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CHEBI:190227 - PI(17:0/18:1)

ChEBI IDCHEBI:190227
ChEBI NamePI(17:0/18:1)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC44H83O13P
Net Charge0
Average Mass851.109
Monoisotopic Mass850.55713
SMILESCCCCCCCCCC/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)[C@@H](O)C1O
InChIInChI=1S/C44H83O13P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-25-27-29-31-33-38(46)56-36(34-54-37(45)32-30-28-26-24-14-12-10-8-6-4-2)35-55-58(52,53)57-44-42(50)40(48)39(47)41(49)43(44)51/h18-19,36,39-44,47-51H,3-17,20-35H2,1-2H3,(H,52,53)/b19-18-/t36-,39?,40-,41?,42?,43?,44?/m1/s1
InChIKeyIWPXVEMEORANHL-VPIALDNNSA-N
Species of MetaboliteComponentSourceComments
Canis lupus (ncbitaxon:9612) liver (BTO:0000759) MetaboLights (MTBLS4015)
ChEBI Ontology
Outgoing Relation(s)
PI(17:0/18:1) (CHEBI:190227) is a phosphatidylinositol (CHEBI:28874)
IUPAC Name 
[(2R)-1-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-3-tridecanoyloxypropan-2-yl] (Z)-docos-11-enoate
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LMGP06010057LIPID MAPS