Glabellin
6,9-dimethyl-3-methylidene-4,6a,7,9,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2,8-dione
Also Known As: Glabellin|6,9-dimethyl-3-methylidene-4,6a,7,9,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2,8-dione|6,9-dimethyl-3-methylidene-4,6a,7,9,9a,9b-hexahydro-3aH-azuleno(4,5-b)furan-2,8-dione|6,9-Dimethyl-3-methylene-3a,6a,7,9,9a,9b-hexahydroazuleno[4,5-b]furan-2,8(3H,4H)-dione #
CAS: 85993-31-3
| Molecular Formula | C15H18O3 |
|---|---|
| Molecular Weight | 246.1256 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 246.1256 |
| Monoisotopic Mass | 246.1256 |
| Heavy Atoms | 18 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 85993-31-3 |
|---|---|
| SMILES | CC1C2C(CC1=O)C(=CCC3C2OC(=O)C3=C)C |
| InChIKey | VKILWIKFZQHLPU-UHFFFAOYSA-N |
Product Overview
Glabellin (CAS 85993-31-3), with molecular formula C15H18O3 and molecular weight 246.1256 g/mol. IUPAC: 6,9-dimethyl-3-methylidene-4,6a,7,9,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-2,8-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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