EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H10N2O2S |
| Net Charge | 0 |
| Average Mass | 210.258 |
| Monoisotopic Mass | 210.04630 |
| SMILES | Nc1nc(C2C(=O)CCCC2=O)cs1 |
| InChI | InChI=1S/C9H10N2O2S/c10-9-11-5(4-14-9)8-6(12)2-1-3-7(8)13/h4,8H,1-3H2,(H2,10,11) |
| InChIKey | AOVFNFDBPZZQBX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(2-amino-4-thiazolyl)cyclohexane-1,3-dione (CHEBI:103923) is a thiazoles (CHEBI:48901) |
| Manual Xrefs | Databases |
|---|---|
| LSM-15276 | LINCS |