EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H25FN2 |
| Net Charge | 0 |
| Average Mass | 372.487 |
| Monoisotopic Mass | 372.20018 |
| SMILES | Cc1cccc(-c2ccc(C3[C@H]4CNC[C@@H]3N4Cc3cccc(F)c3)cc2)c1 |
| InChI | InChI=1S/C25H25FN2/c1-17-4-2-6-21(12-17)19-8-10-20(11-9-19)25-23-14-27-15-24(25)28(23)16-18-5-3-7-22(26)13-18/h2-13,23-25,27H,14-16H2,1H3/t23-,24+,25? |
| InChIKey | WSVNFXWADMNKEI-XMGLRAKGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (1R,5S)-6-[(3-fluorophenyl)methyl]-7-[4-(3-methylphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane (CHEBI:130799) is a piperidines (CHEBI:26151) |
| Manual Xrefs | Databases |
|---|---|
| LSM-42348 | LINCS |