EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H17F2N2 |
| Net Charge | +1 |
| Average Mass | 347.388 |
| Monoisotopic Mass | 347.13543 |
| SMILES | [H]c1c([H])c2c(c([H])c1F)-c1c3c(c([H])c(C([H])([H])[H])c([H])c3c3c([H])c(F)c([H])c([H])c3[n+]1C([H])([H])[H])N2C([H])([H])[H] |
| InChI | InChI=1S/C22H17F2N2/c1-12-8-16-15-10-13(23)4-6-18(15)26(3)22-17-11-14(24)5-7-19(17)25(2)20(9-12)21(16)22/h4-11H,1-3H3/q+1 |
| InChIKey | FJUYVGXXNUNWDT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3,11-DIFLUORO-6,8,13-TRIMETHYL-8H-QUINO[4,3,2-KL]ACRIDIN-13-IUM (CHEBI:43822) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| 3,11-difluoro-6,8,13-trimethyl-8H-quino[4,3,2-kl]acridin-13-ium | PDBeChem |
| 3,11-DIFLUORO-6,8,13-TRIMETHYL-8H-QUINO[4,3,2-KL]ACRIDIN-13-IUM | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| LG1 | PDBeChem |