Sesquiterpene lactone TS-7
8-hydroxy-8a-methyl-3,5-dimethylidene-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one
Also Known As: Asperilin|SESQUITERPENE LACTONE TS-7|8-Hydroxy-8a-methyl-3,5-bis(methylene)decahydronaphtho[2,3-b]furan-2(3H)-one|8-hydroxy-8a-methyl-3,5-dimethylene-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one|8-hydroxy-8a-methyl-3,5-dimethylidene-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one
| Molecular Formula | C15H20O3 |
|---|---|
| Molecular Weight | 248.14125 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.14125 |
| Monoisotopic Mass | 248.14125 |
| Heavy Atoms | 18 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 7044-35-1 |
|---|---|
| SMILES | CC12CC3C(CC1C(=C)CCC2O)C(=C)C(=O)O3 |
| InChIKey | GAUPAOVCTWBVKC-UHFFFAOYSA-N |
Product Overview
Sesquiterpene lactone TS-7 (CAS 7044-35-1), with molecular formula C15H20O3 and molecular weight 248.14125 g/mol. IUPAC: 8-hydroxy-8a-methyl-3,5-dimethylidene-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one.
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