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CHEBI:89694 - PC(18:1(11Z)/18:4(6Z,9Z,12Z,15Z))

ChEBI IDCHEBI:89694
ChEBI NamePC(18:1(11Z)/18:4(6Z,9Z,12Z,15Z))
Stars
DownloadsMolfile
FormulaC44H78NO8P
Net Charge0
Average Mass780.081
Monoisotopic Mass779.54651
SMILES[H][C@@](COC(=O)CCCCCCCCC/C=C\CCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC
InChIInChI=1S/C44H78NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h9,11,15-18,21,23,27,29,42H,6-8,10,12-14,19-20,22,24-26,28,30-41H2,1-5H3/b11-9-,17-15-,18-16-,23-21-,29-27-/t42-/m1/s1
InChIKeyQAMLWHXIPWZMCT-WXVJBZSZSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) saliva (UBERON:0001836) Article (Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation))
ChEBI Ontology
Outgoing Relation(s)
PC(18:1(11Z)/18:4(6Z,9Z,12Z,15Z)) (CHEBI:89694) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
Phosphatidylcholine(18:1n7/18:4n3)HMDB
PC aa C36:5HMDB
PC(18:1w7/18:4w3)HMDB
PC(18:1/18:4)HMDB
trimethyl(2-{[(2R)-3-[(11Z)-octadec-11-enoyloxy]-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyloxy]propyl phosphonato]oxy}ethyl)azaniumHMDB
1-Vaccenoyl-2-stearidonoyl-sn-glycero-3-phosphocholineHMDB
Manual XrefsDatabases
LecithinWikipedia
HMDB0008075HMDB
PHOSPHATIDYLCHOLINEMetaCyc