Chemical Compound

17|A-Estradiol 3-Sulfate 17-(2,3,4-Tri-O-acetyl-|A-D-glucuronide Methyl Ester) Ammonium Salt

17|A-Estradiol 3-Sulfate 17-(2,3,4-Tri-O-acetyl-|A-D-glucuronide Methyl Ester) Ammonium Salt chemical structure
Primary Record

17|A-Estradiol 3-Sulfate 17-(2,3,4-Tri-O-acetyl-|A-D-glucuronide Methyl Ester) Ammonium Salt

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
71316478
SMILES
CC(=O)O[C@H]1[C@@H]([C@H](O[C@H]([C@@H]1OC(=O)C)O[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3CCC5=C4C=CC(=C5)OS(=O)(=O)[O-])C)C(=O)OC)OC(=O)C.[NH4+]
Canonical SMILES
COC(=O)[C@H]1O[C@@H](O[C@H]2CC[C@H]3[C@@H]4CCc5cc(OS(=O)(=O)[O-])ccc5[C@H]4CC[C@]23C)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.[NH4+]

Names & Synonyms

  • 17|A-Estradiol 3-Sulfate 17-(2,3,4-Tri-O-acetyl-|A-D-glucuronide Methyl Ester) Ammonium Salt
  • 3-Sulfate-(17|A)-3-hydroxyestra-1,3,5(10)-trien-17-yl 2,3,4-triacetate-|A-D-glucopyranosiduronic Acid Methyl Ester