EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C26H37N3O3 |
| Net Charge | 0 |
| Average Mass | 439.600 |
| Monoisotopic Mass | 439.28349 |
| SMILES | CC=Cc1ccc([C@H]2[C@@H](CO)N(C(=O)C3CCCCC3)C23CN(C(=O)NC(C)C)C3)cc1 |
| InChI | InChI=1S/C26H37N3O3/c1-4-8-19-11-13-20(14-12-19)23-22(15-30)29(24(31)21-9-6-5-7-10-21)26(23)16-28(17-26)25(32)27-18(2)3/h4,8,11-14,18,21-23,30H,5-7,9-10,15-17H2,1-3H3,(H,27,32)/t22-,23+/m1/s1 |
| InChIKey | UVYBUCSZKIUQRS-PKTZIBPZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-40925 (CHEBI:129374) is a azetidines (CHEBI:38777) |
| LSM-40925 (CHEBI:129374) is a benzenes (CHEBI:22712) |
| LSM-40925 (CHEBI:129374) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-40925 | LINCS |