Products 76663-56-4
CAS 76663-56-4 is the registry number for 3-O-(2,3-Dimethylbutanoyl)-13-O-decanoylingenol. Offered by: MedChemExpress. Available pack sizes: Get quote.
[(1S,4S,5S,6R,9S,10R,12S,14R)-4-(2,3-dimethylbutanoyloxy)-5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxo-12-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] decanoate (CAS 76663-56-4) is a chemical compound with the molecular formula C36H56O8 and a molecular weight of 616.8 g/mol. IUPAC name: [(1S,4S,5S,6R,9S,10R,12S,14R)-4-(2,3-dimethylbutanoyloxy)-5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxo-12-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] decanoate. InChIKey: VHVJBYQIZINFQS-YJQDPXNASA-N.
| Molecular formula | C36H56O8 |
|---|---|
| Molecular weight | 616.8 g/mol |
| IUPAC name | [(1S,4S,5S,6R,9S,10R,12S,14R)-4-(2,3-dimethylbutanoyloxy)-5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxo-12-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] decanoate |
| InChIKey | VHVJBYQIZINFQS-YJQDPXNASA-N |
| SMILES | CCCCCCCCCC(=O)O[C@@]12C[C@H]([C@]34C=C([C@@H]([C@]3([C@@H](C(=C[C@@H]([C@@H]1C2(C)C)C4=O)CO)O)O)OC(=O)C(C)C(C)C)C)C |
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