EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | CH4O3S.C17H16N6O |
| Net Charge | 0 |
| Average Mass | 416.463 |
| Monoisotopic Mass | 416.12667 |
| SMILES | CS(=O)(=O)O.NC(N)=NC(=O)c1cnn(-c2cccc3ncccc23)c1C1CC1 |
| InChI | InChI=1S/C17H16N6O.CH4O3S/c18-17(19)22-16(24)12-9-21-23(15(12)10-6-7-10)14-5-1-4-13-11(14)3-2-8-20-13;1-5(2,3)4/h1-5,8-10H,6-7H2,(H4,18,19,22,24);1H3,(H,2,3,4) |
| InChIKey | LEHNUSLKIYRRQJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| zoniporide mesylate (CHEBI:752605) is a quinolines (CHEBI:26513) |
| Synonyms | Source |
|---|---|
| CP-597,396-27 | ChEMBL |
| CP-597396-27 | ChEMBL |
| Zoniporide mesilate | ChEMBL |
| Zoniporide mesylate | ChEMBL |