EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C44H85O12P |
| Net Charge | 0 |
| Average Mass | 837.126 |
| Monoisotopic Mass | 836.57786 |
| SMILES | CCCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)[C@@H](O)C1O |
| InChI | InChI=1S/C44H85O12P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-38(45)55-37(35-53-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2)36-54-57(51,52)56-44-42(49)40(47)39(46)41(48)43(44)50/h19-20,37,39-44,46-50H,3-18,21-36H2,1-2H3,(H,51,52)/b20-19-/t37-,39?,40-,41?,42?,43?,44?/m1/s1 |
| InChIKey | PNJVFOVAAOMOTK-OBGYOJFISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Trypanosoma brucei (ncbitaxon:5691) | cell culture (BTO:0000214) | MetaboLights (MTBLS2559) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PI(O-16:0/19:1(9Z)) (CHEBI:183184) is a glycerophosphoinositol (CHEBI:36315) |
| IUPAC Name |
|---|
| [(2R)-1-hexadecoxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropan-2-yl] (Z)-nonadec-9-enoate |
| Manual Xrefs | Databases |
|---|---|
| LMGP06020012 | LIPID MAPS |