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CHEBI:183948 - Pi(18:1/8,9-epete)
| Formula | C47H79O14P |
| Net Charge | 0 |
| Average Mass | 899.109 |
| Monoisotopic Mass | 898.52074 |
| SMILES | CC/C=C\C/C=C\C/C=C\CC1OC1C/C=C\CCCC(=O)OC(COC(=O)CCCCCCC/C=C\CCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O |
| InChI | InChI=1S/C47H79O14P/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-29-33-40(48)57-35-37(36-58-62(55,56)61-47-45(53)43(51)42(50)44(52)46(47)54)59-41(49)34-30-26-25-28-32-39-38(60-39)31-27-23-21-19-12-10-8-6-4-2/h6,8,12,15-16,19,23,25,27-28,37-39,42-47,50-54H,3-5,7,9-11,13-14,17-18,20-22,24,26,29-36H2,1-2H3,(H,55,56)/b8-6-,16-15-,19-12-,27-23-,28-25- |
| InChIKey | KKGCPLJFEXUDSC-IDDXEADPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Nippostrongylus brasiliensis (ncbitaxon:27835) | Whole Organism (NCIT:C13413) | MetaboLights (MTBLS3486) | |
| Mus musculus (ncbitaxon:10090) | small intestine (BTO:0000651) | MetaboLights (MTBLS3486) | Strain: C57BL/6 Mouse [THESAURUS.OWL#C14424] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Pi(18:1/8,9-epete) (CHEBI:183948) is a phosphatidylinositol (CHEBI:28874) |
| IUPAC Name |
|---|
| [3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-2-[(Z)-7-[3-[(2Z,5Z,8Z)-undeca-2,5,8-trienyl]oxiran-2-yl]hept-5-enoyl]oxypropyl] (Z)-octadec-9-enoate |