3-(Dimethylamino)-16-hydroxy-14-methyl-4-methylidene-9,19-cyclopregnan-20-one
1-[(6S,8R,11S,14R,15R,16R)-6-(dimethylamino)-14-hydroxy-12,16-dimethyl-7-methylidene-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]ethanone
Also Known As: Cyclomicrobuxine|KST-1A0283|(3|A,5|A,9xi,10xi,14xi,16|A)-3-(dimethylamino)-16-hydroxy-14-methyl-4-methylidene-9,19-cyclopregnan-20-one|3-(Dimethylamino)-16-hydroxy-14-methyl-4-methylidene-9,19-cyclopregnan-20-one|(9xi,10xi,14xi)-3beta-(Dimethylamino)-16alpha-hydroxy-14-methyl-4-methylidene-5alpha-9,19-cyclopregnan-20-one
| Molecular Formula | C25H39NO2 |
|---|---|
| Molecular Weight | 385.29807 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 385.29807 |
| Monoisotopic Mass | 385.29807 |
| Heavy Atoms | 28 |
| Complexity | 745.0 |
Chemical Identifiers
| CAS Number | 3296-11-5 |
|---|---|
| SMILES | CC(=O)[C@H]1[C@@H](CC2([C@@]1(CCC34[C@H]2CC[C@@H]5C3(C4)CC[C@@H](C5=C)N(C)C)C)C)O |
| InChIKey | GNRVDDAXIDKEFJ-QASJIEDTSA-N |
Product Overview
3-(Dimethylamino)-16-hydroxy-14-methyl-4-methylidene-9,19-cyclopregnan-20-one (CAS 3296-11-5), with molecular formula C25H39NO2 and molecular weight 385.29807 g/mol. IUPAC: 1-[(6S,8R,11S,14R,15R,16R)-6-(dimethylamino)-14-hydroxy-12,16-dimethyl-7-methylidene-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]ethanone.
3-(Dimethylamino)-16-hydroxy-14-methyl-4-methylidene-9,19-cyclopregnan-20-one is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »