Products 82938-04-3

CAS 82938-04-3 appears in our catalog under these names: Estradiol-13C2 17-Benzoate, Estradiol 17-Benzoate-13C2. Offered by: TRC, MedChemExpress. Available pack sizes: 10mg, 2,5mg, 5mg, 10 mg, 2.5 mg, 5 mg.

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

[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] benzoate (CAS 82938-04-3) is a chemical compound with the molecular formula C25H28O3 and a molecular weight of 378.5 g/mol. IUPAC name: [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] benzoate. InChIKey: AAGOOGMSOHOVSE-GWROIAGVSA-N.

Identity
Molecular formulaC25H28O3
Molecular weight378.5 g/mol
IUPAC name[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] benzoate
InChIKeyAAGOOGMSOHOVSE-GWROIAGVSA-N
SMILESC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OC(=O)C4=CC=CC=C4)CCC5=C3C=C[13C](=[13CH]5)O

Computed by PubChem (NCBI)