CAS 1217604-00-6 appears in our catalog under these names: Isosorbide-13C6 5-Mononitrate, Isosorbide mononitrate-13C6. Offered by: Chemat Brand, MedChemExpress. Available pack sizes: on request, 1 mg, 10 mg.
[(3S,3aR,6R,6aS)-3-hydroxy-2,3,3a,5,6,6a-hexahydro(2,3,4,5-13C4)furano[3,2-b](2,3,4,5-13C4)furan-6-yl] nitrate (CAS 1217604-00-6) is a chemical compound with the molecular formula C6H9NO6 and a molecular weight of 197.10 g/mol. IUPAC name: [(3S,3aR,6R,6aS)-3-hydroxy-2,3,3a,5,6,6a-hexahydro(2,3,4,5-13C4)furano[3,2-b](2,3,4,5-13C4)furan-6-yl] nitrate. InChIKey: YWXYYJSYQOXTPL-AEKYUDOOSA-N.
| Molecular formula | C6H9NO6 |
|---|---|
| Molecular weight | 197.10 g/mol |
| IUPAC name | [(3S,3aR,6R,6aS)-3-hydroxy-2,3,3a,5,6,6a-hexahydro(2,3,4,5-13C4)furano[3,2-b](2,3,4,5-13C4)furan-6-yl] nitrate |
| InChIKey | YWXYYJSYQOXTPL-AEKYUDOOSA-N |
| SMILES | [13CH2]1[13C@@H]([13C@@H]2[13C@H](O1)[13C@@H]([13CH2]O2)O[N+](=O)[O-])O |
Computed by PubChem (NCBI)