rel-(1R,2R,5R,6S,8aS)-6-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyloctahydro-2H-dispiro[naphthalene-1,2'-oxolane-5',3''-oxolan]-5''-one
Chemical Structure Depiction of
rel-(1R,2R,5R,6S,8aS)-6-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyloctahydro-2H-dispiro[naphthalene-1,2'-oxolane-5',3''-oxolan]-5''-one
rel-(1R,2R,5R,6S,8aS)-6-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyloctahydro-2H-dispiro[naphthalene-1,2'-oxolane-5',3''-oxolan]-5''-one
Compound characteristics
| Compound ID: | N088-0027 |
| Compound Name: | rel-(1R,2R,5R,6S,8aS)-6-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyloctahydro-2H-dispiro[naphthalene-1,2'-oxolane-5',3''-oxolan]-5''-one |
| Molecular Weight: | 352.47 |
| Molecular Formula: | C20 H32 O5 |
| Smiles: | C[C@@H]1CCC2[C@](C)(CC[C@@H]([C@@]2(C)CO)O)[C@@]12CCC1(CC(=O)OC1)O2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9655 |
| logD: | 1.9655 |
| logSw: | -2.5186 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.283 |
| InChI Key: | XCEIXRWKIFQZDC-APUXBEGXSA-N |