Methylatropine
[(1S,5R)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] (2R)-3-hydroxy-2-phenylpropanoate
Also Known As: Methylatropine|N-Methylatropine|Methylatropinium|Atropine methobromide|Atropine methonitrate|methylatropine-nitrate|Lopac-A-6883|8-Methylatropinium nitrate|NCIStruc1_001069|NCIStruc2_001378|METHYLATROPINE NITRATE|NCGC00015080-01|NCGC00015080-02|NCGC00015080-03|(3(R)-endo)-3-(3-Hydroxy-1-oxo-2-phenylpropoxy)-8,8-dimethyl-8-azoniabicyclo(3.2.1)octane|(1R,3R,5S)-3-{[(2R)-3-hydroxy-2-phenylpropanoyl]oxy}-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium|8-Azoniabicyclo(3.2.1)octane, 3-(3-hydroxy-1-oxo-2-phenylpropoxy)-8,8-dimethyl-, (3(R)-endo)-|(1beta,3alpha,5beta)-3-[[(R)-3-Hydroxy-1-oxo-2-phenylpropyl]oxy]-8,8-dimethyl-8-azoniabicyclo[3.2.1]octane|(1R,5S)-3alpha-[(R)-3-Hydroxy-1-oxo-2-phenylpropoxy]-8,8-dimethyl-8-azoniabicyclo[3.2.1]octane|(2R)-3-hydroxy-2-phenyl-propionic acid [(1R,5S)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] ester;iodide|(2R)-3-hydroxy-2-phenylpropanoic acid [(1R,5S)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] ester;iodide|(3-endo)-3-[(2R)-3-Hydroxy-1-oxo-2-phenylpropoxy]-8,8-dimethyl-8-azoniabicyclo[3.2.1]octane|[(1R,5S)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] (2R)-3-hydroxy-2-phenylpropanoate|[(1R,5S)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] (2R)-3-hydroxy-2-phenylpropanoate;iodide|[(1R,5S)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] (2R)-3-oxidanyl-2-phenyl-propanoate;iodide|[(1S,5R)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] (2R)-3-hydroxy-2-phenylpropanoate
| Molecular Formula | C18H26NO3+ |
|---|---|
| Molecular Weight | 304.19125 g/mol |
| LogP | 2.0755 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.19125 |
| Monoisotopic Mass | 304.19125 |
| Heavy Atoms | 22 |
| Complexity | 512.3936 |
Chemical Identifiers
| CAS Number | 57-69-2 |
|---|---|
| SMILES | C[N+]1([C@@H]2CC[C@H]1CC(C2)OC(=O)[C@@H](CO)C3=CC=CC=C3)C |
Product Overview
Methylatropine (CAS 57-69-2), with molecular formula C18H26NO3+ and molecular weight 304.19125 g/mol. IUPAC: [(1S,5R)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] (2R)-3-hydroxy-2-phenylpropanoate.
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