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Ursodeoxycholic acid

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Identification
Molecular formula
C24H38O4
CAS number
128-13-2
IUPAC name
2-[4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid
State
State

At room temperature, ursodeoxycholic acid is in a solid state.

Melting point (Celsius)
203.00
Melting point (Kelvin)
476.15
Boiling point (Celsius)
595.00
Boiling point (Kelvin)
868.15
General information
Molecular weight
392.57g/mol
Molar mass
392.5740g/mol
Density
1.2600g/cm3
Appearence

Ursodeoxycholic acid appears as a white powder. It is odorless and has a bitter taste.

Comment on solubility

Solubility of 2-[4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid

The solubility of the compound with the formula C24H38O4 can be quite complex, primarily due to its intricate molecular structure. Several factors contribute to its solubility characteristics:

  • Polarity: The presence of hydroxyl (–OH) groups suggests that parts of the molecule may engage in hydrogen bonding, which enhances solubility in polar solvents such as water.
  • Hydrocarbon Moiety: The significant hydrocarbon portions may inhibit solubility in polar solvents but increase compatibility with nonpolar solvents.
  • Chain Length: The length of the pentanoyl chain could also affect the solubility, potentially leading to lower solubility in water but increased solubility in organic solvents.
  • pH Sensitivity: As an amino acid derivative, its solubility may vary with pH; it could be more soluble in acidic or basic conditions.

In summary, the solubility of 2-[4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid will likely present variations depending on solvent type, temperature, and solution conditions.

Interesting facts

Interesting Facts about 2-[4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic Acid

This compound stands out due to its complex structure and potential biological significance. Here are some engaging facts about it:

  • Structural Complexity: The molecule showcases a sophisticated arrangement, featuring a tetradecahydro-cyclopenta[a]phenanthrene core which hints at its potential interactions in biological systems.
  • Hydroxyl Groups: With multiple hydroxyl groups present in its structure, this compound may exhibit unique solubility properties and can participate in a variety of hydrogen bonding scenarios, enhancing its reactivity and potential therapeutic applications.
  • Amidation: The presence of an acetic acid moiety linked through a pentanoyl group suggests that this compound could function as a precursor or intermediate in synthetic pathways, possibly with implications in medicinal chemistry.
  • Research Potential: Compounds like this one are often of interest in studies related to steroidal structures and their derivatives, particularly in the realm of drug discovery and the development of new therapeutics.
  • Biological Activity: Given its structural attributes, it's plausible that this compound could interact with various biological receptors, which might lead to significant biological effects worth further investigation.

In conclusion, the synthesis and exploration of such intricate compounds can unveil valuable insights into their functionality and pave the way for innovative applications in fields ranging from pharmaceuticals to materials science. As a chemistry student or researcher, delving into the structure and behavior of compounds like these can spark curiosity and inspire future discoveries!

Synonyms
n-(3,12-dihydroxy-24-oxocholan-24-yl)glycine
2-[4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid
Acid, Glycodeoxycholic
2-[[4-(3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-1-oxopentyl]amino]acetic acid
MFCD00067133
CHEBI:91852
DTXSID80861898
HSCI1_000379
AKOS024288496
LS-15161
SY120981
BRD-A73859745-236-01-8
Q27163648