EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H26F3N3O3 |
| Net Charge | 0 |
| Average Mass | 449.473 |
| Monoisotopic Mass | 449.19263 |
| SMILES | O=C1CCc2cc(OC[C@H](O)CN3CCN(c4ccc(C(F)(F)F)cc4)CC3)ccc2N1 |
| InChI | InChI=1S/C23H26F3N3O3/c24-23(25,26)17-2-4-18(5-3-17)29-11-9-28(10-12-29)14-19(30)15-32-20-6-7-21-16(13-20)1-8-22(31)27-21/h2-7,13,19,30H,1,8-12,14-15H2,(H,27,31)/t19-/m1/s1 |
| InChIKey | QJKYLYXHWSCZQT-LJQANCHMSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| np-10679 (CHEBI:758831) is a piperazines (CHEBI:26144) |
| Synonyms | Source |
|---|---|
| Np-10679 | ChEMBL |
| NP10679 | ChEMBL |