3beta,5,14-Trihydroxy-19-(hydroxyimino)-5beta-card-20-enolide
4-[(3S,5S,8R,9S,10R,13R,14S,17R)-3,5,14-trihydroxy-10-(hydroxyiminomethyl)-13-methyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3H-furan-2-one
Also Known As: Strophanthidin oxime|NCI60_042082|(3beta,5beta)-3,5,14-Trihydroxy-19-(hydroxyimino)card-20-enolide|3beta,5,14-Trihydroxy-19-(hydroxyimino)-5beta-card-20-enolide|(3I(2),5I(2))-3,5,14-Trihydroxy-19-(hydroxyimino)card-20-enolide|4-[(3S,5S,8R,9S,10R,13R,14S,17R)-3,5,14-trihydroxy-10-(hydroxyiminomethyl)-13-methyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3H-furan-2-one
| Molecular Formula | C23H33NO6 |
|---|---|
| Molecular Weight | 419.23077 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 419.23077 |
| Monoisotopic Mass | 419.23077 |
| Heavy Atoms | 30 |
| Complexity | 812.0 |
Chemical Identifiers
| CAS Number | 6100-99-8 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@]1(CC[C@@H]2C4=COC(=O)C4)O)CC[C@]5([C@@]3(CC[C@@H](C5)O)C=NO)O |
| InChIKey | SLLODQQGCJRULY-HZXDTFASSA-N |
Product Overview
3beta,5,14-Trihydroxy-19-(hydroxyimino)-5beta-card-20-enolide (CAS 6100-99-8), with molecular formula C23H33NO6 and molecular weight 419.23077 g/mol. IUPAC: 4-[(3S,5S,8R,9S,10R,13R,14S,17R)-3,5,14-trihydroxy-10-(hydroxyiminomethyl)-13-methyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3H-furan-2-one.
3beta,5,14-Trihydroxy-19-(hydroxyimino)-5beta-card-20-enolide is a custom synthesis product. We offer services from milligram to kilogram scale.
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