Bilobalide
(1S,4R,7R,8S,9R,11S)-9-tert-butyl-7,9-dihydroxy-3,5,12-trioxatetracyclo[6.6.0.01,11.04,8]tetradecane-2,6,13-trione
| Molecular Formula | C15H18O8 |
|---|---|
| Molecular Weight | 326.3 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 119.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 326.10016 |
| Heavy Atoms | 23 |
| Complexity | 650.0 |
Chemical Identifiers
| CAS Number | 33570-04-6 |
|---|---|
| SMILES | CC(C)(C)C1(CC2C3(C14C(C(=O)OC4OC3=O)O)CC(=O)O2)O |
| InChIKey | MOLPUWBMSBJXER-YDGSQGCISA-N |
📖 Product Overview
Bilobalide (CAS: 33570-04-6) is a chemical compound with molecular formula C15H18O8 and molecular weight 326.3 g/mol. Its IUPAC systematic name is (1S,4R,7R,8S,9R,11S)-9-tert-butyl-7,9-dihydroxy-3,5,12-trioxatetracyclo[6.6.0.01,11.04,8]tetradecane-2,6,13-trione.
MOLPUWBMSBJXER-YDGSQGCISA-N.
SMILES: CC(C)(C)C1(CC2C3(C14C(C(=O)OC4OC3=O)O)CC(=O)O2)O.
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