Products 352431-50-6

CAS 352431-50-6 appears in our catalog under these names: Estradiol-2,4,16,16-d4 3-Sulfate Sodium Salt, Sodium 17beta-Estradiol-2,4,16,16-d4 3-Sulfate (Stabilized with TRIS, 50% w/w), >95% (HPLC), Sodium 17beta-Estradiol-2,4,16,16-d4 3-Sulfate (Stabilized with TRIS, 50% w/w), 98 atom % D, min 98% Chemical Purity, 17β–Estradiol–2,4,16,16–d4 3–sulfate (sodium salt), 17β-Estradiol sulfate-d4 (sodium), 99.57%. Offered by: Chemat Brand, TRC, CDN, GLPBio, MedChemExpress. Available pack sizes: on request, 0,2mg, 0,4mg, 2mg, 0,02g, 0,01g, 1mg, 5mg.

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

Sodium [(8R,9S,13S,14S,17S)-2,4,16,16-tetradeuterio-17-hydroxy-13-methyl-7,8,9,11,12,14,15,17-octahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfate (CAS 352431-50-6) is a chemical compound with the molecular formula C18H23NaO5S and a molecular weight of 378.5 g/mol. IUPAC name: sodium [(8R,9S,13S,14S,17S)-2,4,16,16-tetradeuterio-17-hydroxy-13-methyl-7,8,9,11,12,14,15,17-octahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfate. InChIKey: LMJQCTISQYSLPF-LDBFCMRTSA-M.

Identity
Molecular formulaC18H23NaO5S
Molecular weight378.5 g/mol
IUPAC namesodium [(8R,9S,13S,14S,17S)-2,4,16,16-tetradeuterio-17-hydroxy-13-methyl-7,8,9,11,12,14,15,17-octahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfate
InChIKeyLMJQCTISQYSLPF-LDBFCMRTSA-M
SMILES[2H]C1=CC2=C(CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC([C@@H]4O)([2H])[2H])C)C(=C1OS(=O)(=O)[O-])[2H].[Na+]

Computed by PubChem (NCBI)