CAS 1105542-94-6: (11β,16α)-16,17-[Butylidene-1,2,2,3,3,4,4,4-d8-bis(oxy)]-11,21-dihydroxypregna-1,4-diene-3,20-dione

Description: The chemical substance known as "(11β,16α)-16,17-[Butylidene-1,2,2,3,3,4,4,4-d8-bis(oxy)]-11,21-dihydroxypregna-1,4-diene-3,20-dione," with the CAS number 1105542-94-6, is a synthetic derivative of the steroid hormone class, specifically a modified form of progesterone. This compound features a complex structure characterized by multiple functional groups, including hydroxyl (-OH) and ether linkages, which contribute to its biological activity. The presence of deuterated butylidene groups indicates that it has been isotopically labeled, which can be useful in pharmacokinetic studies and metabolic tracing. Its structural modifications may enhance its binding affinity to steroid receptors, potentially influencing its efficacy and selectivity in therapeutic applications. Such compounds are often investigated for their potential roles in hormone replacement therapies, contraceptive formulations, or as anti-inflammatory agents. However, detailed studies on its pharmacodynamics, pharmacokinetics, and safety profile would be essential to fully understand its characteristics and potential uses in clinical settings.

Formula: C₂₅H₂₆D₈O₆

InChI: InChI=1S/C25H34O6/c1-4-5-21-30-20-11-17-16-7-6-14-10-15(27)8-9-23(14,2)22(16)18(28)12-24(17,3)25(20,31-21)19(29)13-26/h8-10,16-18,20-22,26,28H,4-7,11-13H2,1-3H3/t16-,17-,18-,20+,21?,22+,23-,24-,25+/m0/s1/i1D3,4D2,5D2,21D

InChI key: InChIKey=VOVIALXJUBGFJZ-SMANYZGRSA-N

SMILES: O=C1C=CC2(C(=C1)CCC3C4CC5OC(OC5(C(=O)CO)C4(C)CC(O)C32)CCC)C

Synonyms:

• (11β,16α)-16,17-[Butylidene-1,2,2,3,3,4,4,4-d8-bis(oxy)]-11,21-dihydroxypregna-1,4-diene-3,20-dione
• Pregna-1,4-diene-3,20-dione, 16,17-[butylidene-1,2,2,3,3,4,4,4-d8-bis(oxy)]-11,21-dihydroxy-, (11β,16α)-
• [D8]-Budesonide
• 2H8-Budesonide

Budesonide-d8 (Mixture of Diastereomers)

CAS: 1105542-94-6

• Formula: C₂₅H₂₆D₈O₆
• Color and Shape: White To Off-White Solid
• Molecular weight: 438.59

Budesonide-d8

CAS: 1105542-94-6

• Formula: C₂₅H₂₆D₈O₆
• Color and Shape: White
• Molecular weight: 438.58

Budesonide-d8

CAS: 1105542-94-6

Budesonide-d8 is an experimental model that has been used to study the effects of the …

• Formula: C₂₅H₂₆D₈O₆
• Purity: Min. 95%
• Color and Shape: Powder
• Molecular weight: 438.6 g/mol