Pregn-16-ene-11,20-dione, 3-(acetyloxy)-, (3β,5α)-

CAS Registry Number®

2724-68-7
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CAS Name

Pregn-16-ene-11,20-dione, 3-(acetyloxy)-, (3β,5α)-

Molecular Formula

C23H32O4

Molecular Mass

372.50

Cite this Page

Pregn-16-ene-11,20-dione, 3-(acetyloxy)-, (3β,5α)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2724-68-7 (retrieved 2024-05-15) (CAS RN: 2724-68-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    183-185 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H32O4/c1-13(24)18-7-8-19-17-6-5-15-11-16(27-14(2)25)9-10-22(15,3)21(17)20(26)12-23(18,19)4/h7,15-17,19,21H,5-6,8-12H2,1-4H3/t15-,16-,17-,19-,21+,22-,23+/m0/s1

InChIKey

InChIKey=JAZBMNIJZWDVQJ-BLDHYFSKSA-N

SMILES

C[C@@]12[C@]([C@]3([C@](C(=O)C1)([C@]4(C)[C@@](CC3)(C[C@@H](OC(C)=O)CC4)[H])[H])[H])(CC=C2C(C)=O)[H]

Canonical SMILES

O=C(OC1CCC2(C)C3C(=O)CC4(C(=CCC4C3CCC2C1)C(=O)C)C)C

Other Names for this Substance

  • Pregn-16-ene-11,20-dione, 3-(acetyloxy)-, (3β,5α)-
  • 5α-Pregn-16-ene-11,20-dione, 3β-hydroxy-, acetate
  • 3β-Acetoxy-5α-pregn-16-ene-11,20-dione
  • NSC 18291
  • NSC 73108

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