21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione

CAS Registry Number®

37413-91-5

CAS Name

21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione

Molecular Formula

C23H26O4

Molecular Mass

366.45

Cite this Page

21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=37413-91-5 (retrieved 2024-11-23) (CAS RN: 37413-91-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    172-174 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H26O4/c1-14(24)27-13-21(26)20-7-6-18-17-5-4-15-12-16(25)8-10-22(15,2)19(17)9-11-23(18,20)3/h7-10,12,17-18H,4-6,11,13H2,1-3H3/t17-,18-,22-,23-/m0/s1

InChIKey

InChIKey=UFEOMHFPJREVTP-PTRHGPIFSA-N

SMILES

C[C@@]12[C@]([C@]3(C([C@]4(C)C(CC3)=CC(=O)C=C4)=CC1)[H])(CC=C2C(COC(C)=O)=O)[H]

Canonical SMILES

O=C1C=CC2(C(=C1)CCC3C2=CCC4(C(=CCC34)C(=O)COC(=O)C)C)C

Other Names for this Substance

  • Pregna-1,4,9(11),16-tetraene-3,20-dione, 21-(acetyloxy)-
  • Pregna-1,4,9(11),16-tetraene-3,20-dione, 21-hydroxy-, acetate
  • 21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione
  • 21-Acetoxypregna-1,4,9(11),16-tetraene-3,20-dione
  • 21-Hydroxy-1,4,9(11)-tetraene 21-acetate

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