19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, 3-(2-propanesulfonate), (17α)-

CAS Registry Number®

28913-23-7

CAS Name

19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, 3-(2-propanesulfonate), (17α)-

Molecular Formula

C23H30O4S

Molecular Mass

402.55

Cite this Page

19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, 3-(2-propanesulfonate), (17α)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=28913-23-7 (retrieved 2024-11-22) (CAS RN: 28913-23-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H30O4S/c1-5-23(24)13-11-21-20-8-6-16-14-17(27-28(25,26)15(2)3)7-9-18(16)19(20)10-12-22(21,23)4/h1,7,9,14-15,19-21,24H,6,8,10-13H2,2-4H3/t19-,20-,21+,22+,23+/m1/s1

InChIKey

InChIKey=KPEUDULLQDHKAZ-VROINQGHSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(OS(C(C)C)(=O)=O)=CC4)(CC1)[H])[H])(CC[C@]2(C#C)O)[H]

Canonical SMILES

O=S(=O)(OC1=CC=C2C(=C1)CCC3C2CCC4(C)C3CCC4(O)C#C)C(C)C

Other Names for this Substance

  • 19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, 3-(2-propanesulfonate), (17α)-
  • 19-Nor-17α-pregna-1,3,5(10)-trien-20-yne-3,17-diol, 3-(2-propanesulfonate)
  • 2-Propanesulfonic acid, 17-hydroxy-19-nor-17α-pregna-1,3,5(10)-trien-20-yn-3-yl ester
  • J 96
  • Turisteron

View All

CAS INSIGHTSTM
Targeted protein degrader structure, illustration