rel-(3R,3aR,4S,9aS,9bR)-4-hydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione
Chemical Structure Depiction of
rel-(3R,3aR,4S,9aS,9bR)-4-hydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione
rel-(3R,3aR,4S,9aS,9bR)-4-hydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione
Compound characteristics
| Compound ID: | 0115-0006 |
| Compound Name: | rel-(3R,3aR,4S,9aS,9bR)-4-hydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione |
| Molecular Weight: | 262.3 |
| Molecular Formula: | C15 H18 O4 |
| Smiles: | [H][C@]12C(C)=CC(C1=C(C)C[C@@H]([C@@]1([H])[C@@H](C)C(=O)O[C@@H]12)O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2571 |
| logD: | 1.2571 |
| logSw: | -1.164 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.123 |
| InChI Key: | YMUOZXZDDBRJEP-UNBQBUAKSA-N |