EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H51O9P |
| Net Charge | 0 |
| Average Mass | 526.648 |
| Monoisotopic Mass | 526.32707 |
| SMILES | CCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)OC[C@@H](O)CO |
| InChI | InChI=1S/C25H51O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25(29)32-20-24(28)22-34-35(30,31)33-21-23(27)19-26/h23-24,26-28H,2-22H2,1H3,(H,30,31)/t23-,24+/m0/s1 |
| InChIKey | KEMFFHNVIWFEJX-BJKOFHAPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS3750) | Strain: C57BL/6 Mouse [NCIT:C14424] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PG(19:0/0:0) (CHEBI:185827) is a glycerophosphoglycerols (CHEBI:24360) |
| IUPAC Name |
|---|
| [(2R)-3-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-2-hydroxypropyl] nonadecanoate |
| Manual Xrefs | Databases |
|---|---|
| 113377834 | ChemSpider |
| LMGP04050031 | LIPID MAPS |