Coenzyme A | Solubility of Things

Identification

Molecular formula

C₂₁H₃₆N₇O₁₆P₃S

CAS number

85-61-0

IUPAC name

S-[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]ethyl] 3-hydroxy-5-oxo-hexanethioate

State

At room temperature, Coenzyme A is typically found as a solid in the form of a powder.

Melting point (Celsius)

160.00

Melting point (Kelvin)

433.15

Boiling point (Celsius)

484.15

Boiling point (Kelvin)

757.30

General information

Molecular weight

767.54g/mol

Molar mass

767.5350g/mol

Density

0.7959g/cm³

Appearence

Coenzyme A (CoA) typically appears as a white to off-white powder.

Comment on solubility

Solubility Characteristics of S-[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]ethyl] 3-hydroxy-5-oxo-hexanethioate

This compound, with the chemical formula C₂₁H₃₆N₇O₁₆P₃S, exhibits complex solubility behavior due to its intricate molecular structure. Understanding its solubility is crucial for applications in biochemical environments, particularly given the varied functional groups present within the molecule.

Solubility Profile

Overall, the solubility of this compound can be influenced by several factors:

Polarity: The presence of numerous hydroxyl (–OH) groups and a phosphonate moiety suggests a degree of polarity, potentially leading to enhanced solubility in polar solvents such as water.
Hydrophobic Regions: The hydrocarbon backbone and certain hydrocarbon entities might impart hydrophobic characteristics, affecting solubility in non-polar solvents.
Conformation: The three-dimensional arrangement of the molecule can influence solubility, as steric hindrance might impede interactions with solvent molecules.

Solvent Interactions

As a result of these properties, this compound is likely:

Highly soluble in: Polar solvents like water and alcohols due to its functional groups.
Less soluble in: Non-polar solvents such as hexane or cyclohexane because of its structure.

In summary, the solubility of this compound is a balanced interplay of its chemical characteristics, defining its behavior in various solvent environments. Researchers must consider these factors when formulating solutions for experimental and therapeutic applications.

Interesting facts

Interesting Facts about S-[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]ethyl] 3-hydroxy-5-oxo-hexanethioate

This intriguing compound is a complex nucleotide derivative that showcases the elegance of chemical synthesis in biological systems. Below are some notable points worth considering:

Biological Significance: It may play a role in various biochemical pathways, particularly related to nucleic acid metabolism and cellular signaling.
Structural Complexity: The compound features multiple functional groups, including phosphono and hydroxy moieties, which enhance its reactivity and interaction potential with biological molecules.
Origin: The presence of the 5-(6-aminopurin-9-yl) structure indicates its potential involvement in purine metabolism, essential for DNA and RNA synthesis.
Synthetic Importance: The synthesis of such a compound can serve as a fascinating laboratory project, exemplifying multi-step organic reactions and the challenges of achieving stereochemical specificity.
Potential Applications: Given its structural characteristics, this compound could have implications in drug development or as a biochemical probe, aiding in the comprehension of cellular processes.

Overall, this compound represents the intricate interplay of organic chemistry and biochemistry, illustrating how small changes in molecular structure can lead to profound effects in biological systems.