Chemical Compound

5alpha-Androstan-3alpha,11beta-diol-17-one 3-glucosiduronate

CAS Registry Number 35259-60-0
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5alpha-Androstan-3alpha,11beta-diol-17-one 3-glucosiduronate chemical structure
Primary Record

5alpha-Androstan-3alpha,11beta-diol-17-one 3-glucosiduronate

In stock
2,459 g
Purity
99.1 %
CAS
35259-60-0

Compound Identifiers & Properties

CAS
35259-60-0
PubChem CID
90471715
SMILES
C[C@]12CC[C@H](CC1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CCC4=O)C)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)[O-])O)O)O.[Na+]
Canonical SMILES
C[C@]12CC[C@@H](O[C@@H]3O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]3O)CC1CC[C@@H]1[C@@H]2[C@@H](O)C[C@]2(C)C(=O)CC[C@@H]12.[Na+]

Names & Synonyms

  • 5alpha-Androstan-3alpha,11beta-diol-17-one 3-glucosiduronate
  • 35259-60-0
  • 5alpha-androstan-3alpha, 11beta-diol-17-one 3-glucosiduronate
  • 5alpha-Androstan-3alpha,11beta-diol-17-one3-glucosiduronate
  • sodium;(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(3R,8S,9S,10S,11S,13S,14S)-11-hydroxy-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylate