20-alpha-Yohimban, hydrochloride
methyl (1S,15S,18R,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate;hydrochloride
Also Known As: Antagonil|allo-Yohimbine hydrochloride|allo-Yohimbin hydrochloride|20-alpha-Yohimban, hydrochloride
CAS: 75431-45-7
| Molecular Formula | C21H27ClN2O3 |
|---|---|
| Molecular Weight | 390.17102 g/mol |
| LogP | 3.0689 |
| Topological Polar Surface Area | 65.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 390.17102 |
| Monoisotopic Mass | 390.17102 |
| Heavy Atoms | 27 |
| Complexity | 851.06433 |
Chemical Identifiers
| CAS Number | 75431-45-7 |
|---|---|
| SMILES | COC(=O)[C@H]1[C@@H](CC[C@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C5=CC=CC=C5N4)O.Cl |
Product Overview
20-alpha-Yohimban, hydrochloride (CAS 75431-45-7), with molecular formula C21H27ClN2O3 and molecular weight 390.17102 g/mol. IUPAC: methyl (1S,15S,18R,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate;hydrochloride.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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