Mepitiostane

CAS Registry Number®

21362-69-6

CAS Name

Mepitiostane

Molecular Formula

C25H40O2S

Molecular Mass

404.65

Cite this Page

Mepitiostane.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21362-69-6 (retrieved 2024-11-21) (CAS RN: 21362-69-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    98-101 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C25H40O2S/c1-23-13-10-19-17(7-6-16-14-20-21(28-20)15-24(16,19)2)18(23)8-9-22(23)27-25(26-3)11-4-5-12-25/h16-22H,4-15H2,1-3H3/t16-,17-,18-,19-,20-,21+,22-,23-,24-/m0/s1

InChIKey

InChIKey=IVDYZAAPOLNZKG-KWHRADDSSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@H](OC5(OC)CCCC5)CC4)[H])(CC[C@]1(C[C@]6([C@@](C2)(S6)[H])[H])[H])[H])[H]

Canonical SMILES

O(C)C1(OC2CCC3C4CCC5CC6SC6CC5(C)C4CCC23C)CCCC1

Other Names for this Substance

  • Androstane, 2,3-epithio-17-[(1-methoxycyclopentyl)oxy]-, (2α,3α,5α,17β)-
  • Cyclopentanone, 2α,3α-epithio-5α-androstan-17β-yl methyl acetal
  • 5α-Androstane, 2α,3α-epithio-17β-[(1-methoxycyclopentyl)oxy]-
  • 2,3-Epithio-1H-cyclopenta[a]phenanthrene, androstane deriv.
  • (2α,3α,5α,17β)-2,3-Epithio-17-[(1-methoxycyclopentyl)oxy]androstane

CAS INSIGHTSTM
Targeted protein degrader structure, illustration