Cordifene
[(1R,2R,6S,7S,9S,11S,12S)-11-hydroxy-4-methyl-10,15-dimethylidene-14-oxo-5,8,13-trioxatetracyclo[10.3.0.04,6.07,9]pentadecan-2-yl] (Z)-2-methylbut-2-enoate
Also Known As: Cordifene|Erlancorin|[(1R,2R,6S,7S,9S,11S,12S)-11-Hydroxy-4-methyl-10,15-dimethylidene-14-oxo-5,8,13-trioxatetracyclo[10.3.0.04,6.07,9]pentadecan-2-yl] (Z)-2-methylbut-2-enoate|2-Butenoic acid, 2-methyl-, dodecahydro-4-hydroxy-9a-methyl-3,7-bis(methylene)-6-oxobisoxireno(5,6:7,8)cyclodeca(1,2-b)furan-8-yl ester, (1aR-(1aR*,1bS*,2aS*,4S*,4aS*,7aR*,8S*(Z),9aR*))-|2-Butenoic acid,2-methyl-,dodecahydro-4-hydroxy-9a-methyl-3,7-bis(methylene)-6-oxobisoxireno(5,6:7,8)cyclodeca(1,2-b)furan-8-yl ester,(1aR-(1aR*,1bS*,2aS*,4S*,4aS*,7aR*,8S*(Z),9aR*))
| Molecular Formula | C20H24O7 |
|---|---|
| Molecular Weight | 376.1522 g/mol |
| LogP | 1.2079 |
| Topological Polar Surface Area | 97.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.1522 |
| Monoisotopic Mass | 376.1522 |
| Heavy Atoms | 27 |
| Complexity | 768.29193 |
Chemical Identifiers
| CAS Number | 65522-32-9 |
|---|---|
| SMILES | C/C=C(/C)\C(=O)O[C@@H]1CC2([C@@H](O2)[C@@H]3[C@@H](O3)C(=C)[C@@H]([C@@H]4[C@@H]1C(=C)C(=O)O4)O)C |
Product Overview
Cordifene (CAS 65522-32-9), with molecular formula C20H24O7 and molecular weight 376.1522 g/mol. IUPAC: [(1R,2R,6S,7S,9S,11S,12S)-11-hydroxy-4-methyl-10,15-dimethylidene-14-oxo-5,8,13-trioxatetracyclo[10.3.0.04,6.07,9]pentadecan-2-yl] (Z)-2-methylbut-2-enoate.
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