Products 1258-35-1

CAS 1258-35-1 appears in our catalog under these names: 5-Bromo-5Alpha-cholestane-3,6-diol 3-Acetate, >95% (HPLC), 5-Bromo-5a-cholestane-3,6-diol 3-Acetate, >95% (HPLC), 5-Bromo-5a-cholestane-3,6-diol 3-acetate. Offered by: TRC, Biosynth. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 250mg.

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

[(3R,5R,6R,8S,9S,10R,13R,14S)-5-bromo-6-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate (CAS 1258-35-1) is a chemical compound with the molecular formula C29H49BrO3 and a molecular weight of 525.6 g/mol. IUPAC name: [(3R,5R,6R,8S,9S,10R,13R,14S)-5-bromo-6-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate. InChIKey: QOKSSEORHJPLLF-LBPASEOFSA-N.

Identity
Molecular formulaC29H49BrO3
Molecular weight525.6 g/mol
IUPAC name[(3R,5R,6R,8S,9S,10R,13R,14S)-5-bromo-6-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
InChIKeyQOKSSEORHJPLLF-LBPASEOFSA-N
SMILESC[C@H](CCCC(C)C)C1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@@]4([C@@]3(CC[C@H](C4)OC(=O)C)C)Br)O)C

Computed by PubChem (NCBI)