57103-59-0

Basic information

• Product Name: (3S)-2,3,4,4aα,5,6,11,11aα-Octahydro-2,2,5-trimethyl-3,5β-ethano-1H-pyrido[3,2-b]carbazole
• Synonyms: (3S)-2,3,4,4aα,5,6,11,11aα-Octahydro-2,2,5-trimethyl-3,5β-ethano-1H-pyrido[3,2-b]carbazole;Aristoteline
• CAS NO: 57103-59-0
• Molecular Formula: C₂₀H₂₆N₂
• Molecular Weight: 294.4338
• Mol File: 57103-59-0.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 444°Cat760mmHg
• Flash Point: 222.4°C
• Appearance: /
• Density: 1.105g/cm³
• Vapor Pressure: 4.42E-08mmHg at 25°C
• Refractive Index: 1.605
• CAS DataBase Reference: (3S)-2,3,4,4aα,5,6,11,11aα-Octahydro-2,2,5-trimethyl-3,5β-ethano-1H-pyrido[3,2-b]carbazole(CAS DataBase Reference)
• NIST Chemistry Reference: (3S)-2,3,4,4aα,5,6,11,11aα-Octahydro-2,2,5-trimethyl-3,5β-ethano-1H-pyrido[3,2-b]carbazole(57103-59-0)
• EPA Substance Registry System: (3S)-2,3,4,4aα,5,6,11,11aα-Octahydro-2,2,5-trimethyl-3,5β-ethano-1H-pyrido[3,2-b]carbazole(57103-59-0)

Safety Data

• Hazardous Substances Data: 57103-59-0(Hazardous Substances Data)

Usage

Description

(3S)-2,3,4,4aα,5,6,11,11aα-Octahydro-2,2,5-trimethyl-3,5β-ethano-1H-pyrido[3,2-b]carbazole is a newly discovered alkaloid derived from Aristotelia serrata. Its structure has been confirmed through X-ray analysis of its hydro bromide salt, which forms orthorhombic crystals with a space group of P21 21 2 and lattice parameters of a = 19.462 ?, b = 10.443 ?, and c = 9.889 ?, with Z = 4.

Uses

Used in Pharmaceutical Industry:
(3S)-2,3,4,4aα,5,6,11,11aα-Octahydro-2,2,5-trimethyl-3,5β-ethano-1H-pyrido[3,2-b]carbazole is used as a pharmaceutical compound for its potential therapeutic applications. (3S)-2,3,4,4aα,5,6,11,11aα-Octahydro-2,2,5-trimethyl-3,5β-ethano-1H-pyrido[3,2-b]carbazole's unique structure and alkaloid nature suggest it may have various biological activities that could be harnessed for the development of new drugs.
Used in Chemical Research:
In the field of chemical research, (3S)-2,3,4,4aα,5,6,11,11aα-Octahydro-2,2,5-trimethyl-3,5β-ethano-1H-pyrido[3,2-b]carbazole can serve as a subject for studying the synthesis, reactivity, and potential applications of complex organic molecules. Its structural features may provide insights into the design of new molecules with specific properties and functions.
Used in Material Science:
(3S)-2,3,4,4aα,5,6,11,11aα-Octahydro-2,2,5-trimethyl-3,5β-ethano-1H-pyrido[3,2-b]carbazole may also find applications in material science, where its unique structural characteristics could be exploited to develop new materials with specialized properties, such as improved conductivity, stability, or reactivity in various environments.

References

Anderson et al., Chem. Commun., 511 (1975)

InChI:InChI=1/C20H26N2/c1-19(2)12-8-9-20(3)15(10-12)17(22-19)11-14-13-6-4-5-7-16(13)21-18(14)20/h4-7,12,15,17,21-22H,8-11H2,1-3H3

Upstream product

• 73004-61-2 (-)-Hobartine 

Downstream Products

• 80787-63-9 aristomakine 
• 74260-86-9 (-)-serratoline 
• 152697-51-3 (+)-O-benzoyl-3-episerratoline 

Relevant articles and documents

Synthesis of aristoteline-type alkaloids. Part II. The structure of neohobartine, a side product of the hobartine-aristoteline transformation

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