EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H26N2O4S |
| Net Charge | 0 |
| Average Mass | 378.494 |
| Monoisotopic Mass | 378.16133 |
| SMILES | CC=Cc1ccc([C@@H]2[C@H](CO)N(S(=O)(=O)CC)C23CN(C(C)=O)C3)cc1 |
| InChI | InChI=1S/C19H26N2O4S/c1-4-6-15-7-9-16(10-8-15)18-17(11-22)21(26(24,25)5-2)19(18)12-20(13-19)14(3)23/h4,6-10,17-18,22H,5,11-13H2,1-3H3/t17-,18+/m0/s1 |
| InChIKey | FWNIWTZANIWACG-ZWKOTPCHSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-39182 (CHEBI:127625) is a azetidines (CHEBI:38777) |
| LSM-39182 (CHEBI:127625) is a benzenes (CHEBI:22712) |
| LSM-39182 (CHEBI:127625) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-39182 | LINCS |