EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H24N4O3 |
| Net Charge | 0 |
| Average Mass | 392.459 |
| Monoisotopic Mass | 392.18484 |
| SMILES | CCOCc1ccc(C)c(Nc2ncc(-c3ccc(N4CCNC4=O)cc3)o2)c1 |
| InChI | InChI=1S/C22H24N4O3/c1-3-28-14-16-5-4-15(2)19(12-16)25-21-24-13-20(29-21)17-6-8-18(9-7-17)26-11-10-23-22(26)27/h4-9,12-13H,3,10-11,14H2,1-2H3,(H,23,27)(H,24,25) |
| InChIKey | ZBAFYGYLXHEICJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| ab-8939 (CHEBI:758786) is a imidazolidines (CHEBI:38261) |
| Synonyms | Source |
|---|---|
| Ab-8939 | ChEMBL |
| AB8939 | ChEMBL |