(3α,5α,20R)-Pregnane-3,17,20-triol

CAS Registry Number®

13933-75-0

CAS Name

(3α,5α,20R)-Pregnane-3,17,20-triol

Molecular Formula

C21H36O3

Molecular Mass

336.51

Cite this Page

(3α,5α,20R)-Pregnane-3,17,20-triol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13933-75-0 (retrieved 2024-11-22) (CAS RN: 13933-75-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    226-229 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H36O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h13-18,22-24H,4-12H2,1-3H3/t13-,14+,15-,16-,17+,18+,19+,20+,21+/m1/s1

InChIKey

InChIKey=SCPADBBISMMJAW-MUHHAPIYSA-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@@H](C)O)O)[H]

Canonical SMILES

OC1CCC2(C)C(CCC3C2CCC4(C)C3CCC4(O)C(O)C)C1

Other Names for this Substance

  • Pregnane-3,17,20-triol, (3α,5α,20R)-
  • 5α-Pregnane-3α,17,20β-triol
  • (3α,5α,20R)-Pregnane-3,17,20-triol

CAS INSIGHTSTM
Targeted protein degrader structure, illustration