EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H15NO4 |
| Net Charge | 0 |
| Average Mass | 237.255 |
| Monoisotopic Mass | 237.10011 |
| SMILES | CCC(C)C(=O)C1OC12C(=O)C=C(C)NC2=O |
| InChI | InChI=1S/C12H15NO4/c1-4-6(2)9(15)10-12(17-10)8(14)5-7(3)13-11(12)16/h5-6,10H,4H2,1-3H3,(H,13,16) |
| InChIKey | GAWXSBCGUQFYOO-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Sphaeropsis (ncbitaxon:66737) | - | PubMed (16712886) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Sapinopyridione (CHEBI:223338) is a tetrahydropyridine (CHEBI:26921) |
| IUPAC Name |
|---|
| 6-methyl-2-(2-methylbutanoyl)-1-oxa-7-azaspiro[2.5]oct-5-ene-4,8-dione |
| Manual Xrefs | Databases |
|---|---|
| 26503482 | ChemSpider |