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Natural phenol derivative

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Identification
Molecular formula
C50H51N2O13
CAS number
1360777-33-4
IUPAC name
5-[3-[4-(6,8-dihydroxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-5-yl)-1-hydroxy-8-methoxy-6-methyl-2-naphthyl]-4-hydroxy-5-methoxy-7-methyl-1-naphthyl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol
State
State

At room temperature, this compound is typically found in a solid state, often as a powder.

Melting point (Celsius)
213.00
Melting point (Kelvin)
486.15
Boiling point (Celsius)
573.00
Boiling point (Kelvin)
846.15
General information
Molecular weight
905.07g/mol
Molar mass
905.0670g/mol
Density
1.2300g/cm3
Appearence

The compound typically exhibits an amorphous solid form. It is characterized by a pale yellow to off-white color, which can vary based on purity and environmental conditions.

Comment on solubility

Solubility of 5-[3-[4-(6,8-dihydroxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-5-yl)-1-hydroxy-8-methoxy-6-methyl-2-naphthyl]-4-hydroxy-5-methoxy-7-methyl-1-naphthyl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol

The solubility of the compound C50H51N2O13 is quite intriguing given its complex molecular structure. Understanding the solubility characteristics of this compound can be essential for its practical applications. Here are some key points to consider:

  • Polarity: Due to the presence of multiple hydroxyl groups, it is likely that this compound exhibits some degree of polarity, which enhances its solubility in polar solvents like water.
  • Hydrogen Bonding: The -OH groups contribute to the formation of hydrogen bonds, which can significantly increase solubility in aqueous environments.
  • Non-Polar Components: Conversely, the large non-polar hydrocarbon segments could lead to reduced solubility in highly polar solvents.
  • Solvent Dependence: Solubility is expected to vary in different solvents—polar protic, polar aprotic, and non-polar solvents may affect the dissolution process differently.

In summary, while the specific solubility data for this compound might not be extensively documented, its intricate structure suggests a multifaceted solubility profile influenced by both polar and non-polar characteristics. The compound may exhibit moderate to good solubility in suitable solvents, particularly those that can engage in hydrogen bonding.

Interesting facts

Interesting Facts about 5-[3-[4-(6,8-dihydroxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-5-yl)-1-hydroxy-8-methoxy-6-methyl-2-naphthyl]-4-hydroxy-5-methoxy-7-methyl-1-naphthyl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol

This compound is a fascinating example of the intersection of organic synthesis and medicinal chemistry. Here are some notable insights that can pique the interest of both scientists and students alike:

  • Complex Structure: The intricate structure features a combination of tetrahydroisoquinoline units coupled with naphthalene moieties, showcasing the creative and diverse configurations molecules can adopt.
  • Biological Significance: Compounds like this are of much interest due to their potential pharmaceutical properties. Research indicates that derivatives of tetrahydroisoquinoline exhibit various biological activities, including antioxidant and anticancer effects.
  • Synthetic Challenges: The synthesis of such complex organic compounds often involves multiple reaction steps, making it a rewarding challenge for organic chemists. The ability to refine and optimally produce these compounds speaks to the art of organic synthesis.
  • Pharmacophore Features: Understanding the pharmacophore of a compound can provide insight into how it interacts with biological targets. The presence of hydroxyl and methoxy groups indicates potential for strong interactions with enzymes and receptors.
  • Research Potential: Due to its structural complexity and biological relevance, this compound is an excellent candidate for further study in terms of its mechanism of action, synthesis optimization, and potential applications in drug discovery.

In the words of renowned chemist Marie Curie, "Nothing in life is to be feared, it is only to be understood." This compound represents a pathway towards deeper understanding in medicinal chemistry and organic synthesis.

Synonyms
Michellamine A
137893-48-2
Michellamine B
137793-81-8
5-[3-[4-(6,8-dihydroxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-5-yl)-1-hydroxy-8-methoxy-6-methylnaphthalen-2-yl]-4-hydroxy-5-methoxy-7-methylnaphthalen-1-yl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol
Michellamine
(-)-Michellamine A
5-[3-[4-(6,8-dihydroxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-5-yl)-1-hydroxy-8-methoxy-6-methyl
NSC 650898
NSC-661755
6,8-Isoquinolinediol, 5,5'-(1,1'-dihydroxy-8,8'-dimethoxy-6,6'-dimethyl(2,2'-binaphthalene)-4,4'-diyl)bis(1,2,3,4-tetrahydro-1,3-dimethyl-, (1R,1'R,3R,3'R,5R,5'S)-
SCHEMBL6361270
(1R,3R,5P,1'''R,3'''R,5'''P)-Michellamine A
(1R,3R,5S,1'''R,3'''R,5'''S)-Michellamine A
DTXSID50929898
5,5'-(1,1'-Dihydroxy-8,8'-dimethoxy-6,6'-dimethyl[2,2'-binaphthalene]-4,4'-diyl)bis(1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol)
5-[3-[4-(6,8-dihydroxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-5-yl)-1-hydroxy-8-methoxy-6-methyl-2-naphthyl]-4-hydroxy-5-methoxy-7-methyl-1-naphthyl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol
5-[3-[4-(6,8-Dihydroxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-5-yl)-1-hydroxy-8-methoxy-6-methyl-naphthalen-2-yl]-4-hydroxy-5-methoxy-7-methyl-naphthalen-1-yl]-1,3-dimethyl-1,2,3,4-tetrahydroisoqu
6,8-Isoquinolinediol, 5,5'-(1,1'-dihydroxy-8,8'-dimethoxy-6,6'-dimethyl(2,2'-binaphthalene)-4,4'-diyl)bis(1,2,3,4-tetrahydro-1,3-dimethyl-, (1R,1'R,3R,3'R,5S,5'S)-
6,8-Isoquinolinediol, 5,5'-(1,1'-dihydroxy-8,8'-dimethoxy-6,6'-dimethyl(2,2'-binaphthalene)-4,4'-diyl)bis(1,2,3,4-tetrahydro-1,3-dimethyl-, stereoisomer