EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H21NO3 |
| Net Charge | 0 |
| Average Mass | 287.359 |
| Monoisotopic Mass | 287.15214 |
| SMILES | COc1ccc(CN=CC2C(=O)CC(C)(C)CC2=O)cc1 |
| InChI | InChI=1S/C17H21NO3/c1-17(2)8-15(19)14(16(20)9-17)11-18-10-12-4-6-13(21-3)7-5-12/h4-7,11,14H,8-10H2,1-3H3 |
| InChIKey | JCNVZAFLBLCELF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-20571 (CHEBI:109174) is a methoxybenzenes (CHEBI:51683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20571 | LINCS |