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Vancomycin hydrochloride

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Identification
Molecular formula
C66H76Cl3N9O24
CAS number
1404-93-9
IUPAC name
(1R,3S,5R,8R,10R,11S,12S,13R,14S)-8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecan-7-one;pentahydrate;dihydrochloride
State
State

At room temperature, vancomycin hydrochloride is in a solid state.

Melting point (Celsius)
139.50
Melting point (Kelvin)
412.65
Boiling point (Celsius)
350.00
Boiling point (Kelvin)
623.00
General information
Molecular weight
1485.71g/mol
Molar mass
1 485.7130g/mol
Density
1.3000g/cm3
Appearence

Vancomycin hydrochloride is typically a white to off-white crystalline powder.

Comment on solubility

Solubility of (1R,3S,5R,8R,10R,11S,12S,13R,14S)-8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecan-7-one;pentahydrate;dihydrochloride

The solubility of the compound (1R,3S,5R,8R,10R,11S,12S,13R,14S)-8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecan-7-one;pentahydrate;dihydrochloride is a notable aspect given its intricate molecular structure. Understanding its solubility can be approached through the following intriguing points:

  • Hydrophilicity: The presence of multiple hydroxyl (-OH) groups generally enhances solubility in water due to the ability to form hydrogen bonds with water molecules.
  • Salt Formation: As a dihydrochloride salt, the compound may exhibit increased solubility in polar solvents due to ionic interactions.
  • Pentahydrate Form: The inclusion of water molecules in the pentahydrate structure indicates that water solubility may be further augmented through hydration dynamics.

In summary, the solubility of this compound is likely to be influenced significantly by its numerous functional groups and ionic characteristics. As a result, it may demonstrate enhanced solubility in water and polar solvents, allowing for interactive applications in biological and chemical systems. It's essential to empirically measure solubility under specific conditions to fully understand its behavior.

Interesting facts

Interesting Facts about Pentahydrated Dihydrochloride Form of a Unique Compound

This particular chemical compound, with a complex structure and notable functional groups, showcases the fascinating world of organic chemistry. Here are some key insights:

  • Versatile Applications: Due to its unique structural features, this compound may be explored for various applications including pharmaceuticals, where it might serve as a precursor or a bioactive agent.
  • Stereochemistry: The (1R,3S,5R,8R,10R,11S,12S,13R,14S) notation indicates its chirality, which is crucial in determining how this compound interacts in biological systems. Chirality can significantly influence the therapeutic effects and safety of drugs.
  • Hydration States: The presence of pentahydrate highlights the importance of water in the stabilization of this compound. Hydration states can affect solubility, reactivity, and biological activity.
  • Functional Diversity: With trihydroxy and bis(methylamino) groups, this compound belongs to a class of compounds that may exhibit complex reactivity, possibly leading to novel synthesis pathways or reactive intermediates.
  • Research Potential: Compounds with extensive tricyclic frameworks, such as this one, are intriguing to chemists because they can lead to the discovery of new biological interactions and mechanistic pathways.

In summary, the study of this compound opens up numerous avenues in chemical research, drug development, and applications in medicinal chemistry. Its multifaceted nature and intricate structure could lead to discoveries that enhance our understanding of organic compounds and their functionalities in various fields.

