Products 67696-82-6
CAS 67696-82-6 is the registry number for Acrihellin. Offered by: MedChemExpress. Available pack sizes: Get quote.
[(3S,5S,8R,9S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(6-oxopyran-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-methylbut-2-enoate (CAS 67696-82-6) is a chemical compound with the molecular formula C29H38O7 and a molecular weight of 498.6 g/mol. IUPAC name: [(3S,5S,8R,9S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(6-oxopyran-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-methylbut-2-enoate. InChIKey: RIOSSPWEPWYRLD-SBQWKNPYSA-N.
| Molecular formula | C29H38O7 |
|---|---|
| Molecular weight | 498.6 g/mol |
| IUPAC name | [(3S,5S,8R,9S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(6-oxopyran-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-methylbut-2-enoate |
| InChIKey | RIOSSPWEPWYRLD-SBQWKNPYSA-N |
| SMILES | CC(=CC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@@]4([C@H](CC[C@@]4([C@@H]3CC[C@@]2(C1)O)O)C5=COC(=O)C=C5)C)C=O)C |
Computed by PubChem (NCBI)
Synonyms:
Acrihellin, Acrihelina, Acrihelline, Acrihellinum, 3beta,5,14-Trihydroxy-19-oxo-5beta-bufa-20,22-dienolide 3-(3-methylcrotonate), 3 beta,5,14-trihydroxy-19-oxo-5 beta-bufa-20,22-dienolide-3-(3-methylcrotonate), Acrihellin [INN], Acrihelina [Spanish], Acrihelina [INN-Spanish], Acrihelline [INN-French]