Testosterone glucuronide

CAS Registry Number®

1180-25-2

CAS Name

Testosterone glucuronide

Molecular Formula

C25H36O8

Molecular Mass

464.55

Cite this Page

Testosterone glucuronide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1180-25-2 (retrieved 2024-11-22) (CAS RN: 1180-25-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H36O8/c1-24-9-7-13(26)11-12(24)3-4-14-15-5-6-17(25(15,2)10-8-16(14)24)32-23-20(29)18(27)19(28)21(33-23)22(30)31/h11,14-21,23,27-29H,3-10H2,1-2H3,(H,30,31)/t14-,15-,16-,17-,18-,19-,20+,21-,23+,24-,25-/m0/s1

InChIKey

InChIKey=NIKZPECGCSUSBV-HMAFJQTKSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@H](O[C@@H]5O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]5O)CC4)[H])(CCC1=CC(=O)CC2)[H])[H]

Canonical SMILES

O=C(O)C1OC(OC2CCC3C4CCC5=CC(=O)CCC5(C)C4CCC23C)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranosiduronic acid, (17β)-3-oxoandrost-4-en-17-yl
  • Glucopyranosiduronic acid, 3-oxoandrost-4-en-17β-yl, β-D-
  • Androstane, β-D-glucopyranosiduronic acid deriv.
  • (17β)-3-Oxoandrost-4-en-17-yl β-D-glucopyranosiduronic acid
  • Testosterone glucuronide

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Deleted or Replaced CAS Registry Numbers

5624-49-7, 30330-56-4

CAS INSIGHTSTM
Targeted protein degrader structure, illustration