Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11,18-epoxy-18-hydroxy-, (11β)-
CAS Registry Number®
2827-21-6
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CAS Name
Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11,18-epoxy-18-hydroxy-, (11β)-Molecular Formula
C23H30O6Molecular Mass
402.48Cite this Page
Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11,18-epoxy-18-hydroxy-, (11β)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=2827-21-6 (retrieved ) (CAS RN: 2827-21-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
190-192 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C23H30O6/c1-12(24)28-11-18(26)17-6-5-16-15-4-3-13-9-14(25)7-8-22(13,2)20(15)19-10-23(16,17)21(27)29-19/h9,15-17,19-21,27H,3-8,10-11H2,1-2H3/t15-,16-,17+,19-,20+,21?,22-,23+/m0/s1
InChIKey
InChIKey=JUHQUIOIVOVZQG-XNEAOMTKSA-N
SMILES
C(COC(C)=O)(=O)[C@@H]1[C@]23[C@]([C@]4([C@]([C@](C2)(OC3O)[H])([C@]5(C)C(CC4)=CC(=O)CC5)[H])[H])(CC1)[H]
Canonical SMILES
O=C(OCC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3C5OC(O)C12C5)C
Other Names for this Substance
- Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11,18-epoxy-18-hydroxy-, (11β)-
- Aldosterone, 21-acetate
- 11,13-(Epoxymethano)-13H-cyclopenta[a]phenanthrene, pregn-4-ene-3,20-dione deriv.
- Aldosterone 21-monoacetate
Deleted or Replaced CAS Registry Numbers
27452-61-5
