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Thapsigargin

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Identification
Molecular formula
C16H30OS
CAS number
67526-95-8
IUPAC name
2,16-dimethyl-5-thiapentacyclo[9.7.0.02,8.04,6.012,16]octadecan-15-ol
State
State

At room temperature, thapsigargin is a solid. It is typically stored in a cool, dry place to maintain its stability and prevent any degradation or reaction with atmospheric moisture.

Melting point (Celsius)
154.00
Melting point (Kelvin)
427.15
Boiling point (Celsius)
322.00
Boiling point (Kelvin)
595.15
General information
Molecular weight
650.84g/mol
Molar mass
650.8350g/mol
Density
1.2820g/cm3
Appearence

Thapsigargin is a white to off-white crystalline solid. Its appearance is typical of many organic crystalline compounds, with a nominal crystalline structure that provides a relatively high degree of purity in its solid form.

Comment on solubility

Solubility Characteristics of 2,16-Dimethyl-5-thiapentacyclo[9.7.0.02,8.04,6.012,16]octadecan-15-ol

The solubility of 2,16-dimethyl-5-thiapentacyclo[9.7.0.02,8.04,6.012,16]octadecan-15-ol (C16H30OS) is particularly intriguing due to its complex structure. A few key points about its solubility include:

  • Hydrophobic Nature: Due to the presence of multiple ring structures and long hydrocarbon chains, this compound is expected to exhibit significant hydrophobic characteristics, which often leads to poor solubility in polar solvents.
  • Solubility in Organic Solvents: It may have favorable solubility in organic solvents such as ethyl acetate, hexane, and other non-polar or slightly polar organic solvents.
  • Temperature Dependence: The solubility could be influenced by temperature, where increased temperatures may enhance solubility in organic media.
  • Potential for Applications: Despite low aqueous solubility, the compound may find utility in specialty applications where organic solvent solubility is desirable.

In summary, the solubility of C16H30OS is characterized by its hydrophobic properties, limited solubility in water, and favorable solubility in various organic solvents, making it a compound of interest in specific chemical pathways and applications.

Interesting facts

Exploring 2,16-Dimethyl-5-thiapentacyclo[9.7.0.02,8.04,6.012,16]octadecan-15-ol

2,16-Dimethyl-5-thiapentacyclo[9.7.0.02,8.04,6.012,16]octadecan-15-ol is a fascinating compound with a unique structure and potential applications. Below are some intriguing facts about this compound:

  • Complex Structure: The *pentacyclic* structure of this compound showcases its intricate framework, which is significant in many biochemical pathways. Such complex architectures can contribute to enhanced stability and reactivity.
  • Thiapentacyclo Element: The presence of sulfur in its thiapentacyclo framework not only adds to the compound's uniqueness but also suggests potential applications in medicinal chemistry, particularly in designing novel therapeutics.
  • LogP Considerations: Compounds with similar structures often exhibit interesting lipophilicity properties, making them suitable for studying pharmacokinetics in drug design. The partition coefficient of a compound like this could provide insights into its absorption and distribution in biological systems.
  • Versatile Functionalities: The hydroxy group (-OH) at the 15th position could be an active site for various *chemical modifications*, potentially leading to derivatives with varied biological activities.
  • Research Applications: Compounds like this one are often studied for their *antimicrobial* or *antioxidant properties*, expanding their relevance beyond academic research into industry applications.

As we delve deeper into the properties and applications of compounds like 2,16-dimethyl-5-thiapentacyclo[9.7.0.02,8.04,6.012,16]octadecan-15-ol, the more we unlock the potential for innovative solutions in both chemistry and biotechnology. The field is ripe for exploration, offering a platform for breakthroughs in drug discovery and materials science.

Synonyms
Thiodrol
2,3-Epithioandrostan-17-ol
10275S
2.alpha.,3.alpha.-Epithio-5.alpha.-androstan-17.beta.-ol
SCHEMBL1649917
CHEBI:95344
DTXSID30859720
OBMLHUPNRURLOK-UHFFFAOYSA-N
NSC194684
AKOS015898868
NS00123965
5.alpha.-Androstan-17.beta.-ol,3.alpha.-epithio-
Q5383718
2.alpha.,3.alpha.-Epithio-5.alpha.-androstan-17.beta.-o1
5.alpha.-Androstan-17.beta.-ol, 2.beta.,3.beta.-epithio-
Androstan-17-ol,3-epithio-, (2.alpha.,3.alpha.,5.alpha.,17.beta.)-
8a,10a-Dimethylhexadecahydro-1H-cyclopenta[7,8]phenanthro[2,3-b]thiiren-1-ol #