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CAS 21170-34-3

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3,20-Dioxopregn-4-en-21-yl 4-bromobenzenesulfonate

Description:
3,20-Dioxopregn-4-en-21-yl 4-bromobenzenesulfonate, with the CAS number 21170-34-3, is a synthetic organic compound that belongs to the class of steroid derivatives. This compound features a pregnane backbone, characterized by a steroid structure with multiple fused rings. The presence of two ketone groups (dioxo) at the 3 and 20 positions contributes to its reactivity and potential biological activity. The sulfonate group, specifically the 4-bromobenzenesulfonate moiety, enhances its solubility in polar solvents and may influence its pharmacological properties. This compound is of interest in medicinal chemistry and pharmacology due to its potential applications in hormone-related therapies or as a biochemical probe. Its structural characteristics suggest that it may interact with biological systems, possibly influencing steroid hormone pathways. However, detailed studies on its biological activity, toxicity, and pharmacokinetics would be necessary to fully understand its potential applications and safety profile.
Formula:C27H33BrO5S
InChI:InChI=1/C27H33BrO5S/c1-26-13-11-19(29)15-17(26)3-8-21-22-9-10-24(27(22,2)14-12-23(21)26)25(30)16-33-34(31,32)20-6-4-18(28)5-7-20/h4-7,15,21-24H,3,8-14,16H2,1-2H3
SMILES:CC12CCC(=O)C=C1CCC1C3CCC(C(=O)COS(=O)(=O)c4ccc(cc4)Br)C3(C)CCC21
Synonyms:
  • Benzenesulfonic Acid, 4-Bromo-, 3,20-Dioxopregn-4-En-21-Yl Ester
  • 3,20-Dioxopregn-4-en-21-yl 4-bromobenzenesulfonate
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