Farformolide A
[(4aR,5R,6S,8aS,9aS)-8a-hydroxy-3,4a,5-trimethyl-2-oxo-5,6,7,8,9,9a-hexahydro-4H-benzo[f][1]benzofuran-6-yl] (Z)-2-methylbut-2-enoate
Also Known As: Farformolide A|2-Butenoic acid, 2-methyl-, (4aR,5R,6S,8aS,9aS)-2,4,4a,5,6,7,8,8a,9,9a-decahydro-8a-hydroxy-3,4a,5-trimethyl-2-oxonaphtho(2,3-b)furan-6-yl ester, (2Z)-|[(4aR,5R,6S,8aS,9aS)-8a-hydroxy-3,4a,5-trimethyl-2-oxo-5,6,7,8,9,9a-hexahydro-4H-benzo[f][1]benzofuran-6-yl] (Z)-2-methylbut-2-enoate
| Molecular Formula | C20H28O5 |
|---|---|
| Molecular Weight | 348.19366 g/mol |
| LogP | 3.0674 |
| Topological Polar Surface Area | 72.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 348.19366 |
| Monoisotopic Mass | 348.19366 |
| Heavy Atoms | 25 |
| Complexity | 675.574 |
Chemical Identifiers
| CAS Number | 69618-92-4 |
|---|---|
| SMILES | C/C=C(/C)\C(=O)O[C@H]1CC[C@@]2(C[C@H]3C(=C(C(=O)O3)C)C[C@@]2([C@H]1C)C)O |
Product Overview
Farformolide A (CAS 69618-92-4), with molecular formula C20H28O5 and molecular weight 348.19366 g/mol. IUPAC: [(4aR,5R,6S,8aS,9aS)-8a-hydroxy-3,4a,5-trimethyl-2-oxo-5,6,7,8,9,9a-hexahydro-4H-benzo[f][1]benzofuran-6-yl] (Z)-2-methylbut-2-enoate.
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