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4135-11-9

4135-11-9 structural image
Product Name: polymyxin B(1)
Formula: C56H98N16O13
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COMPUTED DESCRIPTORS

Molecular Weight 1203.5 g/mol
XLogP3 -2.5
Hydrogen Bond Donor Count 18
Hydrogen Bond Acceptor Count 18
Rotatable Bond Count 29
Exact Mass 1202.74992724 g/mol
Monoisotopic Mass 1202.74992724 g/mol
Topological Polar Surface Area 491 Ų
Heavy Atom Count 85
Formal Charge 0
Complexity 2150
Isotope Atom Count 0
Defined Atom Stereocenter Count 13
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Polymyxin B1 is a polypeptide obtained from Bacillus polymyxa strains with antimicrobial activity. Polymyxin B1 exerts its antimicrobial effect through its cationic detergent action on cell membranes. Specifically, this antibiotic binds to the negatively charged site in the lipopolysaccharide layer of the bacterial cell membrane via electrostatic affinity with the positively charged amino groups in the cyclic peptide portion. Subsequently, the fatty acid portion of polymyxin B1 dissolves in the hydrophobic region of the bacterial cell membrane. This results in an alteration in cell membrane structure, disruption of cell wall integrity and an increase in permeability for water and molecules. This will eventually lead to bacterial cell death.