Synonyms
Spectinomycin hydrochloride
Spectinomycin HCl
Spectogard
Spectinomycin hydrochloride hydrate
Espectinomicina dihydrochloride pentahydrate
U-18,409AE
Actinospectacin dihydrochloride pentahydrate
Spectinomycin hcl pentahydrate
HWT06H303Z
U-18409AE
NSC-757319
Spectinomycini hydrochloridum
CHEBI:9217
SPECTINOMYCIN HYDROCHLORIDE PENTAHYDRATE
Spectam Tablets
PROSPEC Injectable
NSC248616
RefChem:57027
Spectinomycin Oral Liquid
magnesium;2-hydroxybenzoate
Spectinomycin Tablet and Injection
(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-Trihydroxy-2-methyl-6,8-bis(methylamino)-2,3,4a,5a,6,7,8,9,9a,10a-decahydro-4H-pyrano(2,3-b)(1,4)benzodioxin-4-one dihydrochloride pentahydrate
4H-Pyrano(2,3-b)(1,4)benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, Dihydrochloride,(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-
22189-32-8
Spectinomycin dihydrochloride pentahydrate
Trobicin
MFCD00150886
Spectam
U 18,400AE
Spectinomycin HCl hydrate
4H-Pyrano[2,3-b][1,4]benzodioxin-4-one,decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-,dihydrochloride, pentahydrate,[2R-(2a,4ab,5ab,6b,7b,8b,9a,9aa,10ab)]-
Togamycin dihydrochloride pentahydrate
22189-32-8 (HCl hydrate)
M 141
(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-benzo[b]pyrano[2,3-e][1,4]dioxin-4-one dihydrochloride pentahydrate
4H-Pyrano(2,3-b)(1,4)benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, dihydrochloride, pentahydrate
Decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-4H-pyrano(2,3-b)(1,4)benzodioxin-4-one dihydrochloride pentahydrate
UNII-HWT06H303Z
Trobicin (TN)
NSC-248616
Spectinomycin, dihydrochloride, pentahydrate
C14H36Cl2N2O12
Decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-4H-pyrano[2,3-b][1,4]benzodioxin-4-one dihydrochloride pentahydrate
Spectinomycin hydrochloride [USAN:USP:JAN]
SPECTINOMYCIN PENTAHYDRATE DIHYDROCHLORIDE
SCHEMBL178082
MSK7701A
orb1310291
CHEMBL3989571
DTXSID90944843
DCHJOVNPPSBWHK-UXXUFHFZSA-N
Spectinomycin hydrochloride (USP)
Spectinomycin for system suitability
s5417
AKOS008145409
AS61455
DS-7849
NSC 757319
SPECTINOMYCIN HYDROCHLORIDE [USAN]
SPECTINOMYCIN HYDROCHLORIDE [VANDF]
SPECTINOMYCIN HYDROCHLORIDE [USP-RS]
Spectinomycin hydrochloride hydrate (JP17)
Trobicin;Spectinomycin hydrochloride hydrate
D00869
SPECTINOMYCIN HYDROCHLORIDE [ORANGE BOOK]
SPECTINOMYCIN HYDROCHLORIDE HYDRATE [JAN]
SPECTINOMYCIN HYDROCHLORIDE [USP IMPURITY]
SPECTINOMYCIN HYDROCHLORIDE [USP MONOGRAPH]
SPECTINOMYCINI HYDROCHLORIDUM [WHO-IP LATIN]
Q27108318
SPECTINOMYCIN DIHYDROCHLORIDE PENTAHYDRATE [MI]
SPECTINOMYCIN HYDROCHLORIDE PENTAHYDRATE [WHO-DD]
Z608353996
Spectinomycin dihydrochloride pentahydrate, >=98.0% (AT)
SPECTINOMYCIN HYDROCHLORIDE PENTAHYDRATE [GREEN BOOK]
SPECTINOMYCIN DIHYDROCHLORIDE PENTAHYDRATE [EP IMPURITY]
SPECTINOMYCIN DIHYDROCHLORIDE PENTAHYDRATE [EP MONOGRAPH]
SPECTINOMYCIN DIHYDROCHLORIDE PENTAHYDRATE [GREEN BOOK]
Spectinomycin dihydrochloride pentahydrate, Cell Culture Grade
Spectinomycin dihydrochloride pentahydrate, powder, gamma-irradiated
Spectinomycin dihydrochloride pentahydrate, potency: >=603 mug per mg
Spectinomycin dihydrochloride pentahydrate, powder, BioReagent, suitable for cell culture
Spectinomycin dihydrochloride pentahydrate, VETRANAL(TM), analytical standard
Spectinomycin hydrochloride, United States Pharmacopeia (USP) Reference Standard
(1R,3S,5R,8R,10R,11S,12S,13R,14S)-8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecan-7-one;pentahydrate;dihydrochloride
(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-benzo[b]pyrano[2,3-e][1,4]dioxin-4-onedihydrochloridepentahydrate
(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-pyrano[2,3-b][1,4]benzodioxin-4-one dihydrochloride pentahydrate
(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-pyrano[2,3-b][1,4]benzodioxin-4-one dihydrochloride--water (1/5)
(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-Trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-pyrano[2,3-b][1,4]benzodioxin-4-one hydrochloride hydrate
(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-N,N',2-trimethyl-4-oxodecahydro-2H-pyrano[2,3-b][1,4]benzodioxine-6,8-diaminium dichloride--water (1/5)
(2R-(2.ALPHA.,4A.BETA.,5A.BETA.,6.BETA.,7.BETA.,8.BETA.,9.ALPHA.,9A.ALPHA.,10A.BETA.))-DECAHYDRO-4A,7,9-TRIHYDROXY-2-METHYL-6,8-BIS(METHYLAMINO)-4H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4-ONE DIHYDROCHLORIDE PENTAHYDRATE
4a,7,9-Trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-pyrano[2,3-b][1,4]benzodioxin-4-one--hydrogen chloride--water (1/2/5)
4H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4-ONE, DECAHYDRO-4A,7,9-TRIHYDROXY-2-METHYL-6,8-BIS(METHYLAMINO)-, HYDROCHLORIDE, HYDRATE (1:2:5), (2R,4AR,5AR,6S,7S,8R,9S,9AR,10AS)-