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Coenzyme A

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Identification
Molecular formula
C21H36N7O16P3S
CAS number
85-61-0
IUPAC name
3-[2-[3-[[4-[[[(2R,3S,4R,5R)-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]-3-oxo-propanoic acid
State
State

At room temperature, Coenzyme A is typically encountered as a solid in its pure, isolated form.

Melting point (Celsius)
0.00
Melting point (Kelvin)
0.00
Boiling point (Celsius)
0.00
Boiling point (Kelvin)
0.00
General information
Molecular weight
767.53g/mol
Molar mass
767.5320g/mol
Density
1.3409g/cm3
Appearence

Coenzyme A is typically a white or off-white powder. It is a coenzyme, notable for its role in the synthesis and oxidation of fatty acids and the oxidation of pyruvate in the citric acid cycle.

Comment on solubility

Solubility of 3-[2-[3-[[4-[[[(2R,3S,4R,5R)-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]-3-oxo-propanoic acid

This complex compound possesses unique structural features that influence its solubility behavior significantly. Understanding the solubility of this compound can be vital for its application in pharmaceuticals and biochemistry.

Key Factors Affecting Solubility:

  • Functional Groups: The presence of multiple hydroxyl (-OH) groups and phosphate moieties enhances hydrophilicity, suggesting improved solubility in aqueous environments.
  • Amine Groups: The existence of amine functional groups can facilitate ionization in solution, further enhancing solubility.
  • Stereochemistry: The stereochemical configuration may influence the compound's interaction with solvents at a molecular level, affecting solubility dynamics.

In summary, the solubility of this compound is likely to be high in aqueous solutions due to its extensive polar functional groups. However, the exact solubility can also vary based on the pH of the solution and other solvation parameters. As a general observation, *highly functionalized compounds* tend to showcase increased solubility, making them particularly versatile in various chemical and biological applications.

Interesting facts

Interesting Facts about the Compound

This compound, known for its complex structure, showcases the intricacies of modern organic chemistry. Here are some fascinating points to consider:

  • Biological Significance: The compound contains a purine derivative, which suggests potential roles in biological systems, particularly in nucleic acid metabolism.
  • Phosphorylation: The multiple phosphate groups in its structure indicate that this compound might play a crucial role in energy transfer and signaling pathways within cells.
  • Medicinal Chemistry: Given its sophisticated configuration, this compound could be a candidate for drug development, particularly in fields like cancer therapy or viral infections.
  • Structure-Activity Relationship: Understanding how each functional group contributes to the overall activity of the compound is a stimulating challenge for chemists and pharmacologists alike.
  • Potential Applications: The incorporation of various functional groups suggests potential uses in targeted drug delivery systems, enhancing the bioavailability and efficacy of therapeutic agents.

The compound exemplifies how intricate molecular designs can lead to significant biological and pharmacological activity. Its multifaceted structure provides a rich area for research, particularly in understanding the interactions at the molecular level.
As chemists and students delve into its properties, the insights gained may open new avenues for innovations in therapeutic strategies.

Synonyms
UNII-LNB9YCJ9F9
SCHEMBL14593552
CHEBI:37555
MCC7955