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CHEBI:89696 - PC(18:1(11Z)/20:4(8Z,11Z,14Z,17Z))

ChEBI IDCHEBI:89696
ChEBI NamePC(18:1(11Z)/20:4(8Z,11Z,14Z,17Z))
Stars
DownloadsMolfile
FormulaC46H82NO8P
Net Charge0
Average Mass808.135
Monoisotopic Mass807.57781
SMILES[H][C@@](COC(=O)CCCCCCCCC/C=C\CCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCC/C=C\C/C=C\C/C=C\C/C=C\CC
InChIInChI=1S/C46H82NO8P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h8,10,14,16-17,19-20,22,25,27,44H,6-7,9,11-13,15,18,21,23-24,26,28-43H2,1-5H3/b10-8-,16-14-,19-17-,22-20-,27-25-/t44-/m1/s1
InChIKeyJZIYIXOCSAGFBB-OYQODMOWSA-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)/20:4(8Z,11Z,14Z,17Z)) (CHEBI:89696) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
PC aa C38:5HMDB
PC(18:1w7/20:4w3)HMDB
Phosphatidylcholine(18:1n7/20:4n3)HMDB
GPCho(18:1n7/20:4n3)HMDB
PC(18:1n7/20:4n3)HMDB
1-Vaccenoyl-2-eicsoateHMDB
Manual XrefsDatabases
PHOSPHATIDYLCHOLINEMetaCyc
HMDB0008082HMDB
LecithinWikipedia
Citations