55576-66-4

Basic information

• Product Name: agrimol B
• Synonyms: agrimol B;(2S)-1-[3,5-Bis[[2,6-dihydroxy-4-methoxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,4,6-trihydroxyphenyl]-2-methyl-1-butanone;(S)-(+)-Agrimol B;AGRIMOL B(P);1-Butanone,1-[3,5-bis[[2,6-dihydroxy-4-methoxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,4,6-trihydroxyphenyl]-2-methyl-,(2S)-;Agrimol B (-)-Agrimol B
• CAS NO: 55576-66-4
• Molecular Formula: C₃₇H₄₆O₁₂
• Molecular Weight: 682.75394
• Product Categories: chemical reagent;pharmaceutical intermediate;phytochemical;reference standards from Chinese medicinal herbs (TCM).;standardized herbal extract
• Mol File: 55576-66-4.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 922.6°Cat760mmHg
• Flash Point: 284.4°C
• Appearance: /
• Density: 1.292
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.611
• Storage Temp.: 2-8°C
• PKA: 7.09±0.50(Predicted)
• CAS DataBase Reference: agrimol B(CAS DataBase Reference)
• NIST Chemistry Reference: agrimol B(55576-66-4)
• EPA Substance Registry System: agrimol B(55576-66-4)

Safety Data

• Hazardous Substances Data: 55576-66-4(Hazardous Substances Data)

Usage

General Description

Agrimol B is a chemical compound that belongs to the group of organic compounds known as ergot alkaloids, which are produced by various fungi of the genera Claviceps and Aspergillus. It is a naturally occurring compound that has been studied for its potential pharmaceutical and agricultural uses. Agrimol B has been reported to have anti-inflammatory, antimicrobial, and antifungal properties, and has also been studied for its potential as a pesticide and herbicide. Its complex chemical structure and diverse biological activities make agrimol B a promising target for further research and development in the fields of medicine and agriculture.

InChI:InChI=1/C37H46O12/c1-9-12-23(38)25-32(44)19(29(41)17(5)36(25)48-7)14-21-31(43)22(35(47)27(34(21)46)28(40)16(4)11-3)15-20-30(42)18(6)37(49-8)26(33(20)45)24(39)13-10-2/h16,41-47H,9-15H2,1-8H3/t16-/m0/s1

Upstream product

• 6099-90-7 1,3,5-Trihydroxybenzene dihydrate 
• 487-70-7 2,4,6-trihydroxybenzaldehyde 
• 50-00-0 formaldehyd 
• 478-48-8 1-4,6-dihydroxy-2-methoxy-3-methylphenylbutan-1-one 
• 125074-06-8 2-methyl-1-(2,4,6-trihydroxyphenyl)-1-butanone 
• 108-73-6 3,5-dihydroxyphenol 
• 1509-06-4 1-[3-methyl-2,4,6-trihydroxyphenyl]-1-butanone 
• 88-03-9 2,4,6-trihydroxytoluene 

Relevant articles and documents

Synthetic method of pilosin B and intermediate pseudomonophenols thereof

The invention discloses a method for synthesizing pilosin B and intermediate pseudomonophenols thereof. The synthesis method of the pseudo-sheep equol comprises the step E. Step F and Step g. The synthetic method of the pilosin B provided by the invention is prepared by the following steps H, step J, preparation of the pseudomonophenols synthesized by the above method, and preparation of the pseudomonophenols synthesized by the method in step I. In step E, the novel amino protecting reagent with good reaction with the phenolic hydroxyl group is used as a protecting reagent, the phenol hydroxyl group of each intermediate in the intermediate molecule fragment a synthesis process is selectively protected, the reagent types are reduced and the use of toxic reagents such as benzyl chloride and the like is avoided.