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Dificid

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Identification
Molecular formula
C52H74Cl2O18
CAS number
873857-62-6
IUPAC name
2-[13-(2,3-dihydroxy-1-methyl-propyl)-8,22-dihydroxy-2,5,11,14,27,30,33,36,39-nonaoxo-34-sec-butyl-27lambda4-thia-3,6,12,15,25,29,32,35,38-nonazapentacyclo[14.12.11.06,10.018,26.019,24]nonatriaconta-18(26),19(24),20,22-tetraen-4-yl]acetamide
State
State

At room temperature, fidaxomicin is a solid.

Melting point (Celsius)
276.50
Melting point (Kelvin)
549.70
Boiling point (Celsius)
0.00
Boiling point (Kelvin)
0.00
General information
Molecular weight
1058.02g/mol
Molar mass
1 058.0240g/mol
Density
1.3200g/cm3
Appearence

Fidaxomicin appears as a white to off-white crystalline powder.

Comment on solubility

Solubility of 2-[13-(2,3-dihydroxy-1-methyl-propyl)-8,22-dihydroxy-2,5,11,14,27,30,33,36,39-nonaoxo-34-sec-butyl-27lambda4-thia-3,6,12,15,25,29,32,35,38-nonazapentacyclo[14.12.11.06,10.018,26.019,24]nonatriaconta-18(26),19(24),20,22-tetraen-4-yl]acetamide (C52H74Cl2O18)

The solubility characteristics of the compound C52H74Cl2O18 can be intriguing due to its extensive structural complexity. Solubility in various solvents often depends on several key factors:

  • Molecular Structure: The presence of various functional groups, such as hydroxyl (-OH) and acetamide (-COCH3), suggests potential for hydrogen bonding.
  • Polarity: Given the dual nature of its structure with hydrophobic (alkyl and aromatic portions) and hydrophilic (hydroxyl and amide groups) characteristics, expect a mix of solubility behaviors.
  • Solvent Interaction: The compound may exhibit solubility in both polar solvents (like water and methanol) as well as non-polar solvents (like chloroform or hexane), albeit to varying degrees.

In practical terms, we can summarize the solubility profile as:

  1. Highly soluble: In alcohols due to capacity for hydrogen bonding.
  2. Moderately soluble: In organic solvents like acetone or ethyl acetate.
  3. Low solubility: In water, despite hydroxyl groups, due to the bulkiness of the alkyl chains.

In conclusion, the solubility of C52H74Cl2O18 is influenced by its multifaceted structure and the interplay of hydrophilic and hydrophobic regions. This highly intricate compound serves as an excellent example of how solubility is not merely dictated by one factor but rather an interplay of several chemical characteristics.

Interesting facts

Interesting Facts about 2-[13-(2,3-dihydroxy-1-methyl-propyl)-8,22-dihydroxy-2,5,11,14,27,30,33,36,39-nonaoxo-34-sec-butyl-27lambda4-thia-3,6,12,15,25,29,32,35,38-nonazapentacyclo[14.12.11.06,10.018,26.019,24]nonatriaconta-18(26),19(24),20,22-tetraen-4-yl]acetamide

This compound is a fascinating example of complex organic chemistry, showcasing the intricate possibilities of molecular architecture. Here are some noteworthy points about this compound:

  • Structural Complexity: The structure of this compound involves multiple functional groups and a highly branched carbon backbone that challenge the typical understanding of molecular assembly.
  • Biological Significance: Compounds with similar architectures are often investigated for their potential biological activities and therapeutic applications, hinting at the possibilities of drug design.
  • High Stability: The cyclic and polyfunctional nature of this molecule typically grants it a level of stability which can be advantageous in various chemical reactions or biological environments.
  • Utilization in Research: Such compounds are often utilized in research settings to study interactions with biological macromolecules, which can lead to advancements in pharmaceuticals.
  • Chiral Centers: The presence of dihydroxy and other stereogenic centers suggests chirality, making enantiomeric forms significant in biological interactions.

As a scientist or a chemistry student, exploring such sophisticated compounds enhances the understanding of structure-activity relationships (SAR) and demonstrates how minute changes at the molecular level can impact biological functions radically.

Overall, this compound embodies the excitement of modern chemistry, where each discovery not only deepens our knowledge but also opens new avenues in scientific and therapeutic realms. It is a testament to the power of chemical innovation and its potential to inspire future explorations.

Synonyms
alpha-amanitin
23109-05-9
alpha-Amanitine
Amanitin
alpha -Amanitin
CBiol_001932
CERAPP_20658
SCHEMBL3506327
BCBcMAP01_000054
DTXSID90860291
CIORWBWIBBPXCG-UHFFFAOYSA-N
Bio1_000218
Bio1_000707
Bio1_001196
SMP1_000013
DA-60946
LS-15416
alpha-Amanitin, from Amanita phalloides, >=90% (HPLC), powder
2-[(2,3-dihydroxy-1-methyl-propyl)-dihydroxy-nonaoxo-sec-butyl-[?]yl]acetamide
9,18-(Iminoethaniminoethaniminoethaniminomethano)pyrrolo[1',2':8,9][1,5,8,11,14]thiatetraazacyclooctadecino[18,17-b]indole Cyclic Peptide Deriv.;Cyclo[L-alpha-aspartyl-(4R)-4-hydroxy-L-prolyl-(4R)-4,5-dihydroxy-L-isoleucyl-6-hydroxy-2-mercapto-L-tryptophylglycyl-L-isoleucylglycyl-L-cysteinyl] Cyclic (4->8)-Thioether (R)-S-Oxide