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CHEBI:88658 - PI(18:2(9Z,12Z)/20:3(5Z,8Z,11Z))

ChEBI IDCHEBI:88658
ChEBI NamePI(18:2(9Z,12Z)/20:3(5Z,8Z,11Z))
Stars
DownloadsMolfile
FormulaC47H81O13P
Net Charge0
Average Mass885.126
Monoisotopic Mass884.54148
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)CCC/C=C\C/C=C\C/C=C\CCCCCCCC
InChIInChI=1S/C47H81O13P/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/h12,14,17-19,21-22,24,28,30,39,42-47,50-54H,3-11,13,15-16,20,23,25-27,29,31-38H2,1-2H3,(H,55,56)/b14-12-,19-17-,21-18-,24-22-,30-28-/t39-,42?,43-,44?,45?,46?,47-/m1/s1
InChIKeyCQDXWSUINUWFQX-XESSABTASA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood (UBERON:0000178) PubMed (20671299)
ChEBI Ontology
Outgoing Relation(s)
PI(18:2(9Z,12Z)/20:3(5Z,8Z,11Z)) (CHEBI:88658) is a phosphatidylinositol (CHEBI:28874)
Synonyms  Source
1-(9Z,12Z-Octadecadienoyl)-2-(5Z,8Z,11Z-eicosatrienoyl)-sn-glycero-3-phospho-(1'-myo-inositol)HMDB
PIno(18:2w6/20:3w9)HMDB
PI(18:2/20:3)HMDB
Phosphatidylinositol(18:2n6/20:3n9)HMDB
PIno(38:5)HMDB
[(2R)-2-[(5Z,8Z,11Z)-icosa-5,8,11-trienoyloxy]-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxy]({[(1s,3R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})phosphinic acidHMDB
Manual XrefsDatabases
PhosphatidylinositolsMetaCyc
LecithinWikipedia
HMDB0009854HMDB
Citations