EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H34N2O3 |
| Net Charge | 0 |
| Average Mass | 398.547 |
| Monoisotopic Mass | 398.25694 |
| SMILES | CC=Cc1ccc([C@@H]2[C@@H](CO)N(C(=O)C3CCC3)[C@H]2CN(CC)C(=O)CC)cc1 |
| InChI | InChI=1S/C24H34N2O3/c1-4-8-17-11-13-18(14-12-17)23-20(15-25(6-3)22(28)5-2)26(21(23)16-27)24(29)19-9-7-10-19/h4,8,11-14,19-21,23,27H,5-7,9-10,15-16H2,1-3H3/t20-,21+,23-/m0/s1 |
| InChIKey | TZEUCKCBNOSTOD-XJUOHMSHSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-38010 (CHEBI:126446) is a azetidines (CHEBI:38777) |
| LSM-38010 (CHEBI:126446) is a benzenes (CHEBI:22712) |
| LSM-38010 (CHEBI:126446) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-38010 | LINCS |