EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H11F3N2O5 |
| Net Charge | 0 |
| Average Mass | 296.201 |
| Monoisotopic Mass | 296.06201 |
| SMILES | O=c1nc(=O)n(C2C[C@H](O)[C@@H](CO)O2)cc1C(F)(F)F |
| InChI | InChI=1S/C10H11F3N2O5/c11-10(12,13)4-2-15(9(19)14-8(4)18)7-1-5(17)6(3-16)20-7/h2,5-7,16-17H,1,3H2,(H,14,18,19)/t5-,6+,7?/m0/s1 |
| InChIKey | VSQQQLOSPVPRAZ-GFCOJPQKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-(trifluoromethyl)pyrimidine-2,4-dione (CHEBI:95193) is a pyrimidine 2'-deoxyribonucleoside (CHEBI:19255) |
| Manual Xrefs | Databases |
|---|---|
| LSM-6478 | LINCS |