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Quercetin sulfate

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Identification
Molecular formula
C27H30O21S2
CAS number
2081-66-1
IUPAC name
[2-methoxy-5-[(5-methoxy-3,4-disulfooxy-tetrahydropyran-2-yl)methoxymethyl]-3-sulfooxy-tetrahydropyran-4-yl] hydrogen sulfate
State
State

Solid at room temperature.

Melting point (Celsius)
185.00
Melting point (Kelvin)
458.15
Boiling point (Celsius)
215.00
Boiling point (Kelvin)
488.15
General information
Molecular weight
652.48g/mol
Molar mass
652.4780g/mol
Density
0.9520g/cm3
Appearence

This compound typically appears as a yellow crystalline powder. It may have a slight, characteristic odor. When dissolved, it can form a yellow solution.

Comment on solubility

Solubility Characteristics

The compound 2-methoxy-5-[(5-methoxy-3,4-disulfooxy-tetrahydropyran-2-yl)methoxymethyl]-3-sulfooxy-tetrahydropyran-4-yl hydrogen sulfate, with the chemical formula C27H30O21S2, presents intriguing solubility properties that can be influenced by its complex molecular structure. The presence of *multiple functional groups*, such as sulfonate and methoxy, significantly contributes to its overall solubility profile.

Key Factors Affecting Solubility

  • Polarity: The high degree of polarity due to sulfonate groups generally increases water solubility.
  • Hydrogen Bonding: The ability to form hydrogen bonds with water molecules enhances solubility in polar solvents.
  • Concentration of Sulfonate Groups: The dual sulfooxy groups are likely to impart strong ionic character, further aiding solubility in aqueous environments.

In summary, this compound is most likely to be soluble in water and other polar solvents, but less soluble in nonpolar solvents. As the solubility of such compounds can have a significant impact on their biological activity and practical applications, it is crucial to consider not just the *qualitative aspects* but also the *quantitative measures* of solubility in different environments.

Interesting facts

Interesting Facts about 2-Methoxy-5-[(5-methoxy-3,4-disulfooxy-tetrahydropyran-2-yl)methoxymethyl]-3-sulfooxy-tetrahydropyran-4-yl] Hydrogen Sulfate

This complex compound demonstrates the intricate world of organic chemistry, particularly in the field of glycosylation and sulfonation. Its structure reveals a fascinating interplay between multiple functional groups, which can have significant implications in biological systems.

Key Characteristics

  • Glycosylated Structure: The presence of tetrahydropyran rings indicates that this compound belongs to a category of naturally occurring sugars. Glycosylation often enhances the solubility and stability of carbohydrates.
  • Sulfate Groups: The two sulfate groups contribute to increased polarity, making the compound potentially useful in applications such as drug delivery and as biomolecular probes.
  • Functional Applications: Given its structure, this compound might be explored in the production of bioactive molecules, which could have potential medicinal properties or act as carbohydrate mimetics.
  • Natural Analogues: The compound could have analogues found in naturally occurring polysaccharides, suggesting a biological role that may mirror polysaccharide functions in human metabolism or cellular signaling.

Chemical Significance

The synthesis and study of such a compound can lead to important insights in:

  • Polymer Chemistry: Investigating how this compound interacts with other biomolecules could help in the design of new materials with specific properties.
  • Drug Development: With a focus on its potential therapeutic uses, the compound's unique components may be optimized for creating novel drugs.
  • Bioconjugation: The versatile functional groups allow for possible conjugation strategies in biochemistry, enhancing the ability to attach to other biomolecules.

In conclusion, 2-methoxy-5-[(5-methoxy-3,4-disulfooxy-tetrahydropyran-2-yl)methoxymethyl]-3-sulfooxy-tetrahydropyran-4-yl hydrogen sulfate presents a rich ground for research and innovation, holding promise for advancing our understanding of complex biomolecular interactions and developing new technologies in medicine and biology.