7-[(6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[(6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methoxy]-2H-1-benzopyran-2-one
7-[(6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | N025-0046 |
| Compound Name: | 7-[(6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C24 H30 O4 |
| Smiles: | CC1=CCC2C(C)(C)C(CCC2(C)C1COc1ccc2C=CC(=O)Oc2c1)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2622 |
| logD: | 5.2622 |
| logSw: | -5.1521 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.602 |
| InChI Key: | MCTDXPDDZLFJHR-ZQBSZGJXSA-N |