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CHEBI:88581 - PI(18:0/20:3(5Z,8Z,11Z))

ChEBI IDCHEBI:88581
ChEBI NamePI(18:0/20:3(5Z,8Z,11Z))
Stars
DownloadsMolfile
FormulaC47H85O13P
Net Charge0
Average Mass889.158
Monoisotopic Mass888.57278
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCCCC)(COP(=O)(O)O[C@H]1C(O)C(O)C(O)[C@@H](O)C1O)OC(=O)CCC/C=C\C/C=C\C/C=C\CCCCCCCC
InChIInChI=1S/C47H85O13P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-41(49)59-39(38-58-61(55,56)60-47-45(53)43(51)42(50)44(52)46(47)54)37-57-40(48)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h17,19,22,24,28,30,39,42-47,50-54H,3-16,18,20-21,23,25-27,29,31-38H2,1-2H3,(H,55,56)/b19-17-,24-22-,30-28-/t39-,42?,43-,44?,45?,46?,47-/m1/s1
InChIKeyBSTMJEKBGMABBW-SVOBYVNYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood (UBERON:0000178) PubMed (20671299)
ChEBI Ontology
Outgoing Relation(s)
PI(18:0/20:3(5Z,8Z,11Z)) (CHEBI:88581) is a phosphatidylinositol (CHEBI:28874)
Synonyms  Source
PIno(18:0/20:3w9)HMDB
PI(18:0/20:3n9)HMDB
Phosphatidylinositol(18:0/20:3n9)HMDB
Phosphatidylinositol(18:0/20:3w9)HMDB
Phosphatidylinositol(38:3)HMDB
[(2R)-2-[(5Z,8Z,11Z)-icosa-5,8,11-trienoyloxy]-3-(octadecanoyloxy)propoxy]({[(1s,3R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})phosphinic acidHMDB
Manual XrefsDatabases
PhosphatidylinositolsMetaCyc
HMDB0009813HMDB
LecithinWikipedia
Citations