(6α)-17-(Acetyloxy)-6-chloropregna-1,4-diene-3,20-dione

CAS Registry Number®

151-69-9

CAS Name

(6α)-17-(Acetyloxy)-6-chloropregna-1,4-diene-3,20-dione

Molecular Formula

C23H29ClO4

Molecular Mass

404.93

Cite this Page

(6α)-17-(Acetyloxy)-6-chloropregna-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=151-69-9 (retrieved 2024-11-22) (CAS RN: 151-69-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    203-205 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H29ClO4/c1-13(25)23(28-14(2)26)10-7-18-16-12-20(24)19-11-15(27)5-8-21(19,3)17(16)6-9-22(18,23)4/h5,8,11,16-18,20H,6-7,9-10,12H2,1-4H3/t16-,17+,18+,20+,21-,22+,23+/m1/s1

InChIKey

InChIKey=AQDNTKZTMCWYDA-WXLIAARGSA-N

SMILES

O(C(C)=O)[C@@]1(C(C)=O)[C@]2(C)[C@@](CC1)([C@]3([C@](CC2)([C@]4(C)C([C@@H](Cl)C3)=CC(=O)C=C4)[H])[H])[H]

Canonical SMILES

O=C1C=CC2(C(=C1)C(Cl)CC3C2CCC4(C)C3CCC4(OC(=O)C)C(=O)C)C

Other Names for this Substance

  • Pregna-1,4-diene-3,20-dione, 17-(acetyloxy)-6-chloro-, (6α)-
  • Pregna-1,4-diene-3,20-dione, 6α-chloro-17-hydroxy-, acetate
  • (6α)-17-(Acetyloxy)-6-chloropregna-1,4-diene-3,20-dione
  • 6α-Chloro-17-hydroxypregna-1,4-diene-3,20-dione acetate
  • Cismadinone acetate

CAS INSIGHTSTM
Targeted protein degrader structure, illustration