EMBL-EBI | Chemical Biology | ChEBI
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| Formula | CH4O3S.C23H24F7N3O |
| Net Charge | 0 |
| Average Mass | 587.558 |
| Monoisotopic Mass | 587.16887 |
| SMILES | CS(=O)(=O)O.Cc1cc(F)ccc1[C@H]1CNCCN1C(=O)N(C)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 |
| InChI | InChI=1S/C23H24F7N3O.CH4O3S/c1-13-8-18(24)4-5-19(13)20-12-31-6-7-33(20)21(34)32(3)14(2)15-9-16(22(25,26)27)11-17(10-15)23(28,29)30;1-5(2,3)4/h4-5,8-11,14,20,31H,6-7,12H2,1-3H3;1H3,(H,2,3,4)/t14-,20-;/m1./s1 |
| InChIKey | BHECXGHXWKHZOY-DXPOFMJKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| vestipitant mesylate (CHEBI:751155) is a piperazines (CHEBI:26144) |
| Synonyms | Source |
|---|---|
| GW-597588B | ChEMBL |
| GW597588B | ChEMBL |
| GW-597599B | ChEMBL |
| GW597599B | ChEMBL |
| Vestipitant mesilate | ChEMBL |
| Vestipitant mesylate | ChEMBL |