EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H29N3 |
| Net Charge | 0 |
| Average Mass | 347.506 |
| Monoisotopic Mass | 347.23615 |
| SMILES | c1cc(-c2ccc(C3[C@H]4CNC[C@@H]3N4CC3CCCCC3)cc2)ccn1 |
| InChI | InChI=1S/C23H29N3/c1-2-4-17(5-3-1)16-26-21-14-25-15-22(26)23(21)20-8-6-18(7-9-20)19-10-12-24-13-11-19/h6-13,17,21-23,25H,1-5,14-16H2/t21-,22+,23? |
| InChIKey | JAONVPPHLACSCW-AIZNXBIQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (1S,5R)-6-(cyclohexylmethyl)-7-(4-pyridin-4-ylphenyl)-3,6-diazabicyclo[3.1.1]heptane (CHEBI:129859) is a piperidines (CHEBI:26151) |
| Manual Xrefs | Databases |
|---|---|
| LSM-41410 | LINCS |