RefChem:1054716
1-[(1R)-1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-morpholin-4-ylpropan-2-ol;trihydrochloride
Also Known As: KST-1B2592|Emetine, 2'-(2-hydroxy-3-morpholinopropyl)-, trihydrochloride|2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-(2-hydroxy-3-morpholinopropyl)-1-isoquinolyl)methyl)-, trihydrochloride|2-Propanol, 1-(4-morpholinyl)-3-(6',7',10,11-tetramethoxyemetan-2'-yl)-, trihydrochloride|1-(morpholin-4-yl)-3-[(1'|A)-6',7',10,11-tetramethoxyemetan-2'-yl]propan-2-ol trihydrochloride|1-(Morpholin-4-yl)-3-(6',7',10,11-tetramethoxyemetan-2'-yl)propan-2-ol--hydrogen chloride (1/3)|Emetine, 2'-(2-hydroxy-3-morpholinopropyl)-, trihydrochloride (8CI)|1-[(1R)-1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-morpholin-4-ylpropan-2-ol trihydrochloride
| Molecular Formula | C36H56Cl3N3O6 |
|---|---|
| Molecular Weight | 731.3235 g/mol |
| LogP | 5.61 |
| Topological Polar Surface Area | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 731.3235 |
| Heavy Atoms | 48 |
| Complexity | 1316.2 |
Chemical Identifiers
| CAS Number | 26988-01-2 |
|---|---|
| SMILES | CC[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@@H]1C[C@@H]4C5=CC(=C(C=C5CCN4CC(CN6CCOCC6)O)OC)OC)OC)OC.Cl.Cl.Cl |
Product Overview
RefChem:1054716 (CAS 26988-01-2), with molecular formula C36H56Cl3N3O6 and molecular weight 731.3235 g/mol. IUPAC: 1-[(1R)-1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-morpholin-4-ylpropan-2-ol;trihydrochloride.
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