6,9a-dimethyl-1,3-dioxo-12-(propan-2-yl)tetradecahydro-1H-3b,11-ethenophenanthro[1,2-c]furan-6-carboxylic acid
Chemical Structure Depiction of
6,9a-dimethyl-1,3-dioxo-12-(propan-2-yl)tetradecahydro-1H-3b,11-ethenophenanthro[1,2-c]furan-6-carboxylic acid
6,9a-dimethyl-1,3-dioxo-12-(propan-2-yl)tetradecahydro-1H-3b,11-ethenophenanthro[1,2-c]furan-6-carboxylic acid
Compound characteristics
| Compound ID: | 5610-0065 |
| Compound Name: | 6,9a-dimethyl-1,3-dioxo-12-(propan-2-yl)tetradecahydro-1H-3b,11-ethenophenanthro[1,2-c]furan-6-carboxylic acid |
| Molecular Weight: | 400.51 |
| Molecular Formula: | C24 H32 O5 |
| Smiles: | CC(C)C1=CC23CCC4C(C)(CCCC4(C)C(O)=O)C3CC1C1C2C(=O)OC1=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5388 |
| logD: | 1.2458 |
| logSw: | -4.2817 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.725 |
| InChI Key: | FEPCMSPFPMPWJK-UHFFFAOYSA-N |