Unii-iae4R6RO1N
(3aS,5R,5aS,7R,8R,8aS,9aR)-7,8-dihydroxy-5,8a-dimethyl-1-methylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one
Also Known As: Geigerinin|Odoratin|Neohymenoratin|3aR-(3alpha)-isomer of odoratin|(3aS,5R,5aS,7R,8R,8aS,9aR)-7,8-dihydroxy-5,8a-dimethyl-1-methylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one|5,6-Dihydroxy-4a,8-dimethyl-3-methylidenedecahydroazuleno[6,5-b]furan-2(3H)-one|(3AR,4AS,5R,6R,7AS,8R,9AS)-5,6-DIHYDROXY-4A,8-DIMETHYL-3-METHYLIDENE-DODECAHYDROAZULENO[6,5-B]FURAN-2-ONE|(3aR,4aS,5R,6R,7aS,8R,9aS)-5,6-Dihydroxy-4a,8-dimethyl-3-methylidenedecahydroazuleno[6,5-b]furan-2(3H)-one|(3aR,4aS,7aalpha,9abeta)-Decahydro-4abeta,8alpha-dimethyl-3-methylene-5beta,6alpha-dihydroxyazuleno[6,5-b]furan-2(3H)-one|Azuleno(6,5-b)furan-2(3H)-one, decahydro-5,6-dihydroxy-4a,8-dimethyl-3-methylene-, (3aR-(3aalpha,4abeta,5beta,6alpha,7aalpha,8alpha,9abeta))-|Azuleno[6,5-b]furan-2(3H)-one, decahydro-5,6-dihydroxy-4a,8-dimethyl-3-methylene-, stereoisomer
| Molecular Formula | C15H22O4 |
|---|---|
| Molecular Weight | 266.1518 g/mol |
| LogP | 1.2621 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 266.1518 |
| Monoisotopic Mass | 266.1518 |
| Heavy Atoms | 19 |
| Complexity | 431.8615 |
Chemical Identifiers
| CAS Number | 6902-72-3 |
|---|---|
| SMILES | C[C@@H]1C[C@H]2[C@H](C[C@]3([C@H]1C[C@H]([C@@H]3O)O)C)C(=C)C(=O)O2 |
Product Overview
Unii-iae4R6RO1N (CAS 6902-72-3), with molecular formula C15H22O4 and molecular weight 266.1518 g/mol. IUPAC: (3aS,5R,5aS,7R,8R,8aS,9aR)-7,8-dihydroxy-5,8a-dimethyl-1-methylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one.