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(2beta,3alpha,5alpha,16beta,17beta)-3,17-Diacetoxy-16-(1-methyl-1-piperidiniumyl)-2-(1-piperidinyl)androstane bromide(CAS: 50700-72-6)

(2beta,3alpha,5alpha,16beta,17beta)-3,17-Diacetoxy-16-(1-methyl-1-piperidiniumyl)-2-(1-piperidinyl)androstane bromide
CAS Number

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Basic Information

Molecular Formula
C34H57BrN2O4
Molecular Weight
637.7 g/mol

Physical Properties

Melting Point
227-234°C
Boiling Point
No data available
Density
==
Flash Point
No data available

Chemical Identifiers

SMILES
CC(=O)OC1CC2CCC3C(C2(CC1N4CCCCC4)C)CCC5(C3CC(C5OC(=O)C)[N+]6(CCCCC6)C)C.[Br-]
InChIKey
VEPSYABRBFXYIB-PWXDFCLTSA-M

Database References

MDL Number
MFCD00867762

FAQ

This compound is a synthetic steroid derivative with a complex molecular structure, featuring acetoxy groups at positions 3 and 17, a piperidinium substituent at position 16, and a methyl group on the piperidinium ring. Its chemical formula is C24H39NO6Br, and it exhibits specific stereochemistry (2beta,3alpha,5alpha,16beta,17beta) and bromide functionality. It is primarily used in research settings for pharmaceutical development and biochemical studies due to its potential as a precursor in drug synthesis.
The compound is mainly utilized in pharmaceutical research for developing drugs targeting hormonal disorders and as a synthetic intermediate in the production of steroid-based medications. It also serves in biochemical studies to investigate molecular interactions and may have applications in medicinal chemistry for creating novel therapeutics. Its unique structure makes it relevant for drug design and formulation studies.
Safety precautions must be followed when handling this compound due to its bromide and piperidinium groups, which may pose irritant or toxic risks. It is typically regulated under chemical safety standards and requires proper protective equipment, such as gloves and goggles, during use. Always consult safety data sheets (SDS) for detailed handling guidelines and ensure compliance with local hazardous material regulations.
This compound should be stored in a cool, dry place (ideally 2-8°C), away from light, and in a sealed, airtight container to prevent moisture ingress. It is sensitive to humidity and light exposure, which may affect its stability. Storage conditions should maintain a controlled environment to ensure longevity, and it should be kept in a chemical-resistant container as per safety standards.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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