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Azasimilanin E

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Identification
Molecular formula
C32H38N2O9
CAS number
212784-88-4
IUPAC name
(11-ethyl-3,8-dihydroxy-4,6,16-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl) 2-acetamidobenzoate
State
State

At room temperature, Azasimilanin E is typically found in a solid state. The compound is stable under normal conditions and does not sublimate easily.

Melting point (Celsius)
215.00
Melting point (Kelvin)
488.15
Boiling point (Celsius)
435.00
Boiling point (Kelvin)
708.15
General information
Molecular weight
599.67g/mol
Molar mass
599.6700g/mol
Density
1.2500g/cm3
Appearence

Azasimilanin E appears as an off-white to pale yellow amorphous powder. It has no distinct smell and is typically stored as a dry solid. Its color and texture can depend on the purity and specific preparation method.

Comment on solubility

Solubility of (11-ethyl-3,8-dihydroxy-4,6,16-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl) 2-acetamidobenzoate

The solubility of the compound (11-ethyl-3,8-dihydroxy-4,6,16-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl) 2-acetamidobenzoate (C32H38N2O9) is influenced by its complex molecular structure and functional groups present. Understanding solubility is crucial in the context of its applications, particularly in pharmaceuticals and material sciences.

Factors Affecting Solubility:

  • Polarity: The presence of multiple hydroxyl (-OH) and methoxy (-OCH3) groups enhances the ability of the compound to form hydrogen bonds with solvents, particularly polar solvents like water.
  • Hydrophobic Moieties: The extensive hydrocarbon portions within the structure may contribute to hydrophobic interactions, which can limit solubility in aqueous environments.
  • pH Sensitivity: The solubility may vary with pH, especially due to the acetamido group which can influence ionization, thereby affecting the overall solubility profile.

In general, compounds with similar complex structures are expected to exhibit variable solubility, often dissolving better in organic solvents rather than in water. This characteristic can make solvent selection a critical factor in the utilization of this compound in various chemical applications.

As with many organic compounds, it is essential to perform solubility tests under different conditions to precisely determine the solubility profile for specific applications.

Interesting facts

Interesting Facts about (11-ethyl-3,8-dihydroxy-4,6,16-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl) 2-acetamidobenzoate

This compound, known for its complex structure, exemplifies the fascinating world of organic chemistry and can be studied through various lenses. Here are some compelling aspects:

  • Diverse Functional Groups: The presence of multiple functional groups such as hydroxyl (-OH) and methoxy (-OCH3) groups plays a significant role in defining the compound's reactivity and properties.
  • Intricate Structure: Its unique heptacyclic structure showcases the beauty of cyclization in organic molecules, indicating potential for interesting steric interactions and conformational variety.
  • Potential Applications: Due to its complex architecture, this compound has potential medicinal applications, particularly in the field of pharmacology where compounds with multiple functional groups often exhibit biological activity.
  • Research Interest: It serves as a subject of interest in natural product chemistry, particularly for researchers exploring novel compounds with therapeutic potential derived from plants or other biological sources.
  • Analytical Challenge: The molecular complexity presents challenges in analytical characterization, making it a worthy topic for students and researchers aiming to master techniques such as NMR and mass spectrometry.

Exploring this compound not only enhances one’s understanding of organic synthesis but also opens doors to discussions about the evolving role of chemistry in developing new therapeutic agents. As chemists continue to delve into the intricacies of such compounds, we can expect new discoveries that could significantly impact fields such as medicinal chemistry and biochemistry.

Synonyms
lappaconitine
(+)-Lappaconitine
32854-75-4
Lannaconitine
NSC304666
(11-Ethyl-3,8-dihydroxy-4,6,16-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl) 2-acetamidobenzoate
BCP19975
AKOS000591682
AKOS030487486
NSC-304666
DB-050174
(ethyl-dihydroxy-trimethoxy-[?]yl) 2-acetamidobenzoate
20-Ethyl-8,9-dihydroxy-1,14,16-trimethoxyaconitan-4-yl 2-(acetylamino)benzoate
11-ethyl-3,8-dihydroxy-4,6,16-trimethoxy-11-azahexacyclo[7.7.2.1(2),?.0(1),(1)?.0(3),?.0(1)(3),(1)?]nonadecan-13-yl 2-acetamidobenzoate