EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H20N2O2 |
| Net Charge | 0 |
| Average Mass | 332.403 |
| Monoisotopic Mass | 332.15248 |
| SMILES | CN1C(=CC(=O)c2oc3ccccc3c2N)C(C)(C)c2ccccc21 |
| InChI | InChI=1S/C21H20N2O2/c1-21(2)14-9-5-6-10-15(14)23(3)18(21)12-16(24)20-19(22)13-8-4-7-11-17(13)25-20/h4-12H,22H2,1-3H3 |
| InChIKey | GTGGBHFTZAOINR-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(3-amino-2-benzofuranyl)-2-(1,3,3-trimethyl-2-indolylidene)ethanone (CHEBI:115107) is a benzofurans (CHEBI:35259) |
| Manual Xrefs | Databases |
|---|---|
| LSM-26568 | LINCS |