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Mesembrane

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Identification
Molecular formula
C27H34ClN1O10
CAS number
18276-02-3
IUPAC name
(1S,16R)-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-30-aza-15-azoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaene-9,21-diol;chloride;pentahydrate;hydrochloride
State
State

At room temperature, Mesembrane is typically a solid. It is usually handled as a hydrated chloride salt, which affects its physical properties.

Melting point (Celsius)
98.00
Melting point (Kelvin)
371.00
Boiling point (Celsius)
265.00
Boiling point (Kelvin)
538.00
General information
Molecular weight
586.15g/mol
Molar mass
586.1480g/mol
Density
1.5400g/cm3
Appearence

This compound typically appears as a crystalline solid that is off-white to pale yellow in color. It is commonly found as a hydrated salt in its pentahydrate form.

Comment on solubility

Solubility of the Compound

The solubility of (1S,16R)-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-30-aza-15-azoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaene-9,21-diol;chloride;pentahydrate;hydrochloride is influenced by several key factors:

  • Polarity: The presence of multiple hydroxyl (-OH) and methoxy (-OCH3) groups indicates a tendency for increased solubility in polar solvents, especially water.
  • Hydration: As a pentahydrate, this compound can form multiple hydrogen bonds with water, enhancing its solubility.
  • Salt Form: The chloride and hydrochloride variations often improve solubility in aqueous solutions due to ionic interactions.

However, it is important to note that the intricate chemical structure may lead to variable solubility characteristics. Empirical solubility testing is recommended to understand its behavior in various solvents. As observed in similar compounds, structures with complex ring systems may demonstrate limited solubility in nonpolar solvents, leading to a significant preference for aqueous environments.


Given these properties, a preliminary assessment suggests that this compound would exhibit a relatively higher solubility in polar solvents, particularly water, while its solubility in organic solvents may be considerably lower. Further investigation could provide deeper insights into its solubility dynamics and potential application scenarios.

Interesting facts

Interesting Facts about (1S,16R)-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-30-aza-15-azoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaene-9,21-diol;chloride;pentahydrate;hydrochloride

This compound represents a fascinating and complex molecular structure characterized by various functional groups and a unique cyclic arrangement. Below are some intriguing facts that highlight the significance and potential applications of this chemical:

  • Diverse Structural Features: The compound's name indicates a rich complexity with multiple rings and functional groups, showcasing the beauty of organic chemistry.
  • Potential Applications: Chemically rich compounds like this one often hold promise in medicinal chemistry, acting as precursors or core structures for drug development.
  • Hydrochloride Form: The presence of the hydrochloride indicates it is often studied in its protonated form, which can enhance solubility and stability in certain contexts, making it suitable for pharmaceutical formulations.
  • Pentahydrate Form: This particular form suggests that it can form stable hydrated crystals, which might influence its reactivity and solubility conditions during synthesis.
  • Exploration in Nature: Chemical compounds with such intricate architectures are frequently derived from natural products, leading to a greater understanding of organic synthesis in nature.
  • Research Opportunities: Researchers are continuously investigating these types of compounds for their unique properties and interactions, paving the way for advancements in material science and biochemistry.

In summary, compounds like this one highlight the intersection of organic chemistry and pharmaceutical science, where structure plays a pivotal role in function. The potential for new discoveries and applications remains vast as ongoing research explores the utility of such intricate structures.

Synonyms
6989-98-6
(+)-Tubocurarine chloride pentahydrate
TUBOCURARINE CHLORIDE PENTAHYDRATE
d-Tubocurarine chloride pentahydrate
(+)-Tubocurarine chloride hydrochloride pentahydrate
Tubaine
D-Tubocurarine (chloride pentahydrate)
Tubarine pentahydrate
900961Z8VR
(1S,16R)-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-30-aza-15-azoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaene-9,21-diol;chloride;pentahydrate;hydrochloride
Tubocuraranium, 7',12'-dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyl-, chloride, hydrochloride, pentahydrate
Tubocurarine chloride (TN)
(11S,51R)-36,57-dihydroxy-16,56-dimethoxy-12,52,52-trimethyl-11,12,13,14,51,52,53,54-octahydro-2,6-dioxa-1(7,1),5(1,8)-diisoquinolina-3(1,3),7(1,4)-dibenzenacyclooctaphan-52-ium chloride hydrochloride pentahydrate
UNII-900961Z8VR
Prestwick_489
MFCD00150157
Tubocurarine chloride [USP:INN:BAN:JAN]
Tubocurarine chloride (USP)
8063-06-7
CHEMBL3989821
MSK40355W
DTXSID20930274
Tubocurarine chloride hydrate (JAN)
1ST40355W
HB2050
TUBOCURARINE CHLORIDE [VANDF]
AKOS040741589
TUBOCURARINE CHLORIDE [WHO-IP]
NSC 757362
13H-4,6:21,24-Dietheno-8,12-metheno-1H-pyrido(3',2':14,15)(1,11)dioxacycloeicosino(2,3,4-ij)isoquinolinium, 2,3,13a,14,15,16,25,25a-octahydro-9,19-dihydroxy-18,29-dimethoxy-1,14,14-trimethyl-, chloride, hydrochloride, pentahydrate, (13aR,25aS)-
MS-31399
TUBOCURARINE CHLORIDE [ORANGE BOOK]
HY-125901
CS-0102809
TUBOCURARINI CHLORIDUM [WHO-IP LATIN]
D02207
D89247
tubocurarine chloride hydrochloride pentahydrate
Tubocurarine hydrochloride pentahydrate, >=97%
TUBOCURARINE CHLORIDE HYDROCHLORIDE HYDRATE
Q27271261
TUBOCURARINE CHLORIDE HYDROCHLORIDE HYDRATE [JAN]
(+)-Tubocurarine chloride pentahydrate, >=97.0% (TLC)
(+)-TUBOCURARINE CHLORIDE HYDROCHLORIDE, PENTAHYDRATE [WHO-IP]
Tubocurarine chloride, United States Pharmacopeia (USP) Reference Standard