Beauvericin | CAS No. 26048-05-5

Beauvericin

Basic Information

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CAS Number

26048-05-5

Molecular Formula

C45H57N3O9

Molecular Weight

477.47 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

93-94 ºC

Boiling Point

975.6±65.0 °C at 760 mmHg

Flash Point

543.8±34.3 °C

Solubility

Insuluble (9.4E-3 g/L) (25 ºC),

Refractive Index

1.529

Vapor Pressure

0.0±0.3 mmHg at 25°C

SMILES

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CC(C)C1C(=O)N(C(C(=O)OC(C(=O)N(C(C(=O)OC(C(=O)N(C(C(=O)O1)CC2=CC=CC=C2)C)C(C)C)CC3=CC=CC=C3)C)C(C)C)CC4=CC=CC=C4)C

InChI

InChI=1S/C22H27N3O9/c1-13(2)20-21(30)24-10-19(29)32-11-16(26)23-9-18(28)33-12-17(27)25-15(22(31)34-20)8-14-6-4-3-5-7-14/h3-7,13,15,20H,8-12H2,1-2H3,(H,23,26)(H,24,30)(H,25,27)

InChIKey

WDAXCNKMUPKHQV-UHFFFAOYSA-N

LogP

-1.385899999999996

Topological Polar Surface Area

166.2 Å²

Hydrogen Bond Donor/Acceptor

3 / 12

Complexity

1200

Synonyms & References

English

Beauvericin Solution in Acetonitrile, 100ug/mL
CS-W020817
NCGC00380798-01
1ST7258-100A
26048-05-5
(3S,6R,9S,12R,15S,18R)-3,9,15-tribenzyl-4,10,16-trimethyl-6,12,18-tri(propan-2-yl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone
HY-N6739
(3S,6R,9S,12R,15S,18R)-3,9,15-tribenzyl-6,12,18-triisopropyl-4,10,16-trimethyl-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexaone
AKOS030622850
1ST7258
26S048LS2R
DTXSID00891834
SCHEMBL29355
CHEMBL249052
(3S,6R,9S,12R,15S,18R)-3,9,15-tribenzyl-6,12,18-triisopropyl-4,10,16-trimethyl-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone
NS00018333
CHEBI:3000
Beauvericin
UNII-26S048LS2R
Cyclo[(2R)-2-hydroxy-3-methylbutanoyl-N-methyl-L-phenylalanyl-(2R)-2-hydroxy-3-methylbutanoyl-N-methyl-L-phenylalanyl-(2R)-2-hydroxy-3-methylbutanoyl-N-methyl-L-phenylalanyl]
beauverin
beauverin bassiaua vuillemin
bovein
Cyclo(-D-a-hydroxyisovaleryl-N-Me-Phe)3
cyclo(D-α-Hydroxyisovaleryl-L-N-methyl-Phe)3

MDL Number

MFCD30541349

FAQ

What is Beauvericin (CAS: 26048-05-5)?

Beauvericin (CAS: 26048-05-5) is a cyclic peptide found in the fungal metabolites of Beauveria bassiana. It has antimicrobial and antifungal properties, making it of interest in the pharmaceutical and agricultural industries.

What are the main uses of Beauvericin (CAS: 26048-05-5)?

Beauvericin (CAS: 26048-05-5) is primarily used as an antifungal agent in agricultural pest control and as a research tool for studying fungal-plant interactions. It also shows potential as a pharmaceutical agent for treating fungal infections.

Is Beauvericin (CAS: 26048-05-5) safe?

Beauvericin (CAS: 26048-05-5) is generally considered safe for use in agricultural applications and research, but proper handling and protective measures are advised. Always follow safety guidelines and seek expert advice before use.

How should Beauvericin (CAS: 26048-05-5) be stored?

Beauvericin (CAS: 26048-05-5) should be stored in a cool, dry place, protected from light. Keep it sealed and away from heat and moisture to maintain its stability and effectiveness. Suitable containers are glass or food-grade plastic bottles, with a tight-fitting lid.