(5α,17β)-17-(Acetyloxy)androst-1-en-3-one

CAS Registry Number®

64-82-4
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CAS Name

(5α,17β)-17-(Acetyloxy)androst-1-en-3-one

Molecular Formula

C21H30O3

Molecular Mass

330.46

Cite this Page

(5α,17β)-17-(Acetyloxy)androst-1-en-3-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=64-82-4 (retrieved 2024-04-28) (CAS RN: 64-82-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    120-122 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H30O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h8,10,14,16-19H,4-7,9,11-12H2,1-3H3/t14-,16-,17-,18-,19-,20-,21-/m0/s1

InChIKey

InChIKey=NKZLRJOJLCHNQR-NGFSFWIMSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@H](OC(C)=O)CC4)[H])(CC[C@]1(CC(=O)C=C2)[H])[H])[H]

Canonical SMILES

O=C(OC1CCC2C3CCC4CC(=O)C=CC4(C)C3CCC12C)C

Other Names for this Substance

  • Androst-1-en-3-one, 17-(acetyloxy)-, (5α,17β)-
  • 5α-Androst-1-en-3-one, 17β-hydroxy-, acetate
  • (5α,17β)-17-(Acetyloxy)androst-1-en-3-one
  • 17β-Acetoxy-5α-androst-1-en-3-one
  • 17β-Hydroxy-5α-androst-1-en-3-one acetate

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Deleted or Replaced CAS Registry Numbers

23714-44-5

CAS INSIGHTSTM
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