(25r)-5a-Spirostan-3b-ol
(1R,2S,4S,5'R,6R,7S,9S,12S,13S,16S,18S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-ol
Also Known As: Tigogenin|(25r)-5a-spirostan-3b-ol|5-alpha-Spirostan-3-beta-ol|KST-1A8394|(25R)-5alpha-Spirostan-3beta-ol|(5alpha,25R)-Spirostan-3beta-ol|EINECS 201-041-9|5alpha-Spirostan-3beta-ol, (25R)-|(3|A,5|A,17xi,25r)-spirostan-3-ol|(3-beta,5-alpha,25R)-Spirostan-3-ol|5-alpha-Spirostan-3-beta-ol, (25R)-|Spirostan-3-ol, (3beta,5alpha,25R)-
| Molecular Formula | C27H44O3 |
|---|---|
| Molecular Weight | 416.32904 g/mol |
| LogP | 5.79 |
| Topological Polar Surface Area | 38.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 416.32904 |
| Heavy Atoms | 30 |
| Complexity | 683.6 |
Chemical Identifiers
| CAS Number | 77-60-1 |
|---|---|
| SMILES | C[C@@H]1CC[C@@]2([C@H](C3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1 |
Product Overview
(25r)-5a-Spirostan-3b-ol (CAS 77-60-1), with molecular formula C27H44O3 and molecular weight 416.32904 g/mol. IUPAC: (1R,2S,4S,5'R,6R,7S,9S,12S,13S,16S,18S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-ol.
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