3α,17α-Dihydroxy-5β-pregnane-11,20-dione

CAS Registry Number®

641-78-1

CAS Name

3α,17α-Dihydroxy-5β-pregnane-11,20-dione

Molecular Formula

C21H32O4

Molecular Mass

348.48

Cite this Page

3α,17α-Dihydroxy-5β-pregnane-11,20-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=641-78-1 (retrieved 2024-11-21) (CAS RN: 641-78-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    200.5-202 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H32O4/c1-12(22)21(25)9-7-16-15-5-4-13-10-14(23)6-8-19(13,2)18(15)17(24)11-20(16,21)3/h13-16,18,23,25H,4-11H2,1-3H3/t13-,14-,15+,16+,18-,19+,20+,21+/m1/s1

InChIKey

InChIKey=AYEXSTRNLGYBSQ-YOBHSKELSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@](CC3)(C[C@H](O)CC4)[H])(C(=O)C1)[H])[H])(CC[C@@]2(C(C)=O)O)[H]

Canonical SMILES

O=C(C)C1(O)CCC2C3CCC4CC(O)CCC4(C)C3C(=O)CC21C

Other Names for this Substance

  • Pregnane-11,20-dione, 3,17-dihydroxy-, (3α,5β)-
  • 5β-Pregnane-11,20-dione, 3α,17-dihydroxy-
  • (3α,5β)-3,17-Dihydroxypregnane-11,20-dione
  • 17α-Hydroxy-11-ketopregnanolone
  • L 513789-0

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration