Products 3233-69-0

CAS 3233-69-0 is the registry number for Estradiol 17Beta-sulfate. Offered by: TRC. Available pack sizes: 1mg.

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

17beta-estradiol 17-sulfate is a steroid sulfate obtained by the formal condensation of sulfuric acid with the 17-hydroxy group of 17beta-estradiol. It has a role as a human urinary metabolite. It is a steroid sulfate, a phenolic steroid and a 3-hydroxy steroid. It is functionally related to a 17beta-estradiol. It is a conjugate acid of a 17beta-estradiol 17-sulfate(1-).

Source: ChEBI

Identity
Molecular formulaC18H24O5S
Molecular weight352.4 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] hydrogen sulfate
InChIKeyJSUDNGPWAXYETN-ZBRFXRBCSA-N
SMILESC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OS(=O)(=O)O)CCC4=C3C=CC(=C4)O

Computed by PubChem (NCBI)