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 | COc1cccc(-c2ccc(C3[C@@H]4CN(Cc5ccccn5)C[C@H]3N4)cc2)c1 |
| InChI | InChI=1S/C24H25N3O/c1-28-21-7-4-5-19(13-21)17-8-10-18(11-9-17)24-22-15-27(16-23(24)26-22)14-20-6-2-3-12-25-20/h2-13,22-24,26H,14-16H2,1H3/t22-,23+,24? |
| InChIKey | NGRUIDFBRMTHCY-VSGJHWFKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3-(2-pyridinylmethyl)-3,6-diazabicyclo[3.1.1]heptane (CHEBI:125049) is a piperidines (CHEBI:26151) |
| Manual Xrefs | Databases |
|---|---|
| LSM-36511 | LINCS |