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Cucurbitacin B

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Identification
Molecular formula
C32H48O8
CAS number
6199-67-3
IUPAC name
5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
State
State
Solid at room temperature.
Melting point (Celsius)
217.00
Melting point (Kelvin)
490.15
Boiling point (Celsius)
512.00
Boiling point (Kelvin)
785.15
General information
Molecular weight
559.66g/mol
Molar mass
559.6620g/mol
Density
1.2800g/cm3
Appearence

Crystalline solid with a white to off-white color.

Comment on solubility

Solubility Characteristics of C32H48O8

The compound 5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde exhibits intriguing solubility properties. Understanding its solubility profile is essential for its potential applications in various fields.

Factors Influencing Solubility

The solubility of this compound may be influenced by several factors:

  • Polarity: Due to the presence of multiple hydroxyl (-OH) groups, the compound is likely to exhibit polar characteristics, which generally enhance solubility in polar solvents such as water.
  • Molecular Size: The large size of the molecule may hinder its solubility in less polar solvents. Large molecules often face steric hindrance in solvent interactions.
  • Hydrogen Bonding: The presence of multiple hydroxyl groups facilitates hydrogen bonding with solvent molecules, potentially increasing solubility in alcohols and other hydrogen-bonding solvents.

Expected Solubility

Given its chemical structure, one might expect the following:

  • Relatively high solubility in polar organic solvents like ethanol and methanol.
  • Limited solubility in non-polar solvents (e.g., hexane or chloroform) due to the extensive hydroxyl functionality.
  • Possible solubility in water, though the extent may vary based on temperature and pH.

In summary, while the intricate structure of C32H48O8 suggests good solubility in polar environments, its overall solubility behavior will need to be systematically studied through experimental methods for precise quantification.

Interesting facts

Interesting Facts about 5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde

This compound is a fascinating example of a complex organic molecule with remarkable structural features that make it a subject of interest in the field of organic chemistry and pharmacology. Here are some intriguing facts about it:

  • Natural Origins: Many compounds with similar structures are often found in nature, particularly in plants, known for their medicinal properties.
  • Biodiversity Influence: The intricate intertwined hydroxyl and furan groups may contribute to the biological activity of this molecule, potentially impacting human health and enhancing its therapeutic effects.
  • Chirality: The numerous stereocenters present in this compound allow for a range of stereoisomers, providing fertile ground for research into their respective biological activities and roles in nature.
  • Applications in Medicine: Investigations into similar compounds have revealed their potential as anti-inflammatory agents, antioxidants, and even anticancer drugs, highlighting the compound’s promise in pharmaceutical applications.
  • Structural Insights: The cyclopenta[a]phenanthrene structure is noteworthy, as it represents a class of compounds related to steroid hormones, that are crucial in biological systems.
  • Research Focus: Ongoing studies may reveal this compound's mechanism of action, helping to tailor it for specific therapeutic uses or modifications.

As scientists deepen their understanding of complex organic molecules like this one, the expectation is that its unique structure will lead to innovative applications in health and wellness. Exploration of such compounds reinforces the significance of chemistry in contributing to both scientific knowledge and societal benefits.

Synonyms
Desglucocheirotoxin
5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
NSC407808
5822-57-1
Strophalloside
Strophanthidin 6-deoxyglucoside
Degluco-Cheirotoxin
Rhamnoside, .alpha.-L-
3-[(6-deoxyhexopyranosyl)oxy]-5,14-dihydroxy-19-oxocard-20(22)-enolide
Cheirotoxin, degluco- (7CI)
CHEBI:169635
Card-20(22)-enolide,3-[(6-deoxy-b-D-gulopyranosyl)oxy]-5,14-dihydroxy-19-oxo-,(3b,5b)-
NCI60_003894
DB-051854
Strophanthidin, 3-(6-deoxy-.alpha.-L-mannopyranoside)
WLN: L E5 B666TJ AVH E1 IQ MQ F- DT5OV EHJ& OO- BT6OTJ CQ DQ EQ F1
5,14-dihydroxy-13-methyl-17-(5-oxo-2H-uran-3-yl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde