21-(Acetyloxy)-17-hydroxypregna-1,4-diene-3,20-dione

CAS Registry Number®

1249-67-8

CAS Name

21-(Acetyloxy)-17-hydroxypregna-1,4-diene-3,20-dione

Molecular Formula

C23H30O5

Molecular Mass

386.48

Cite this Page

21-(Acetyloxy)-17-hydroxypregna-1,4-diene-3,20-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1249-67-8 (retrieved 2024-10-06) (CAS RN: 1249-67-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    216-218 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H30O5/c1-14(24)28-13-20(26)23(27)11-8-19-17-5-4-15-12-16(25)6-9-21(15,2)18(17)7-10-22(19,23)3/h6,9,12,17-19,27H,4-5,7-8,10-11,13H2,1-3H3/t17-,18+,19+,21+,22+,23+/m1/s1

InChIKey

InChIKey=WVRZJAMAOJQSRN-JZTHCNPZSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(CC3)=CC(=O)C=C4)(CC1)[H])[H])(CC[C@@]2(C(COC(C)=O)=O)O)[H]

Canonical SMILES

O=C1C=CC2(C(=C1)CCC3C2CCC4(C)C3CCC4(O)C(=O)COC(=O)C)C

Other Names for this Substance

  • Pregna-1,4-diene-3,20-dione, 21-(acetyloxy)-17-hydroxy-
  • Pregna-1,4-diene-3,20-dione, 17,21-dihydroxy-, 21-acetate
  • 21-(Acetyloxy)-17-hydroxypregna-1,4-diene-3,20-dione
  • 21-Acetoxy-17-hydroxypregna-1,4-diene-3,20-dione
  • 11-Deoxyprednisone acetate

View All

Deleted or Replaced CAS Registry Numbers

1080024-50-5

CAS INSIGHTSTM
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