(1'RS)-3'-methyl-1,2,3,4,10,11-hexahydro-5H-spiro[benzo[d]benzo[1,2-b:5,4-b']dipyran-9,1'-cyclohexan]-5-one
Chemical Structure Depiction of
(1'RS)-3'-methyl-1,2,3,4,10,11-hexahydro-5H-spiro[benzo[d]benzo[1,2-b:5,4-b']dipyran-9,1'-cyclohexan]-5-one
(1'RS)-3'-methyl-1,2,3,4,10,11-hexahydro-5H-spiro[benzo[d]benzo[1,2-b:5,4-b']dipyran-9,1'-cyclohexan]-5-one
Compound characteristics
| Compound ID: | Y041-1357 |
| Compound Name: | (1'RS)-3'-methyl-1,2,3,4,10,11-hexahydro-5H-spiro[benzo[d]benzo[1,2-b:5,4-b']dipyran-9,1'-cyclohexan]-5-one |
| Molecular Weight: | 338.45 |
| Molecular Formula: | C22 H26 O3 |
| Smiles: | CC1CCC[C@]2(CCc3cc4C5CCCCC=5C(=O)Oc4cc3O2)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.995 |
| logD: | 5.995 |
| logSw: | -5.4067 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.8164 |
| InChI Key: | WVUOPDJQAXABCC-JDMGRSRBSA-N |