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2-{[(3alpha,5beta,12alpha)-3,12-Dihydroxy-24-oxocholan-24-yl]amino}ethanesulfonic acid(CAS: 516-50-7)

2-{[(3alpha,5beta,12alpha)-3,12-Dihydroxy-24-oxocholan-24-yl]amino}ethanesulfonic acid
CAS Number

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Basic Information

Molecular Formula
C26H45NO6S
Molecular Weight
499.71 g/mol

Chemical Identifiers

SMILES
CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)O)C)O)C
InChIKey
AWDRATDZQPNJFN-VAYUFCLWSA-N

Database References

MDL Number
MFCD00152175

FAQ

This compound must comply with the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations, and FDA/EPA regulations. It should be classified and labeled according to its hazardous properties, such as acute toxicity and skin irritation. Manufacturers and distributors must also register the compound with the European Chemicals Agency (ECHA) under REACH and ensure compliance with all relevant safety data sheets (SDS) and material safety data sheets (MSDS) requirements.
There are no direct alternatives to this specific compound, but similar cholate derivatives or other bile acid analogs can be used as substitutes in some applications. For synthesis, common alternative reagents include various carboxylic acids, aminoethanesulfonic acid analogs, and choline derivatives, depending on the intended use and desired properties.
The market for this compound is currently limited, but there is growing interest in its potential applications in biomedical research, particularly in studying bile acid metabolism and liver function. Research trends include investigating its role in drug delivery systems and its use as a model compound for bile acid-related diseases. Market trends indicate increasing demand for specialized chemical reagents in pharmaceutical and biotechnology sectors.
Waste containing this compound should be collected in appropriate containers and handled according to the local regulations for hazardous waste. Safe disposal methods include incineration or professional waste disposal services. Environmental protection precautions include proper ventilation and use of personal protective equipment (PPE) to prevent exposure. It is crucial to ensure the waste is treated and disposed of in a manner that minimizes environmental impact and complies with all relevant safety and environmental regulations.

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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