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CHEBI:89690 - PC(18:1(11Z)/20:3(5Z,8Z,11Z))

ChEBI IDCHEBI:89690
ChEBI NamePC(18:1(11Z)/20:3(5Z,8Z,11Z))
Stars
DownloadsMolfile
FormulaC46H84NO8P
Net Charge0
Average Mass810.151
Monoisotopic Mass809.59346
SMILES[H][C@@](COC(=O)CCCCCCCCC/C=C\CCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC/C=C\C/C=C\C/C=C\CCCCCCCC
InChIInChI=1S/C46H84NO8P/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/h17,19-20,22,25,27,31,33,44H,6-16,18,21,23-24,26,28-30,32,34-43H2,1-5H3/b19-17-,22-20-,27-25-,33-31-/t44-/m1/s1
InChIKeyGUKWLDDRYZDHHJ-QQZUSIKJSA-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(18:1(11Z)/20:3(5Z,8Z,11Z)) (CHEBI:89690) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
PC(18:1w7/20:3w9)HMDB
GPCho(18:1/20:3)HMDB
Phosphatidylcholine(18:1n7/20:3n9)HMDB
PC aa C38:4HMDB
GPCho(38:4)HMDB
(2-{[(2R)-2-[(5Z,8Z,11Z)-icosa-5,8,11-trienoyloxy]-3-[(11Z)-octadec-11-enoyloxy]propyl phosphonato]oxy}ethyl)trimethylazaniumHMDB
Manual XrefsDatabases
LecithinWikipedia
PHOSPHATIDYLCHOLINEMetaCyc
HMDB0008079HMDB
Citations