79592-91-9

Basic information

• Product Name: CRASSICAULINE A
• Synonyms: 3-Deoxyyunaconitine;Crassicaulin A;Crassicauline I;Crassicayline A
• CAS NO: 79592-91-9
• Molecular Formula: C₃₅H₄₉NO₁₀
• Molecular Weight: 643.76426
• Product Categories: Alkaloids;chemical reagent;pharmaceutical intermediate;phytochemical;reference standards from Chinese medicinal herbs (TCM).;standardized herbal extract
• Mol File: 79592-91-9.mol
• Article Data: 2

Chemical Properties

• Melting Point: 166-168℃
• Boiling Point: 688.18oC at 760 mmHg
• Flash Point: 369.998oC
• Appearance: /
• Density: 1.30
• Vapor Pressure: 6.94E-20mmHg at 25°C
• Refractive Index: 1.588
• Storage Temp.: Refrigerator
• Solubility: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
• CAS DataBase Reference: CRASSICAULINE A(CAS DataBase Reference)
• NIST Chemistry Reference: CRASSICAULINE A(79592-91-9)
• EPA Substance Registry System: CRASSICAULINE A(79592-91-9)

Safety Data

• Hazardous Substances Data: 79592-91-9(Hazardous Substances Data)

Usage

Description

CRASSICAULINE A is a natural compound with the chemical formula C15H22O2 and a molecular weight of approximately 234.34 g/mol. It is a white solid with unique chemical properties and potential applications in various industries.

Uses

Used in Pharmaceutical Industry:
CRASSICAULINE A is used as a neurotoxin antagonist for its ability to bind and activate tetrodotoxin-sensitive Na+ channels, thereby prolonging the opening of the sodium-ion channel and suppressing conformational changes. This makes it a potential candidate for the development of drugs targeting neurological disorders and pain management.
Used in Chemical Research:
As a white solid with unique chemical properties, CRASSICAULINE A can be used in chemical research for studying the structure, properties, and reactions of natural compounds. It can also be used as a reference material for the development of new synthetic methods and techniques in organic chemistry.
Used in Quality Control and Analysis:
CRASSICAULINE A can be used as a reference compound in quality control and analysis of natural products, ensuring the purity and authenticity of the compounds being studied or used in various applications. Its unique chemical properties make it a valuable tool for the development of analytical methods and techniques in the field of natural product chemistry.

InChI:InChI=1/C35H49NO10/c1-8-36-17-32(18-40-3)14-13-23(42-5)35-22-15-33(39)24(43-6)16-34(46-19(2)37,26(29(35)36)27(44-7)28(32)35)25(22)30(33)45-31(38)20-9-11-21(41-4)12-10-20/h9-12,22-30,39H,8,13-18H2,1-7H3

Upstream product

• 121220-91-5 3-O-(imidazolylthiocarbonyl)-yunaconitine 

Downstream Products

• 1297595-81-3 β-cyclodextrin-crassicauline A complex 

Relevant articles and documents

Diterpenoid alkaloids from aconitum episcopale

Three new diterpenoid alkaloids, liaconitine A (N-ethyl- 1α,6α,16β,18-tetramethoxy-13β-ol-2,3-dehydroaconitane-8-acetate-14- anisoylate), B (N-ethyl- 1α,6α, 16β,18-tetramethoxy- 13β-ol-2,3- dehydroaconitane-8,14-dianisoylate and C (N-ethyl- 1α,6α,16β,18- tetramethoxy-8-ethoxy-13β-ol-2,3-dehydroaconitane-14-anisoylate) have been isolated from the roots of Aconitum episcopale. The structures of the new compounds were established by spectroscopic methods and reduction of liaconitine A to the known alkaloid, crassicauline A.