EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C27H26N4O |
| Net Charge | 0 |
| Average Mass | 422.532 |
| Monoisotopic Mass | 422.21066 |
| SMILES | O=C(NC1CCN(Cc2ccccc2)CC1)c1cc(-c2ccccn2)nc2ccccc12 |
| InChI | InChI=1S/C27H26N4O/c32-27(29-21-13-16-31(17-14-21)19-20-8-2-1-3-9-20)23-18-26(25-12-6-7-15-28-25)30-24-11-5-4-10-22(23)24/h1-12,15,18,21H,13-14,16-17,19H2,(H,29,32) |
| InChIKey | LSOIQFQNLHWNNY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[1-(phenylmethyl)-4-piperidinyl]-2-(2-pyridinyl)-4-quinolinecarboxamide (CHEBI:103921) is a piperidines (CHEBI:26151) |
| Manual Xrefs | Databases |
|---|---|
| LSM-15274 | LINCS |