2-Methoxyestrone 3-glucuronide

CAS Registry Number®

25577-70-2

CAS Name

2-Methoxyestrone 3-glucuronide

Molecular Formula

C25H32O9

Molecular Mass

476.52

Cite this Page

2-Methoxyestrone 3-glucuronide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=25577-70-2 (retrieved 2024-11-22) (CAS RN: 25577-70-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H32O9/c1-25-8-7-12-13(15(25)5-6-18(25)26)4-3-11-9-17(16(32-2)10-14(11)12)33-24-21(29)19(27)20(28)22(34-24)23(30)31/h9-10,12-13,15,19-22,24,27-29H,3-8H2,1-2H3,(H,30,31)

InChIKey

InChIKey=NZTHZDNDYACBSX-UHFFFAOYSA-N

SMILES

CC12C(C3C(C=4C(CC3)=CC(OC5OC(C(O)=O)C(O)C(O)C5O)=C(OC)C4)CC1)CCC2=O

Canonical SMILES

O=C(O)C1OC(OC=2C=C3C(=CC2OC)C4CCC5(C(=O)CCC5C4CC3)C)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranosiduronic acid, 2-methoxy-17-oxoestra-1,3,5(10)-trien-3-yl
  • Glucopyranosiduronic acid, 2-methoxy-17-oxoestra-1,3,5(10)-trien-3-yl, β-D-
  • Estrane, β-D-glucopyranosiduronic acid deriv.
  • 2-Methoxy-17-oxoestra-1,3,5(10)-trien-3-yl β-D-glucopyranosiduronic acid
  • 2-Methoxyestrone, glucuronide

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Deleted or Replaced CAS Registry Numbers

21809-49-4, 31016-87-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration