EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H28ClNO |
| Net Charge | 0 |
| Average Mass | 357.925 |
| Monoisotopic Mass | 357.18594 |
| SMILES | CC(OCCN1CCCCCC1)(c1ccccc1)c1ccc(Cl)cc1 |
| InChI | InChI=1S/C22H28ClNO/c1-22(19-9-5-4-6-10-19,20-11-13-21(23)14-12-20)25-18-17-24-15-7-2-3-8-16-24/h4-6,9-14H,2-3,7-8,15-18H2,1H3 |
| InChIKey | VBSPHZOBAOWFCL-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| setastine (CHEBI:135513) is a diarylmethane (CHEBI:51614) |
| Synonyms | Source |
|---|---|
| setastinum | DrugCentral |
| EGYT-2062 | DrugCentral |
| Manual Xrefs | Databases |
|---|---|
| 2437 | DrugCentral |
| Registry Numbers | Sources |
|---|---|
| CAS:64294-95-7 | DrugCentral |