Chemical Compound

Estriol 3-sulfate 16-glucuronide

CAS Registry Number 4661-65-8
Estriol 3-sulfate 16-glucuronide chemical structure
Primary Record

Estriol 3-sulfate 16-glucuronide

In stock
2,897 g
Purity
98.8 %
CAS
4661-65-8

Compound Identifiers & Properties

CAS
4661-65-8
PubChem CID
151223
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@H]([C@@H]2O)OC4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)CCC5=C3C=CC(=C5)OS(=O)(=O)O
Canonical SMILES
C[C@]12CC[C@@H]3c4ccc(OS(=O)(=O)O)cc4CC[C@H]3[C@@H]1C[C@@H](OC1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H]2O

Names & Synonyms

  • Estriol 3-sulfate 16-glucuronide
  • AC1L45WI
  • estriol3-sulfate16-glucuronide
  • SCHEMBL3448859
  • CHEBI:88727
  • Estriol-3-sulfate-16-glucosiduronate
  • C24H32O12S
  • Estriol 3-sulphate 16-glucuronide
  • Estriol 3-sulfate 16-glucuronoside
  • CID151223
  • Estriol 3-sulphate 16-glucuronoside
  • C24-H32-O12-S
  • Estriol 3-sulfate 16alpha-glucuronide
  • Estriol-3-sulfate-16alpha-glucosiduronate
  • Estriol 3-sulphate 16alpha-glucuronide
  • Estriol 3-sulfate 16alpha-glucuronoside
  • Estriol 3-sulphate 16alpha-glucuronoside
  • 4661-65-8
  • (2S,3S,4S,5R)-3,4,5-trihydroxy-6-[[(8R,9S,13S,14S,16R,17R)-17-hydroxy-13-methyl-3-sulfooxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl]oxy]oxane-2-carboxylic acid
  • Q27160645
  • (16alpha,17beta)-17-hydroxy-3-(sulfooxy)estra-1,3,5(10)-trien-16-yl-beta-D-Glucopyranosiduronic acid
  • (16alpha,17beta)-17-hydroxy-3-(sulfooxy)estra-1,3,5(10)-trien-16-yl-beta-delta-Glucopyranosiduronic acid
  • .beta.-D-Glucopyranosiduronic acid, (16.alpha.,17.beta.)-17-hydroxy-3-(sulfooxy)estra-1,3,5(10)-trien-16-yl
  • beta-D-Glucopyranosiduronic acid, (16alpha,17beta)-17-hydroxy-3-(sulfooxy)estra-1,3,5(10)-trien-16-yl