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CHEBI:89069 - PC(22:0/18:3(6Z,9Z,12Z))

ChEBI IDCHEBI:89069
ChEBI NamePC(22:0/18:3(6Z,9Z,12Z))
Stars
DownloadsMolfile
FormulaC48H90NO8P
Net Charge0
Average Mass840.221
Monoisotopic Mass839.64041
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCCCCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC
InChIInChI=1S/C48H90NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-28-30-32-34-36-38-40-47(50)54-44-46(45-56-58(52,53)55-43-42-49(3,4)5)57-48(51)41-39-37-35-33-31-29-26-21-19-17-15-13-11-9-7-2/h15,17,21,26,31,33,46H,6-14,16,18-20,22-25,27-30,32,34-45H2,1-5H3/b17-15-,26-21-,33-31-/t46-/m1/s1
InChIKeyOFWRYSQDJOQSHU-FARFQYTLSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) PubMed (24023812)
ChEBI Ontology
Outgoing Relation(s)
PC(22:0/18:3(6Z,9Z,12Z)) (CHEBI:89069) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
PC aa C40:3HMDB
Phosphatidylcholine(22:0/18:3w6)HMDB
GPCho(40:3)HMDB
(2-{[(2R)-3-(docosanoyloxy)-2-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazaniumHMDB
PC(22:0/18:3n6)HMDB
GPCho(22:0/18:3w6)HMDB
Manual XrefsDatabases
LecithinWikipedia
HMDB0008534HMDB
PHOSPHATIDYLCHOLINEMetaCyc
Citations