14-Hydroxy-3-oxocarda-1,4,20(22)-trienolide
3-[(10R,13R,14S)-14-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Also Known As: delta(sup 1,4)-Digitoxigenone, BRN 1298204, 14-Hydroxy-3-oxocarda-1,4,20(22)-trienolide, CARDA-1,4,20(22)-TRIENOLIDE, 14-HYDROXY-3-OXO-, (8xi,9xi)-14-Hydroxy-3-oxo-17xi-carda-1,4,20(22)-trienolide, 3-[(10R,13R,14S)-14-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
| Molecular Formula | C23H28O4 |
|---|---|
| Molecular Weight | 368.19876 g/mol |
| LogP | 3.51 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 368.19876 |
| Heavy Atoms | 27 |
| Complexity | 820 |
Chemical Identifiers
| CAS Number | 13328-63-7 |
|---|---|
| SMILES | C[C@]12CCC3C([C@]1(CCC2C4=CC(=O)OC4)O)CCC5=CC(=O)C=C[C@]35C |
Product Overview
14-Hydroxy-3-oxocarda-1,4,20(22)-trienolide (CAS 13328-63-7), with molecular formula C23H28O4 and molecular weight 368.19876 g/mol. IUPAC: 3-[(10R,13R,14S)-14-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one.
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