Perhydrohistrionicotoxin
(2R,6R,10S,11S)-11-butyl-2-pentyl-1-azaspiro[5.5]undecan-10-ol
Also Known As: Perhydrohistrionicotoxin|H(12)-Htx|(-)-Perhydrohistrionicotoxin|KST-1A4825|(2r,6r,7s,8s)-7-butyl-2-pentyl-1-azaspiro[5.5]undecan-8-ol|7-Butyl-2-pentyl-1-azaspiro[5.5]undecan-8-ol|(2R,6R,10S,11S)-11-butyl-2-pentyl-1-azaspiro[5.5]undecan-10-ol|1-Azaspiro(5.5)undecan-8-ol, 7-butyl-2-pentyl-, (2R,6R,7S,8S)-|(2R,6R,7S,8S)-2-Pentyl-7-butyl-1-azaspiro[5.5]undecane-8-ol|(6R)-2alpha-Pentyl-7alpha-butyl-1-azaspiro[5.5]undecane-8beta-ol|(6R)-7alpha-Butyl-2alpha-pentyl-1-azaspiro[5.5]undecane-8beta-ol|1-Azaspiro(5.5)undecan-8-ol, 7-butyl-2-pentyl-, (6R-(6alpha(R*),7beta,8alpha))-|(2R,6R)-7alpha-Butyl-2alpha-pentyl-1-azaspiro[5.5]undecan-8beta-ol|(4R,6R,10S,11S)-11-butyl-4-pentyl-5-azaspiro[5.5]undecan-10-ol
| Molecular Formula | C19H37NO |
|---|---|
| Molecular Weight | 295.2875 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 32.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 295.2875 |
| Heavy Atoms | 21 |
| Complexity | 289.3 |
Chemical Identifiers
| CAS Number | 40709-29-3 |
|---|---|
| SMILES | CCCCC[C@@H]1CCC[C@@]2(N1)CCC[C@@H]([C@H]2CCCC)O |
Product Overview
Perhydrohistrionicotoxin (CAS 40709-29-3), with molecular formula C19H37NO and molecular weight 295.2875 g/mol. IUPAC: (2R,6R,10S,11S)-11-butyl-2-pentyl-1-azaspiro[5.5]undecan-10-ol.
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