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CHEBI:89692 - PC(18:1(11Z)/18:3(6Z,9Z,12Z))

ChEBI IDCHEBI:89692
ChEBI NamePC(18:1(11Z)/18:3(6Z,9Z,12Z))
Stars
DownloadsMolfile
FormulaC44H80NO8P
Net Charge0
Average Mass782.097
Monoisotopic Mass781.56216
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\CCCCC
InChIInChI=1S/C44H80NO8P/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/h15-18,21,23,27,29,42H,6-14,19-20,22,24-26,28,30-41H2,1-5H3/b17-15-,18-16-,23-21-,29-27-/t42-/m1/s1
InChIKeyMRRFMOUCAPXWJC-SSCJOAGESA-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))
urine (BTO:0001419) PubMed (24023812)
ChEBI Ontology
Outgoing Relation(s)
PC(18:1(11Z)/18:3(6Z,9Z,12Z)) (CHEBI:89692) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
1-Vaccenoyl-2-g-linolenoyl-sn-glycero-3-phosphocholineHMDB
Phosphatidylcholine(18:1w7/18:3w6)HMDB
PC(36:4)HMDB
Phosphatidylcholine(18:1/18:3)HMDB
trimethyl(2-{[(2R)-3-[(11Z)-octadec-11-enoyloxy]-2-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propyl phosphonato]oxy}ethyl)azaniumHMDB
PC(18:1/18:3)HMDB
Manual XrefsDatabases
PHOSPHATIDYLCHOLINEMetaCyc
HMDB0008073HMDB
LecithinWikipedia
Citations