EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H18O3 |
| Net Charge | 0 |
| Average Mass | 246.306 |
| Monoisotopic Mass | 246.12559 |
| SMILES | C/C1=C\CCC2(C)O[C@@H]2C(=O)c2c(C)coc2C1 |
| InChI | InChI=1S/C15H18O3/c1-9-5-4-6-15(3)14(18-15)13(16)12-10(2)8-17-11(12)7-9/h5,8,14H,4,6-7H2,1-3H3/b9-5-/t14-,15-/m1/s1 |
| InChIKey | CVIVANCKIBYAOP-LGIYYPAKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Zederone (CHEBI:80915) is a aromatic ketone (CHEBI:76224) |
| Manual Xrefs | Databases |
|---|---|
| C17085 | KEGG COMPOUND |