Chemical Compound

CHEBI:136974

CHEBI:136974 chemical structure
Primary Record

CHEBI:136974

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
129011101
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=C(C=C34)OC)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)[O-])O)O)O
Canonical SMILES
COc1cc2c(cc1O[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12

Names & Synonyms

  • CHEBI:136974
  • 2-methoxy-17beta-estradiol 3-glucosiduronate
  • 2-methoxy-17beta-estradiol 3-glucuronide(1-)
  • 2-methoxy-17beta-estradiol 3-O-glucuronide(1-)
  • 2-methoxy-17beta-estradiol 3-beta-glucuronide(1-)
  • 2-methoxy-17beta-estradiol 3-beta-D-glucuronide(1-)
  • 2-methoxy-17beta-estradiol 3-O-(beta-D-glucuronate)
  • 2-methoxy-17beta-estradiol 3-O-(beta-D-glucuronide)(1-)
  • (17beta)-17-hydroxy-2-methoxyestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronate
  • 17beta-hydroxy-2-methoxyestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronate