EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C29H37N3O5 |
| Net Charge | 0 |
| Average Mass | 507.631 |
| Monoisotopic Mass | 507.27332 |
| SMILES | COc1cc(NC(=O)C2=C(N3CCOCC3)C(=Cc3ccc(N(C)C)cc3)CCC2)cc(OC)c1OC |
| InChI | InChI=1S/C29H37N3O5/c1-31(2)23-11-9-20(10-12-23)17-21-7-6-8-24(27(21)32-13-15-37-16-14-32)29(33)30-22-18-25(34-3)28(36-5)26(19-22)35-4/h9-12,17-19H,6-8,13-16H2,1-5H3,(H,30,33) |
| InChIKey | ZCQLDWFUUYNVRY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[[4-(dimethylamino)phenyl]methylidene]-2-(4-morpholinyl)-N-(3,4,5-trimethoxyphenyl)-1-cyclohexenecarboxamide (CHEBI:104885) is a anilide (CHEBI:13248) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16247 | LINCS |