Products 2221029-54-3

CAS 2221029-54-3 appears in our catalog under these names: 16β–Hydroperoxyalisol B 23–acetate, 16β-hydroperoxyalisol B 23-acetate, ≥95%, ≥95%, 16β-Hydroperoxyalisol B 23-acetate. Offered by: GLPBio, Chemat, MedChemExpress. Available pack sizes: 5mg, 10mg, 5 mg, 1 mg.

Structural formula: {0} (CAS {1})

[(1S,3R)-1-[(2R)-3,3-dimethyloxiran-2-yl]-3-[(5R,8S,9S,10S,11S,14R,16S)-16-hydroperoxy-11-hydroxy-4,4,8,10,14-pentamethyl-3-oxo-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]butyl] acetate (CAS 2221029-54-3) is a chemical compound with the molecular formula C32H50O7 and a molecular weight of 546.7 g/mol. IUPAC name: [(1S,3R)-1-[(2R)-3,3-dimethyloxiran-2-yl]-3-[(5R,8S,9S,10S,11S,14R,16S)-16-hydroperoxy-11-hydroxy-4,4,8,10,14-pentamethyl-3-oxo-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]butyl] acetate. InChIKey: OPWQFBRURDPURF-XKFNBYHKSA-N.

Identity
Molecular formulaC32H50O7
Molecular weight546.7 g/mol
IUPAC name[(1S,3R)-1-[(2R)-3,3-dimethyloxiran-2-yl]-3-[(5R,8S,9S,10S,11S,14R,16S)-16-hydroperoxy-11-hydroxy-4,4,8,10,14-pentamethyl-3-oxo-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]butyl] acetate
InChIKeyOPWQFBRURDPURF-XKFNBYHKSA-N
SMILESC[C@H](C[C@@H]([C@@H]1C(O1)(C)C)OC(=O)C)C2=C3C[C@@H]([C@H]4[C@]5(CCC(=O)C([C@@H]5CC[C@@]4([C@]3(C[C@@H]2OO)C)C)(C)C)C)O

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