EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:88641 - PI(18:2(9Z,12Z)/18:0)

ChEBI IDCHEBI:88641
ChEBI NamePI(18:2(9Z,12Z)/18:0)
Stars
DownloadsMolfile
FormulaC45H83O13P
Net Charge0
Average Mass863.120
Monoisotopic Mass862.55713
SMILES[H][C@@](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)(COP(=O)(O)O[C@H]1C(O)C(O)C(O)[C@@H](O)C1O)OC(=O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C45H83O13P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(46)55-35-37(36-56-59(53,54)58-45-43(51)41(49)40(48)42(50)44(45)52)57-39(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,37,40-45,48-52H,3-10,12,14-16,18,20-36H2,1-2H3,(H,53,54)/b13-11-,19-17-/t37-,40?,41-,42?,43?,44?,45-/m1/s1
InChIKeyAXGVJUACAGEWGQ-TYYHIVGOSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood (UBERON:0000178) PubMed (20671299)
ChEBI Ontology
Outgoing Relation(s)
PI(18:2(9Z,12Z)/18:0) (CHEBI:88641) is a phosphatidylinositol (CHEBI:28874)
Synonyms  Source
PI(36:2)HMDB
Phosphatidylinositol(18:2n6/18:0)HMDB
PI(18:2/18:0)HMDB
[(2R)-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]-2-(octadecanoyloxy)propoxy]({[(1s,3R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})phosphinic acidHMDB
Phosphatidylinositol(36:2)HMDB
PIno(18:2n6/18:0)HMDB
Manual XrefsDatabases
PhosphatidylinositolsMetaCyc
LecithinWikipedia
HMDB0009847HMDB
Citations