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Sinefungin

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Identification
Molecular formula
C16H26N6O4S
CAS number
58944-73-3
IUPAC name
2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl-methyl-sulfonio]butanoate
State
State

At room temperature, sinefungin is typically found in solid state as a powder.

Melting point (Celsius)
230.00
Melting point (Kelvin)
503.00
Boiling point (Celsius)
300.00
Boiling point (Kelvin)
573.00
General information
Molecular weight
389.48g/mol
Molar mass
389.4130g/mol
Density
1.6950g/cm3
Appearence

Sinefungin typically appears as a white or off-white powder. It is a nucleoside antibiotic which is closely related in structure to S-adenosylmethionine (SAM).

Comment on solubility

Solubility of 2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl-methyl-sulfonio]butanoate

The solubility of 2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl-methyl-sulfonio]butanoate (C16H26N6O4S) can be influenced by several factors due to its complex structure and the presence of functional groups. Here are some important considerations regarding its solubility:

  • Polarity: The presence of amine groups and sulfonium is likely to increase the polarity of the compound, potentially enhancing its solubility in polar solvents such as water.
  • Hydrogen Bonding: With multiple hydroxyl groups, this compound may form hydrogen bonds with water, further contributing to increased solubility.
  • Ionization: Depending on pH, the amino groups may become protonated, affecting solubility and promoting solubility in aqueous environments.
  • Solvent Interaction: Miscibility may vary significantly if tested in non-polar solvents, likely resulting in poor solubility.

In summary, while the structural characteristics of 2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl-methyl-sulfonio]butanoate suggest a higher solubility in polar solvents, experimental data would be essential to quantify and understand the specific solubility behavior of this bioactive compound.

Interesting facts

Interesting Facts about 2-Amino-4-[[5-(6-Aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl-methyl-sulfonio]butanoate

2-Amino-4-[[5-(6-Aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl-methyl-sulfonio]butanoate is a fascinating compound that plays a significant role in various biochemical applications. Here are some intriguing insights into this compound:

  • Biochemical Significance: This compound is closely related to the structures found in nucleic acids, particularly purines, which are essential for DNA and RNA function.
  • Potential Therapeutic Applications: Due to its structural similarity to important biological molecules, it has been researched for its potential as a therapeutic agent, particularly in oncology and viral infections.
  • Complex Structure: The presence of both amino and sulfonio groups introduces interesting reactivity and versatility in medicinal chemistry, allowing for modifications that can enhance its biological activity.
  • Research Interest: Scientists are continually exploring the pathways through which this compound exerts its effects, making it a subject of ongoing research in both organic and medicinal chemistry fields.
  • In Silico Studies: Advanced computational studies have been conducted to predict the behavior of this compound in biological systems, aiding in the design of more effective derivatives.

In summary, 2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl-methyl-sulfonio]butanoate represents a bridge between structural chemistry and biological activity, offering exciting prospects for future research and development in pharmacology.

Synonyms
17176-17-9
Probes1_000499
Probes2_000054
AKOS040759141