Ziniolide
(3aS,5aR,8aR,9aR)-8-methyl-1,5-dimethylidene-4,5a,6,8a,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-2-one
Also Known As: Ziniolide|Silacyclobutane, octachloro-|Azuleno(6,5-b)furan-2(3H)-one, 3a,4,4a,7,7a,8,9,9a-octahydro-5-methyl-3,8-bis(methylene)-, (3aR,4aR,7aR,9aS)-|(3aS,5aR,8aR,9aR)-8-methyl-1,5-dimethylidene-4,5a,6,8a,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-2-one|5-methyl-3,8-dimethylidene-3a,4,4a,7,7a,8,9,9a-octahydroazuleno[6,5-b]furan-2(3h)-one|(3aR,4aR,7aR,9aS)-5-Methyl-3,8-dimethylidene-3a,4,4a,7,7a,8,9,9a-octahydroazuleno[6,5-b]furan-2(3H)-one
| Molecular Formula | C15H18O2 |
|---|---|
| Molecular Weight | 230.13068 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 230.13068 |
| Monoisotopic Mass | 230.13068 |
| Heavy Atoms | 17 |
| Complexity | 444.0 |
Chemical Identifiers
| CAS Number | 73020-91-4 |
|---|---|
| SMILES | CC1=CC[C@@H]2[C@H]1C[C@H]3[C@H](CC2=C)OC(=O)C3=C |
| InChIKey | KREYKRAJLBRHAZ-FQUUOJAGSA-N |
Product Overview
Ziniolide (CAS 73020-91-4), with molecular formula C15H18O2 and molecular weight 230.13068 g/mol. IUPAC: (3aS,5aR,8aR,9aR)-8-methyl-1,5-dimethylidene-4,5a,6,8a,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-2-one.
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