EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H9F6N7 |
| Net Charge | 0 |
| Average Mass | 365.241 |
| Monoisotopic Mass | 365.08236 |
| SMILES | Cc1nn(CCc2nnnn2)c2nc(C(F)(F)F)cc(C(F)(F)F)c12 |
| InChI | InChI=1S/C12H9F6N7/c1-5-9-6(11(13,14)15)4-7(12(16,17)18)19-10(9)25(22-5)3-2-8-20-23-24-21-8/h4H,2-3H2,1H3,(H,20,21,23,24) |
| InChIKey | FGMOQCGINZQATI-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-methyl-1-[2-(2H-tetrazol-5-yl)ethyl]-4,6-bis(trifluoromethyl)pyrazolo[3,4-b]pyridine (CHEBI:104997) is a pyrazolopyridine (CHEBI:46699) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16360 | LINCS |