Products 54706-97-7
CAS 54706-97-7 is the registry number for 5-O-Benzoyl-20-deoxyingenol. Offered by: MedChemExpress. Available pack sizes: 1 mg, 5 mg.
[(1S,4S,5R,6R,9S,10R,12R,14R)-4,5-dihydroxy-3,7,11,11,14-pentamethyl-15-oxo-6-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] benzoate (CAS 54706-97-7) is a chemical compound with the molecular formula C27H32O5 and a molecular weight of 436.5 g/mol. IUPAC name: [(1S,4S,5R,6R,9S,10R,12R,14R)-4,5-dihydroxy-3,7,11,11,14-pentamethyl-15-oxo-6-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] benzoate. InChIKey: KLMKTIKJNCIWMW-JTOBKRNASA-N.
| Molecular formula | C27H32O5 |
|---|---|
| Molecular weight | 436.5 g/mol |
| IUPAC name | [(1S,4S,5R,6R,9S,10R,12R,14R)-4,5-dihydroxy-3,7,11,11,14-pentamethyl-15-oxo-6-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] benzoate |
| InChIKey | KLMKTIKJNCIWMW-JTOBKRNASA-N |
| SMILES | C[C@@H]1C[C@@H]2[C@@H](C2(C)C)[C@@H]3C=C([C@H]([C@]4([C@@]1(C3=O)C=C([C@@H]4O)C)O)OC(=O)C5=CC=CC=C5)C |
Computed by PubChem (NCBI)
Synonyms:
orb2564211, 20-Deoxy,5-benzoyl-Ingenol, 95%