Etiocholanolone

CAS Registry Number®

53-42-9

CAS Name

Etiocholanolone

Molecular Formula

C19H30O2

Molecular Mass

290.44

Cite this Page

Etiocholanolone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=53-42-9 (retrieved 2024-11-22) (CAS RN: 53-42-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    138.5-139.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,18+,19+/m1/s1

InChIKey

InChIKey=QGXBDMJGAMFCBF-BNSUEQOYSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)C(=O)CC4)[H])(CC[C@@]1(C[C@H](O)CC2)[H])[H])[H]

Canonical SMILES

O=C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C

Other Names for this Substance

  • Androstan-17-one, 3-hydroxy-, (3α,5β)-
  • 5β-Androstan-17-one, 3α-hydroxy-
  • (3α,5β)-3-Hydroxyandrostan-17-one
  • 5β-Androstan-3α-ol-17-one
  • 5β-Androsterone

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration