Androsta-1,4-diene-3,11,17-trione

CAS Registry Number®

7738-93-4
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CAS Name

Androsta-1,4-diene-3,11,17-trione

Molecular Formula

C19H22O3

Molecular Mass

298.38

Cite this Page

Androsta-1,4-diene-3,11,17-trione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7738-93-4 (retrieved 2024-05-20) (CAS RN: 7738-93-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    193-195 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C19H22O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h7-9,13-14,17H,3-6,10H2,1-2H3/t13-,14-,17+,18-,19-/m0/s1

InChIKey

InChIKey=RZACPWSZIQKVDY-IRIMSJTPSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3=O)C(=O)CC4)[H])(CCC1=CC(=O)C=C2)[H])[H]

Canonical SMILES

O=C1C=CC2(C(=C1)CCC3C2C(=O)CC4(C(=O)CCC34)C)C

Other Names for this Substance

  • Androsta-1,4-diene-3,11,17-trione
  • Δ1-Adrenosterone
  • NSC 82849
  • 1-Dehydroadrenosterone

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