EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H16N2O3 |
| Net Charge | 0 |
| Average Mass | 296.326 |
| Monoisotopic Mass | 296.11609 |
| SMILES | CC1(C)Oc2ccc(C#N)cc2[C@@H](n2ccccc2=O)[C@@H]1O |
| InChI | InChI=1S/C17H16N2O3/c1-17(2)16(21)15(19-8-4-3-5-14(19)20)12-9-11(10-18)6-7-13(12)22-17/h3-9,15-16,21H,1-2H3/t15-,16+/m1/s1 |
| InChIKey | MMSFHQSHXRMPLJ-CVEARBPZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| emakalim (CHEBI:748438) is a 1-benzopyran (CHEBI:38443) |
| INN | Source |
|---|---|
| emakalim | WHO MedNet |
| Citations |
|---|