EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H37N3O2 |
| Net Charge | 0 |
| Average Mass | 399.579 |
| Monoisotopic Mass | 399.28858 |
| SMILES | CC=Cc1ccc([C@H]2[C@@H](CO)N(CC3CCCC3)[C@@H]2CNC(=O)NC(C)C)cc1 |
| InChI | InChI=1S/C24H37N3O2/c1-4-7-18-10-12-20(13-11-18)23-21(14-25-24(29)26-17(2)3)27(22(23)16-28)15-19-8-5-6-9-19/h4,7,10-13,17,19,21-23,28H,5-6,8-9,14-16H2,1-3H3,(H2,25,26,29)/t21-,22-,23-/m1/s1 |
| InChIKey | YXKXIPILDABBBC-DNVJHFABSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-39513 (CHEBI:127957) is a azetidines (CHEBI:38777) |
| LSM-39513 (CHEBI:127957) is a benzenes (CHEBI:22712) |
| LSM-39513 (CHEBI:127957) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-39513 | LINCS |