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CHEBI:89068 - PC(22:0/18:3(9Z,12Z,15Z))

Default Structure
ChEBI IDCHEBI:89068
ChEBI NamePC(22:0/18:3(9Z,12Z,15Z))
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)CCCCCCC/C=C\C/C=C\C/C=C\CC
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/h9,11,15,17,21,26,46H,6-8,10,12-14,16,18-20,22-25,27-45H2,1-5H3/b11-9-,17-15-,26-21-/t46-/m1/s1
InChIKeyJYFWSVLYQSTYHE-NOAWTOFZSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) PubMed (24023812)
ChEBI Ontology
Outgoing Relation(s)
PC(22:0/18:3(9Z,12Z,15Z)) (CHEBI:89068) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
1-Behenoyl-2-a-linolenoyl-sn-glycero-3-phosphocholineHMDB
1-Behenoyl-2-alpha-linolenoyl-sn-glycero-3-phosphocholineHMDB
(2-{[(2R)-3-(docosanoyloxy)-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazaniumHMDB
GPCho(22:0/18:3)HMDB
GPCho(22:0/18:3n3)HMDB
GPCho(22:0/18:3w3)HMDB
Manual XrefsDatabases
HMDB0008535HMDB
LecithinWikipedia
PHOSPHATIDYLCHOLINEMetaCyc
Citations