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Avermectin B1b aglycon derivative

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Identification
Molecular formula
C43H57NO8
CAS number
71827-03-7
IUPAC name
(16-benzyl-5,12-dihydroxy-5,7,14-trimethyl-13-methylene-6,18-dioxo-17-azatricyclo[9.7.0.01,15]octadeca-3,9-dien-2-yl) acetate
State
State
Typically, this compound is in a solid state at room temperature, often found in crystalline form, indicating its stability and defined chemical structure.
Melting point (Celsius)
184.00
Melting point (Kelvin)
457.15
Boiling point (Celsius)
295.00
Boiling point (Kelvin)
568.15
General information
Molecular weight
813.02g/mol
Molar mass
813.0220g/mol
Density
1.2700g/cm3
Appearence

This compound typically appears as a solid substance with a crystalline structure. The color may vary depending on the specific isomer or derivative, ranging from off-white to pale yellow.

Comment on solubility

Solubility Insights on (16-benzyl-5,12-dihydroxy-5,7,14-trimethyl-13-methylene-6,18-dioxo-17-azatricyclo[9.7.0.01,15]octadeca-3,9-dien-2-yl) acetate

The solubility of this complex organic compound is influenced by multiple factors, primarily due to its intricate molecular structure.

Key Factors Affecting Solubility:

  • Polarity: The presence of hydroxyl groups (-OH) generally enhances solubility in polar solvents, while the extensive hydrocarbon structure may limit solubility in water.
  • Structural Configuration: The aromatic and aliphatic portions of the molecule could contribute varying degrees of hydrophobic character, affecting how the compound interacts with its solvent.
  • Hydrogen Bonding: The capacity for hydrogen bonding due to hydroxyl functionality may allow for solubility in alcohols and ethers.

As a result, one might find that:

  • It may exhibit some degree of solubility in non-polar organic solvents (like hexane) due to its large hydrophobic chains.
  • Moderate solubility can be observed in more polar solvents like ethanol and chloroform.
  • Limited solubility in water is likely, emphasizing its organic characteristics.

To summarize, predicting the solubility of (16-benzyl-5,12-dihydroxy-5,7,14-trimethyl-13-methylene-6,18-dioxo-17-azatricyclo[9.7.0.01,15]octadeca-3,9-dien-2-yl) acetate requires consideration of its complex molecular interactions and solvent types, where **"like dissolves like"** is a crucial guiding principle.

Interesting facts

Interesting Facts about 16-benzyl-5,12-dihydroxy-5,7,14-trimethyl-13-methylene-6,18-dioxo-17-azatricyclo[9.7.0.01,15]octadeca-3,9-dien-2-yl Acetate

This complex organic compound belongs to a class of molecules known for their unique structural attributes and potential biological activity. Here are some fascinating insights:

  • Structural Complexity: The compound features a tricyclic structure, which contributes to its intriguing three-dimensional arrangement. The presence of multiple functional groups like hydroxyls and carbonyls makes it a candidate for various chemical transformations.
  • Biological Potential: Compounds with similar frameworks are often investigated for their medicinal properties. Many such chemicals exhibit antimicrobial or antitumor activities, suggesting possible applications in pharmaceutical development.
  • Natural Occurrence: This compound’s structural characteristics may hint at a natural origin, allowing for a deeper exploration into the biosynthetic pathways that lead to its formation. Studying its biosynthesis could unveil new insights into natural product chemistry.
  • Research Interest: The adaptable nature of such molecules makes them popular in chemical research. They often serve as scaffolds in the design of new drugs, leading to a further understanding of their effects on biological systems.
  • Functionalization Opportunities: The numerous functional groups present in the structure of 16-benzyl-5,12-dihydroxy-5,7,14-trimethyl-13-methylene-6,18-dioxo-17-azatricyclo[9.7.0.01,15]octadeca-3,9-dien-2-yl acetate offer ample opportunities for synthetic modifications, paving the way for novel derivatives with enhanced properties.

In summary, the diverse potential applications and research interests surrounding this compound make it a noteworthy subject in the realm of chemistry. Its intricate molecular framework not only sparks curiosity but also emphasizes the importance of interdisciplinary collaboration in exploring its full range of capabilities.

Synonyms
Neuro_000109
Zygosporin A; Lygosporin A
DTXSID10860273
BCP20993
DB-045817
3-benzyl-6,12-dihydroxy-4,10,12-trimethyl-5-methylidene-1,11-dioxo-2,3,3a,4,5,6,6a,9,10,11,12,15-dodecahydro-1H-cycloundeca[d]isoindol-15-yl acetate