17α-Ethynyl-5α-androstane-3α,17β-diol

CAS Registry Number®

183387-50-0

CAS Name

17α-Ethynyl-5α-androstane-3α,17β-diol

Molecular Formula

C21H32O2

Molecular Mass

316.48

Cite this Page

17α-Ethynyl-5α-androstane-3α,17β-diol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=183387-50-0 (retrieved 2024-11-21) (CAS RN: 183387-50-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H32O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h1,14-18,22-23H,5-13H2,2-3H3/t14-,15+,16+,17-,18-,19-,20-,21-/m0/s1

InChIKey

InChIKey=CKAXZOYFIHQCBN-JRRMKBMNSA-N

SMILES

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

Canonical SMILES

C#CC1(O)CCC2C3CCC4CC(O)CCC4(C)C3CCC21C

Other Names for this Substance

  • Pregn-20-yne-3,17-diol, (3α,5α,17α)-
  • (3α,5α,17α)-Pregn-20-yne-3,17-diol
  • HE 3235
  • Apoptone
  • 17α-Ethynyl-5α-androstane-3α,17β-diol

CAS INSIGHTSTM
Targeted protein degrader structure, illustration