EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H40O5 |
| Net Charge | 0 |
| Average Mass | 384.557 |
| Monoisotopic Mass | 384.28757 |
| SMILES | CCCCC(C)CC(O)/C=C/C1C(O)CC(O)C1CCCCCCC(=O)O |
| InChI | InChI=1S/C22H40O5/c1-3-4-9-16(2)14-17(23)12-13-19-18(20(24)15-21(19)25)10-7-5-6-8-11-22(26)27/h12-13,16-21,23-25H,3-11,14-15H2,1-2H3,(H,26,27)/b13-12+ |
| InChIKey | GBYMYPWDCSUFAK-OUKQBFOZSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | feces (BTO:0000440) | MetaboLights (MTBLS5335) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 17,20-dimethyl Prostaglandin F1alpha (CHEBI:193308) is a prostanoid (CHEBI:26347) |
| IUPAC Name |
|---|
| 7-[3,5-dihydroxy-2-[(E)-3-hydroxy-5-methylnon-1-enyl]cyclopentyl]heptanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 21467067 | ChemSpider |