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112362-50-2

112362-50-2 structural image
Product Name: Dalfopristin
Formula: C34H50N4O9S
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form Slightly yellow to yellow powder
Melting Point approximately 150 °C
Other Experimental Properties Hygroscopic

COMPUTED DESCRIPTORS

Molecular Weight 690.8 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 7
Exact Mass 690.32985036 g/mol
Monoisotopic Mass 690.32985036 g/mol
Topological Polar Surface Area 185 Ų
Heavy Atom Count 48
Formal Charge 0
Complexity 1340
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 3
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Dalfopristin is a macrolide that is pristinamycin IIA in which the double bond between positions 26 and 26a of the pyrroline ring has been reduced and position 26R carries a [2-(diethylamino)ethyl]sulfonyl group. It is a semi-synthetic streptogramin antibiotic and often used as a mixture with quinupristin for the treatment of vancomycin-resistant Enterococcus faecium. It has a role as an antibacterial drug and a protein synthesis inhibitor. It is a macrolide, a member of 1,3-oxazoles, a cyclic ketone, an enamide, a secondary alcohol, a secondary carboxamide, a tertiary carboxamide, a sulfone, a tertiary amino compound, a carboxylic ester and a macrolide antibiotic. It is functionally related to a pristinamycin IIA.