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Cardiogenol C7

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Identification
Molecular formula
C21H28O6
CAS number
518-28-5
IUPAC name
(3S,5R,10R,13R,14S,16S,17R)-3,14,16-trihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-10-carbaldehyde
State
State

The compound is typically found as a solid at room temperature. It retains its structure in typical atmospheric conditions, providing chemical stability and ease of handling in solid-state applications.

Melting point (Celsius)
258.50
Melting point (Kelvin)
531.65
Boiling point (Celsius)
472.15
Boiling point (Kelvin)
745.30
General information
Molecular weight
426.45g/mol
Molar mass
426.5510g/mol
Density
1.2350g/cm3
Appearence

The compound appears as a white crystalline powder. It is often characterized by its fine particulate form and lack of color, making it distinct in appearance.

Comment on solubility

Solubility of (3S,5R,10R,13R,14S,16S,17R)-3,14,16-trihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-10-carbaldehyde

This compound exhibits unique solubility properties, largely influenced by its complex structure. Its solubility can vary significantly depending on several factors:

  • Polarity: With multiple hydroxyl (-OH) groups, the compound is expected to have increased polarity, which may lead to better solubility in polar solvents such as water and alcohols.
  • Hydrophobic Regions: The tetradecahydrocyclopenta[a]phenanthrene core suggests that there are significant hydrophobic regions. This implies that the compound may also be soluble in non-polar solvents like hexane or benzene.
  • Temperature Effects: Solubility may further change with temperature; generally, higher temperatures can lead to higher solubility for many organic compounds.
  • pH Dependence: The presence of hydroxyl groups can lead to variations in solubility with changes in pH, particularly if the compound can participate in acid-base reactions.

In practical terms, the solubility of this compound is best determined experimentally, considering various solvent systems to comprehensively understand its behavior. As with many organic compounds, achieving an ideal solvent for dissolving this compound may entail balancing hydrophilic and hydrophobic characteristics.

Interesting facts

Interesting Facts about (3S,5R,10R,13R,14S,16S,17R)-3,14,16-trihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-10-carbaldehyde

This complex chemical compound, with a lengthy name reflecting its intricate structure, is a fascinating subject in organic chemistry. It encapsulates various functional groups, lending itself to numerous properties and potential applications.

Structural Diversity

The structure of this compound includes:

  • Hydroxyl groups: Three hydroxyl groups provide significant reactivity and can influence the compound's biological activity.
  • Furan ring: The 5-oxo-2H-furan-3-yl moiety contributes to its unique chemical behavior, possibly enhancing its reactivity towards nucleophiles.
  • Aldehyde functionality: The presence of a carbaldehyde group suggests potential for further derivatization and use in synthesis.

Biological Relevance

Compounds like this often serve as lead structures in drug discovery owing to their complex arrangements. They can exhibit:

  • Antimicrobial properties: Similar structures have shown efficacy against various pathogens.
  • Anti-inflammatory activity: The hydroxyl groups can play a role in modulating inflammatory pathways.

Environmental Significance

Such compounds may also hold importance in environmental chemistry, where they can act as:

  • Biodegradable agents: Their natural origin could contribute to sustainability in chemical production.
  • Indicators of ecosystem health: Detection of similar compounds may help assess pollution levels in aquatic systems.

In summary, this compound is not just a feat of synthetic chemistry, but its multifaceted interactions in biological systems and environmental settings underscore its importance in ongoing research and development. As noted by chemists, "The complexity of structures often translates into equally complex behaviors." This compound is a prime example of that intriguing relationship.

Synonyms
DTXSID00963661
3,14,16-Trihydroxy-19-oxocard-20(22)-enolide