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Epothilone B

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Identification
Molecular formula
C27H41NO10
CAS number
153591-77-4
IUPAC name
dimethyl 12-acetoxy-4,7-dihydroxy-6-(2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.02,6.09,11]dodec-3-en-9-yl)-6-methyl-14-(2-methylbut-2-enoyloxy)-3,9-dioxatetracyclo[6.6.1.01,5.011,15]pentadecane-4,11-dicarboxylate
State
State

At room temperature, Epothilone B is a solid. It is known to be stable under normal temperatures and pressures.

Melting point (Celsius)
236.00
Melting point (Kelvin)
509.15
Boiling point (Celsius)
820.15
Boiling point (Kelvin)
1 093.15
General information
Molecular weight
743.94g/mol
Molar mass
743.9390g/mol
Density
1.3700g/cm3
Appearence

Epothilone B is a pale yellow solid. It is typically synthesized in a laboratory setting and its appearance can range from a crystalline to an amorphous substance depending on its level of purity and form.

Comment on solubility

Solubility of Dimethyl 12-acetoxy-4,7-dihydroxy-6-(2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.02,6.09,11]dodec-3-en-9-yl)-6-methyl-14-(2-methylbut-2-enoyloxy)-3,9-dioxatetracyclo[6.6.1.01,5.011,15]pentadecane-4,11-dicarboxylate

Understanding the solubility of a complex compound like dimethyl 12-acetoxy-4,7-dihydroxy-6-(2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.02,6.09,11]dodec-3-en-9-yl)-6-methyl-14-(2-methylbut-2-enoyloxy)-3,9-dioxatetracyclo[6.6.1.01,5.011,15]pentadecane-4,11-dicarboxylate (C27H41NO10) is crucial for its application in various fields. The solubility of this compound is influenced by several factors:

  • Molecular Structure: The presence of multiple functional groups can enhance solubility in polar solvents.
  • Hydrophobic and Hydrophilic Balance: With a significant number of oxygen atoms and hydroxyl groups, this compound could exhibit hydrophilic characteristics, albeit its substantial hydrophobic carbon chains may hinder total solubility in water.
  • Temperature: Like many organic compounds, increased temperature may improve solubility, allowing for greater dispersion in solvents.
  • pH Sensitivity: The solubility may also vary with pH levels due to the presence of carboxylate groups, which can ionize at different pH values.

In conclusion, while this compound's solubility can be expected in some organic solvents, its complex structure suggests a nuanced interaction that may vary substantially based on environmental conditions. As a result, researchers might want to conduct specific solubility tests to determine optimal conditions for its use.

Interesting facts

Interesting Facts about Dimethyl 12-Acetoxy-4,7-Dihydroxy-6-(2-Hydroxy-11-Methyl-5,7,10-Trioxatetracyclo[6.3.1.02,6.09,11]Dodec-3-En-9-Yl)-6-Methyl-14-(2-Methylbut-2-Enoyloxy)-3,9-Dioxatetracyclo[6.6.1.01,5.011,15]Pentadecane-4,11-Dicarboxylate

This compound, often referred to in shorthand due to its complex name, belongs to a fascinating class of organic compounds known for their rich structural diversity and biological activity. Here are some intriguing points about this compound:

  • Structural Complexity: The compound features a highly intricate structure with multiple functional groups. This complexity contributes to its potential applications in various fields of chemistry and biochemistry.
  • Natural Derivative: It is thought to be a natural derivative or inspired by naturally occurring molecules, reminiscent of compounds found in plants or microorganisms, which often exhibit unique properties.
  • Biological Activity: Many derivatives in this class have shown promising biological activities, including antibacterial, antifungal, and anticancer properties. Its structural components may play a significant role in their effectiveness.
  • Potential Applications: Because of its unique properties, research into this compound may lead to breakthroughs in pharmaceuticals, particularly in developing new medications that target specific biological pathways.
  • Research Interest: Due to its complex nature, it's a great subject for synthetic chemists looking to explore new methodologies for constructing intricate organic molecules.

Quote from a Chemist

As one molecular biologist put it, “The beauty of organic chemistry lies in the synthesis of complex molecules that can mimic nature's designs, revealing the intricacies of life itself.” This compound serves as a profound example of that sentiment.

In summary, this compound represents not only a wonderful journey into the depths of organic chemistry but also a beacon of potential in medicinal chemistry and related fields. The ongoing research and interest in compounds like this one highlight the continuous quest for innovation in science.

Synonyms
Dimethyl 10-(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-[(2-methylbut-2-enoyl)oxy]octahydro-1H,7H-naphtho[1,8a-c:4,5-b'c']difuran-5,10a(8H)-dicarboxylate
Dimethyl 10-(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro(2,3-b)oxireno(e)oxepin-1a(2H)-yl)-4-methyl-8-((2-methylbut-2-enoyl)oxy)octahydro-1H,7H-naphtho(1,8a-c:4,5-b'c')difuran-5,10a(8H)-dicarboxylate
dimethyl 12-acetyloxy-4,7-dihydroxy-6-(2-hydroxy-11-methyl-5,7,10-trioxatetracyclo(6.3.1.02,6.09,11)dodec-3-en-9-yl)-6-methyl-14-(2-methylbut-2-enoyloxy)-3,9-dioxatetracyclo(6.6.1.01,5.011,15)pentadecane-4,11-dicarboxylate
dimethyl 12-acetyloxy-4,7-dihydroxy-6-(2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.02,6.09,11]dodec-3-en-9-yl)-6-methyl-14-(2-methylbut-2-enoyloxy)-3,9-dioxatetracyclo[6.6.1.01,5.011,15]pentadecane-4,11-dicarboxylate
DTXSID70860092