Solasodenone
(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-ene-6,2'-piperidine]-16-one
Also Known As: SOLASODENONE|(22R,25R)-Spirosol-4-en-3-one|(25R)-22alpha-Spirosol-4-en-3-one|(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-ene-6,2'-piperidine]-16-one|(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethyl-5-oxaspiro[pentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-piperidin]-17-en-16-one|(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro(5-oxapentacyclo(10.8.0.02,9.04,8.013,18)icos-17-ene-6,2'-piperidine)-16-one
| Molecular Formula | C27H41NO2 |
|---|---|
| Molecular Weight | 411.31372 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 411.31372 |
| Monoisotopic Mass | 411.31372 |
| Heavy Atoms | 30 |
| Complexity | 790.0 |
Chemical Identifiers
| CAS Number | 17094-86-9 |
|---|---|
| SMILES | C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CCC6=CC(=O)CC[C@]56C)C)C)NC1 |
| InChIKey | XCAKPWXDUSEAEH-CLGLNXEMSA-N |
Product Overview
Solasodenone (CAS 17094-86-9), with molecular formula C27H41NO2 and molecular weight 411.31372 g/mol. IUPAC: (1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-ene-6,2'-piperidine]-16-one.
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