EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C36H71O7P |
| Net Charge | 0 |
| Average Mass | 646.931 |
| Monoisotopic Mass | 646.49374 |
| SMILES | CCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCC)COP(=O)(O)O |
| InChI | InChI=1S/C36H71O7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36(37)43-35(34-42-44(38,39)40)33-41-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h15,17,35H,3-14,16,18-34H2,1-2H3,(H2,38,39,40)/b17-15-/t35-/m1/s1 |
| InChIKey | DCEXIYJETNPMSD-SFENZSGWSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Trypanosoma brucei (ncbitaxon:5691) | cell culture (BTO:0000214) | MetaboLights (MTBLS2559) |
| Roles Classification |
|---|
| Biological Role: | mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PA(O-16:0/17:1(9Z)) (CHEBI:183218) is a ether lipid (CHEBI:64611) |
| PA(O-16:0/17:1(9Z)) (CHEBI:183218) is a monoacylglycerol phosphate (CHEBI:16961) |
| IUPAC Name |
|---|
| [(2R)-1-hexadecoxy-3-phosphonooxypropan-2-yl] (Z)-heptadec-9-enoate |
| Manual Xrefs | Databases |
|---|---|
| LMGP10020009 | LIPID MAPS |
| 113379322 | ChemSpider |