EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H16FNO2 |
| Net Charge | 0 |
| Average Mass | 285.318 |
| Monoisotopic Mass | 285.11651 |
| SMILES | [H]c1c(F)c([H])c2c(OC#CC3([H])C([H])([H])C3([H])[H])c(C([H])(C([H])([H])[H])C([H])([H])[H])c(=O)n([H])c2c1[H] |
| InChI | InChI=1S/C17H16FNO2/c1-10(2)15-16(21-8-7-11-3-4-11)13-9-12(18)5-6-14(13)19-17(15)20/h5-6,9-11H,3-4H2,1-2H3,(H,19,20) |
| InChIKey | YVJFHKQYMKKIHK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[(CYCLOPROPYLETHYNYL)OXY]-6-FLUORO-3-ISOPROPYLQUINOLIN-2(1H)-ONE (CHEBI:43111) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| 4-[(cyclopropylethynyl)oxy]-6-fluoro-3-(1-methylethyl)quinolin-2(1H)-one | PDBeChem |
| 4-[(CYCLOPROPYLETHYNYL)OXY]-6-FLUORO-3-ISOPROPYLQUINOLIN-2(1H)-ONE | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| GWB | PDBeChem |