Chemical Compound

RefChem:79271

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RefChem:79271 chemical structure
Primary Record

RefChem:79271

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
71296129
SMILES
CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](OC1O[C@@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3CCC5=C4C=CC(=C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O)C)CO)O)O
Canonical SMILES
CC(=O)N[C@H]1C(O[C@@H]2CC[C@H]3[C@@H]4CCc5cc(O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)ccc5[C@H]4CC[C@]23C)O[C@H](CO)[C@@H](O)[C@@H]1O

Names & Synonyms

  • RefChem:79271
  • CHEBI:16129
  • 17alpha-(N-acetyl-D-glucosaminyl)estradiol 3-glucosiduronic acid
  • 17alpha-(N-acetyl-D-glucosaminyl)estradiol 3-glucuronide
  • Q27098391
  • 17alpha-(N-Acetyl-D-glucosaminyl)-estradiol 3-D-glucuronoside
  • 17alpha-(2-acetamido-2-deoxy-D-glucopyranosyloxy)estra-1,3,5(10)-trien-3-yl-beta-D-glucopyranosiduronic acid
  • 17alpha-(2-acetamido-2-deoxy-beta-D-glucopyranosyloxy)estra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid