(2β,3α,5α,16β,17β)-2,16-Di-1-piperidinylandrostane-3,17-diol

CAS Registry Number®

13522-16-2

CAS Name

(2β,3α,5α,16β,17β)-2,16-Di-1-piperidinylandrostane-3,17-diol

Molecular Formula

C29H50N2O2

Molecular Mass

458.72

Cite this Page

(2β,3α,5α,16β,17β)-2,16-Di-1-piperidinylandrostane-3,17-diol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13522-16-2 (retrieved 2024-11-22) (CAS RN: 13522-16-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    157 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C29H50N2O2/c1-28-12-11-22-21(23(28)18-24(27(28)33)30-13-5-3-6-14-30)10-9-20-17-26(32)25(19-29(20,22)2)31-15-7-4-8-16-31/h20-27,32-33H,3-19H2,1-2H3/t20-,21+,22-,23-,24-,25-,26-,27-,28-,29-/m0/s1

InChIKey

InChIKey=SMEIBKQQBOLIMJ-RIQJFVKASA-N

SMILES

C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@@](CC3)(C[C@H](O)[C@H](C4)N5CCCCC5)[H])(CC1)[H])[H])(C[C@@H]([C@@H]2O)N6CCCCC6)[H]

Canonical SMILES

OC1CC2CCC3C(CCC4(C)C(O)C(N5CCCCC5)CC34)C2(C)CC1N6CCCCC6

Other Names for this Substance

  • Androstane-3,17-diol, 2,16-di-1-piperidinyl-, (2β,3α,5α,16β,17β)-
  • 5α-Androstane-3α,17β-diol, 2β,16β-dipiperidino-
  • (2β,3α,5α,16β,17β)-2,16-Di-1-piperidinylandrostane-3,17-diol
  • 2β,16β-Dipiperidino-5α-androstane-3α,17β-diol
  • 2,16-Di(piperidin-1-yl)androstane-3,17-diol

CAS INSIGHTSTM
Targeted protein degrader structure, illustration