EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H25N3O |
| Net Charge | 0 |
| Average Mass | 371.484 |
| Monoisotopic Mass | 371.19976 |
| SMILES | COc1ccccc1CN1C[C@@H]2N[C@H](C1)C2c1ccc(-c2ccncc2)cc1 |
| InChI | InChI=1S/C24H25N3O/c1-28-23-5-3-2-4-20(23)14-27-15-21-24(22(16-27)26-21)19-8-6-17(7-9-19)18-10-12-25-13-11-18/h2-13,21-22,24,26H,14-16H2,1H3/t21-,22+,24? |
| InChIKey | NPSYZFOGEPYHIL-RIKCKFAHSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (1S,5R)-3-[(2-methoxyphenyl)methyl]-7-(4-pyridin-4-ylphenyl)-3,6-diazabicyclo[3.1.1]heptane (CHEBI:125103) is a piperidines (CHEBI:26151) |
| Manual Xrefs | Databases |
|---|---|
| LSM-36565 | LINCS |