EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:89678 - PC(18:1(11Z)/16:1(9Z))

ChEBI IDCHEBI:89678
ChEBI NamePC(18:1(11Z)/16:1(9Z))
Stars
DownloadsMolfile
FormulaC42H80NO8P
Net Charge0
Average Mass758.075
Monoisotopic Mass757.56216
SMILES[H][C@@](COC(=O)CCCCCCCCC/C=C\CCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCC
InChIInChI=1S/C42H80NO8P/c1-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-22-19-17-15-13-11-9-7-2/h16-19,40H,6-15,20-39H2,1-5H3/b18-16-,19-17-/t40-/m1/s1
InChIKeyFDBAKEKHEMZAPT-JSLHZOBYSA-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)/16:1(9Z)) (CHEBI:89678) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
LecithinHMDB
PC(34:2)HMDB
PC(18:1n7/16:1n7)HMDB
GPCho(18:1/16:1)HMDB
Phosphatidylcholine(18:1n7/16:1n7)HMDB
Phosphatidylcholine(18:1/16:1)HMDB
Manual XrefsDatabases
HMDB0008068HMDB
LecithinWikipedia
PHOSPHATIDYLCHOLINEMetaCyc
Citations