Products 208042-42-6
CAS 208042-42-6 appears in our catalog under these names: Nalfurafine N-Oxide, Nalfurafine N-Oxide (1.0mg/ml in Acetonitrile). Offered by: Chemat Brand, TRC. Available pack sizes: on request, 50mg, 5mg, 5x1ml.
(E)-N-[(4R,4aS,7R,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-3-oxido-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-yl]-3-(furan-3-yl)-N-methylprop-2-enamide (CAS 208042-42-6) is a chemical compound with the molecular formula C28H32N2O6 and a molecular weight of 492.6 g/mol. IUPAC name: (E)-N-[(4R,4aS,7R,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-3-oxido-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-yl]-3-(furan-3-yl)-N-methylprop-2-enamide. InChIKey: MWDGJQVNEHFHMK-MBBMFRJGSA-N.
| Molecular formula | C28H32N2O6 |
|---|---|
| Molecular weight | 492.6 g/mol |
| IUPAC name | (E)-N-[(4R,4aS,7R,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-3-oxido-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-yl]-3-(furan-3-yl)-N-methylprop-2-enamide |
| InChIKey | MWDGJQVNEHFHMK-MBBMFRJGSA-N |
| SMILES | CN([C@@H]1CC[C@]2([C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)O)CC[N+]3(CC6CC6)[O-])O)C(=O)/C=C/C7=COC=C7 |
Computed by PubChem (NCBI)