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Acetyl-Coenzyme A

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Identification
Molecular formula
C23H38N7O17P3S
CAS number
72-89-9
IUPAC name
[4-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethylsulfanyl]-4-oxo-but-2-enyl]-trimethyl-ammonium
State
State

At room temperature, Acetyl-Coenzyme A exists as a solid compound. It is stable under normal conditions but must be handled with care in laboratory settings to prevent degradation.

Melting point (Celsius)
56.00
Melting point (Kelvin)
329.15
Boiling point (Celsius)
86.30
Boiling point (Kelvin)
359.45
General information
Molecular weight
809.76g/mol
Molar mass
809.7560g/mol
Density
1.2800g/cm3
Appearence

Acetyl-Coenzyme A, or Acetyl-CoA, is a solid compound which often appears as a white powder. It is a vital coenzyme in metabolism, contributing to the synthesis and oxidation of fatty acids.

Comment on solubility

Solubility of the Compound

The compound 4-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethylsulfanyl]-4-oxo-but-2-enyl]-trimethyl-ammonium (C23H38N7O17P3S) presents interesting solubility characteristics worthy of discussion.


Due to its complex structure, several factors influence its solubility:

  • Polarity: The presence of numerous functional groups, such as hydroxyl (-OH) and phosphate (-PO42-), increases the polarity of the molecule, which generally enhances solubility in polar solvents like water.
  • Hydrophilicity: The phosphoryl groups and amino functionalities can interact favorably with water molecules, suggesting a good degree of hydrophilicity.
  • Size and Sterics: The relatively large size and sterical hindrance posed by multiple substituents can affect the ability of the compound to dissolve, often leading to lower solubility in non-polar or less polar environments.

In conclusion, while this compound's intricate architecture may pose some limitations to its solubility in certain organic solvents, its highly polar nature and functional groups likely confer substantial solubility in aqueous environments. Understanding these dynamics is crucial for applications in fields such as pharmaceuticals or biochemistry, where solubility plays a key role in efficacy and delivery.

Interesting facts

Interesting Facts about 4-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethylsulfanyl]-4-oxo-but-2-enyl]-trimethyl-ammonium

This complex compound shines a light on the fascinating world of organic chemistry, particularly in the realms of pharmaceuticals and biochemistry. Here are some captivating points to consider:

  • Structural Complexity: The compound features a unique configuration that includes multiple functional groups such as –OH (hydroxyl groups), –PO4 (phosphate groups), and sulfonamide linkages. This structural arrangement contributes to its potential biological activity.
  • Biological Significance: The presence of the purine base (6-aminopurine) indicates its potential utility in nucleic acid related applications or as a building block for biologically active molecules. Compounds related to purines are essential in various biochemical processes, including DNA and RNA synthesis.
  • Pharmacological Potential: The combination of phosphonate and phosphoramide moieties suggests that this compound may possess interesting drug-like properties. Researchers often explore variations of similar structures for their potential in treating diseases such as cancer or viral infections.
  • Drug Delivery Systems: The intricate design might also serve in the development of targeted drug delivery systems, where its multifaceted architecture aids in enhanced absorption or specificity to target cells.
  • Innovative Synthetic Pathways: The synthesis of such a complex molecule often forces chemists to devise ingenious synthetic pathways. This might include methods like coupling reactions, phosphonation, and selective reductions, which are essential skills in modern synthetic chemistry.

In summary, the exploration of compounds like 4-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethylsulfanyl]-4-oxo-but-2-enyl]-trimethyl-ammonium provides invaluable insights into the evolving landscape of medicinal chemistry and the interplay between structure and function in drug design.