Estrone 3-glucuronide

CAS Registry Number®

2479-90-5
No image available.

CAS Name

Estrone 3-glucuronide

Molecular Formula

C24H30O8

Molecular Mass

446.49

Cite this Page

Estrone 3-glucuronide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=2479-90-5 (retrieved 2024-04-18) (CAS RN: 2479-90-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C24H30O8/c1-24-9-8-14-13-5-3-12(10-11(13)2-4-15(14)16(24)6-7-17(24)25)31-23-20(28)18(26)19(27)21(32-23)22(29)30/h3,5,10,14-16,18-21,23,26-28H,2,4,6-9H2,1H3,(H,29,30)/t14-,15-,16+,18+,19+,20-,21+,23-,24+/m1/s1

InChIKey

InChIKey=FJAZVHYPASAQKM-JBAURARKSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(O[C@@H]5O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]5O)=CC4)(CC1)[H])[H])(CCC2=O)[H]

Canonical SMILES

O=C(O)C1OC(OC2=CC=C3C(=C2)CCC4C3CCC5(C(=O)CCC45)C)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranosiduronic acid, 17-oxoestra-1,3,5(10)-trien-3-yl
  • Glucopyranosiduronic acid, 17-oxoestra-1,3,5(10)-trien-3-yl, β-D-
  • β-D-Glucosiduronic acid, 17-oxoestra-1,3,5(10)-trien-3-yl
  • Estra-1,3,5(10)-trien-17-one, 3-(β-D-glucopyranuronosyloxy)-
  • Estrane, β-D-glucopyranosiduronic acid deriv.

View All

Deleted or Replaced CAS Registry Numbers

26610-40-2, 30137-08-7, 125926-19-4, 904747-74-6

CAS INSIGHTSTM
Insights teaser
Insights teaser
Insights teaser
Insights teaser