3β-Acetoxyandrost-5-en-17-one

CAS Registry Number®

853-23-6

CAS Name

3β-Acetoxyandrost-5-en-17-one

Molecular Formula

C21H30O3

Molecular Mass

330.46

Cite this Page

3β-Acetoxyandrost-5-en-17-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=853-23-6 (retrieved 2024-11-28) (CAS RN: 853-23-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    150 °C

  • Density (2)

    1.289 g/cm³ @ Temp: 25.000 °C; Press: 759.8 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H30O3/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(23)21(17,3)11-9-18(16)20/h4,15-18H,5-12H2,1-3H3/t15-,16-,17-,18-,20-,21-/m0/s1

InChIKey

InChIKey=NCMZQTLCXHGLOK-ZKHIMWLXSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)C(=O)CC4)[H])(CC=C1C[C@@H](OC(C)=O)CC2)[H])[H]

Canonical SMILES

O=C(OC1CC2=CCC3C4CCC(=O)C4(C)CCC3C2(C)CC1)C

Other Names for this Substance

  • Androst-5-en-17-one, 3-(acetyloxy)-, (3β)-
  • Androst-5-en-17-one, 3β-hydroxy-, acetate
  • (3β)-3-(Acetyloxy)androst-5-en-17-one
  • Δ5-Dehydroepiandrosterone 3-acetate
  • Dehydroepiandrost-5-en-17-one 3-acetate

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Deleted or Replaced CAS Registry Numbers

651322-73-5, 2420433-67-4

CAS INSIGHTSTM
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