Epirubicin | Solubility of Things

Identification

Molecular formula

C₂₇H₂₉N₁O₁₁

CAS number

56420-45-2

IUPAC name

[6-[[6-[5-[5-(5-acetoxy-4-hydroxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-4-hydroxy-3-methyl-tetrahydropyran-2-yl]-4-hydroxy-3-methyl-tetrahydropyran-2-yl]oxy-7-(3,4-dihydroxy-1-methoxy-2-oxo-pentyl)-4,10-dihydroxy-3-methyl-5-oxo-7,8-dihydro-6H-anthracen-2-yl]oxy]-4-(4-hydroxy-5-methoxy-6-methyl-tetrahydropyran-2-yl)oxy-2-methyl-tetrahydropyran-3-yl] acetate

State

At room temperature, Epirubicin is generally in the form of a solid powder.

Melting point (Celsius)

245.00

Melting point (Kelvin)

518.15

Boiling point (Celsius)

605.74

Boiling point (Kelvin)

878.89

General information

Molecular weight

543.52g/mol

Molar mass

543.5180g/mol

Density

1.2900g/cm³

Appearence

Epirubicin is a red-orange powder.

Comment on solubility

Solubility of the Compound

The solubility of the compound with the chemical formula C₂₇H₂₉N₁O₁₁ is quite intriguing due to its complex structure. Here are some key points regarding its solubility:

Hydrophilicity: The presence of multiple hydroxyl groups (–OH) suggests that the compound may exhibit significant hydrophilicity, potentially leading to solubility in polar solvents such as water.
Hydrophobic Regions: On the other hand, certain hydrophobic segments in the molecule may limit its solubility in aqueous environments, indicating that solubility might be more favorable in organic solvents.
Esters and Acetates: The acetate functional group could enhance solubility in organic solvents, allowing for better dissolution in non-polar solutions.
Solvent Interaction: Compatibility with solvents can also be influenced by temperature and pH, affecting the solubility dynamics significantly.

Overall, while the compound may exhibit some level of solubility in water due to its hydroxyl groups, the balance between hydrophilic and hydrophobic components plays a critical role. Therefore, testing in various solvents would provide a comprehensive view of its solubility profile, proving essential for practical applications.

Interesting facts

Interesting Facts about 6-[[6-[5-[5-(5-acetoxy-4-hydroxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-4-hydroxy-3-methyl-tetrahydropyran-2-yl]-4-hydroxy-3-methyl-tetrahydropyran-2-yl]oxy-7-(3,4-dihydroxy-1-methoxy-2-oxo-pentyl)-4,10-dihydroxy-3-methyl-5-oxo-7,8-dihydro-6H-anthracen-2-yl]oxy]-4-(4-hydroxy-5-methoxy-6-methyl-tetrahydropyran-2-yl)oxy-2-methyl-tetrahydropyran-3-yl acetate

This complex organic compound represents a fascinating intersection of organic chemistry and pharmacology. Here are some insights into its structure and potential significance:

Diverse Functional Groups: The molecule incorporates various functional groups, such as acetoxy, hydroxy, and methoxy groups, which enhance its reactivity and potential functionality in biological systems.
Sugar Derivative Structure: The multiple tetrahydropyran rings within the structure suggest that this compound could be a sugar derivative, potentially influencing its interaction with biological receptors and systems.
Natural Product Inspiration: Many compounds of similar complexity are derived from natural products, highlighting the intricate relationships in nature between chemical diversity and biological activities.
Therapeutic Potential: Compounds with such extensive hydroxylation patterns often show a variety of biological activities including anti-inflammatory, antioxidant, or antimicrobial properties, making them targets for drug development.
Structure-Activity Relationship (SAR): The structural intricacies offer a rich field for studying SAR, allowing researchers to investigate how modifications could impact the compound's pharmacokinetics and pharmacodynamics.

In scientific discourse, one might say, "Nature has already optimized the designs for us," which truly encapsulates the journey of exploring such complex molecules. The intricacy of 6-[[6-[5-[5-(5-acetoxy-4-hydroxy-4,6-dimethyl-tetrahydropyran-2-yl)okka-4-hydroxy-3-methyl-tetrahydropyran-2-yl]-4-hydroxy-3-methyl-tetrahydropyran-2-yl]oxy-7-(3,4-dihydroxy-1-methoxy-2-oxo-pentyl)-4,10-dihydroxy-3-methyl-5-oxo-7,8-dihydro-6H-anthracen-2-yl]oxy]-4-(4-hydroxy-5-methoxy-6-methyl-tetrahydropyran-2-yl)oxy-2-methyl-tetrahydropyran-3-yl acetate not only sparks interest but also exemplifies the complexity of chemical synthesis and its relevance to medicine and biology.