EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H10F8N4O |
| Net Charge | 0 |
| Average Mass | 426.267 |
| Monoisotopic Mass | 426.07269 |
| SMILES | [H]/C(C(=O)N1CC(F)(F)C1)=C(\[H])n1cnc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 |
| InChI | InChI=1S/C16H10F8N4O/c17-14(18)6-27(7-14)12(29)1-2-28-8-25-13(26-28)9-3-10(15(19,20)21)5-11(4-9)16(22,23)24/h1-5,8H,6-7H2/b2-1- |
| InChIKey | JCHAWRDHMUSLMM-UPHRSURJSA-N |
| Roles Classification |
|---|
| Biological Role: | exportin 1 inhibitor Any inhibitor of exportin 1. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| KPT-276 (CHEBI:232870) has role exportin 1 inhibitor (CHEBI:229763) |
| KPT-276 (CHEBI:232870) is a organic molecular entity (CHEBI:50860) |
| IUPAC Name |
|---|
| (Z)-3-[3-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]-1-(3,3-difluoroazetidin-1-yl)prop-2-en-1-one |
| Citations |
|---|