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CHEBI:89558 - PC(18:3(6Z,9Z,12Z)/18:2(9Z,12Z))

ChEBI IDCHEBI:89558
ChEBI NamePC(18:3(6Z,9Z,12Z)/18:2(9Z,12Z))
Stars
DownloadsMolfile
FormulaC44H78NO8P
Net Charge0
Average Mass780.081
Monoisotopic Mass779.54651
SMILES[H][C@@](COC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
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/h14-17,20-23,26,28,42H,6-13,18-19,24-25,27,29-41H2,1-5H3/b16-14-,17-15-,22-20-,23-21-,28-26-/t42-/m1/s1
InChIKeyHBJOLTVTFPGCMX-XXDURKHJSA-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(18:3(6Z,9Z,12Z)/18:2(9Z,12Z)) (CHEBI:89558) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
GPCho(18:3w6/18:2w6)HMDB
1-g-Linolenoyl-2-linoleoyl-sn-glycero-3-phosphocholineHMDB
Phosphatidylcholine(18:3n6/18:2n6)HMDB
trimethyl(2-{[(2R)-3-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl phosphonato]oxy}ethyl)azaniumHMDB
1-gamma-Linolenoyl-2-linoleoyl-sn-glycero-3-phosphocholineHMDB
PC(18:3n6/18:2n6)HMDB
Manual XrefsDatabases
PHOSPHATIDYLCHOLINEMetaCyc
HMDB0008171HMDB
LecithinWikipedia