3-Aminospirostan-6-ol
(1R,2S,4S,5'R,7S,8R,9S,12S,13R,16S,18S,19S)-16-amino-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-19-ol
Also Known As: Isojuripidine|3-Aminospirostan-6-ol|KST-1A3345|(3|A,5|A,6|A,22xi,25r)-3-aminospirostan-6-ol|(22xi,25R)-3beta-Amino-5alpha-spirostan-6alpha-ol
CAS: 23656-00-0
| Molecular Formula | C27H45NO3 |
|---|---|
| Molecular Weight | 431.33994 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 64.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 431.33994 |
| Monoisotopic Mass | 431.33994 |
| Heavy Atoms | 31 |
| Complexity | 729.0 |
Chemical Identifiers
| CAS Number | 23656-00-0 |
|---|---|
| SMILES | C[C@@H]1CCC2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4C[C@@H]([C@@H]6[C@@]5(CC[C@@H](C6)N)C)O)C)C)OC1 |
| InChIKey | YQYXKZJKLISVTR-RMOAROBGSA-N |
Product Overview
3-Aminospirostan-6-ol (CAS 23656-00-0), with molecular formula C27H45NO3 and molecular weight 431.33994 g/mol. IUPAC: (1R,2S,4S,5'R,7S,8R,9S,12S,13R,16S,18S,19S)-16-amino-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-19-ol.
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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