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CHEBI:191124 - Pi(18:1/13-hode)
| Formula | C45H81O14P |
| Net Charge | 0 |
| Average Mass | 877.103 |
| Monoisotopic Mass | 876.53639 |
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OCC(COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)OC(=O)CCCCCCC/C=C\C=C\C(O)CCCCC |
| InChI | InChI=1S/C45H81O14P/c1-3-5-7-8-9-10-11-12-13-14-15-18-21-24-28-32-38(47)56-34-37(35-57-60(54,55)59-45-43(52)41(50)40(49)42(51)44(45)53)58-39(48)33-29-25-22-19-16-17-20-23-27-31-36(46)30-26-6-4-2/h12-13,20,23,27,31,36-37,40-46,49-53H,3-11,14-19,21-22,24-26,28-30,32-35H2,1-2H3,(H,54,55)/b13-12-,23-20-,31-27+ |
| InChIKey | ZIJTZBSRQDRWFX-DYMQBEGYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Rattus norvegicus (ncbitaxon:10116) | INS-1 cell (BTO:0002135) | MetaboLights (MTBLS3963) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Pi(18:1/13-hode) (CHEBI:191124) is a phosphatidylinositol (CHEBI:28874) |
| IUPAC Name |
|---|
| [1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-[(Z)-octadec-9-enoyl]oxypropan-2-yl] (9Z,11E)-13-hydroxyoctadeca-9,11-dienoate |