EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H33N3O3 |
| Net Charge | 0 |
| Average Mass | 411.546 |
| Monoisotopic Mass | 411.25219 |
| SMILES | CC=Cc1ccc([C@@H]2[C@@H](CO)N(C(C)=O)C23CN(C(=O)NC2CCCCC2)C3)cc1 |
| InChI | InChI=1S/C24H33N3O3/c1-3-7-18-10-12-19(13-11-18)22-21(14-28)27(17(2)29)24(22)15-26(16-24)23(30)25-20-8-5-4-6-9-20/h3,7,10-13,20-22,28H,4-6,8-9,14-16H2,1-2H3,(H,25,30)/t21-,22-/m1/s1 |
| InChIKey | NJFOSNPDZVFYRA-FGZHOGPDSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-39204 (CHEBI:127647) is a azetidines (CHEBI:38777) |
| LSM-39204 (CHEBI:127647) is a benzenes (CHEBI:22712) |
| LSM-39204 (CHEBI:127647) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-39204 | LINCS |