EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:89063 - PC(22:0/14:1(9Z))

ChEBI IDCHEBI:89063
ChEBI NamePC(22:0/14:1(9Z))
Stars
DownloadsMolfile
FormulaC44H86NO8P
Net Charge0
Average Mass788.145
Monoisotopic Mass787.60911
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCCCCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCC
InChIInChI=1S/C44H86NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-26-17-15-13-11-9-7-2/h13,15,42H,6-12,14,16-41H2,1-5H3/b15-13-/t42-/m1/s1
InChIKeyRGHFEAMZDBFLPO-FASREOMLSA-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(22:0/14:1(9Z)) (CHEBI:89063) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
LecithinHMDB
GPCho(22:0/14:1w5)HMDB
PC aa C36:1HMDB
GPCho(22:0/14:1n5)HMDB
GPCho(36:1)HMDB
GPCho(22:0/14:1)HMDB
Manual XrefsDatabases
LecithinWikipedia
HMDB0008526HMDB
PHOSPHATIDYLCHOLINEMetaCyc
Citations