EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H26N2O2 |
| Net Charge | 0 |
| Average Mass | 362.473 |
| Monoisotopic Mass | 362.19943 |
| SMILES | CC=Cc1ccc([C@H]2[C@H]3CN(Cc4ccccc4)CC(=O)N3[C@H]2CO)cc1 |
| InChI | InChI=1S/C23H26N2O2/c1-2-6-17-9-11-19(12-10-17)23-20-14-24(13-18-7-4-3-5-8-18)15-22(27)25(20)21(23)16-26/h2-12,20-21,23,26H,13-16H2,1H3/t20-,21+,23+/m1/s1 |
| InChIKey | PTKQWCOSPHHWRV-GIWBLDEGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-37829 (CHEBI:126263) is a azetidines (CHEBI:38777) |
| LSM-37829 (CHEBI:126263) is a benzenes (CHEBI:22712) |
| LSM-37829 (CHEBI:126263) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-37829 | LINCS |