMDB
Manual XrefsDatabases
HMDB0008195HMDB
LecithinWikipedia
PHOSPHATIDYLCHOLINEMetaCyc
Citations