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58602-66-7

58602-66-7 structural image
Product Name: Aminopterin
Formula: C19H21N8NaO5
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COMPUTED DESCRIPTORS

Molecular Weight 484.4 g/mol
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 7
Exact Mass 484.11955427 g/mol
Monoisotopic Mass 484.11955427 g/mol
Topological Polar Surface Area 225 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 663
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 3
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Aminopterin Sodium is the sodium salt of a pterin derivative with antineoplastic and immunosuppressive properties. As a folate analogue, aminopterin competes for the folate binding site of the enzyme dihydrofolate reductase, thereby blocking tetrahydrofolate synthesis, and resulting in depletion of nucleotide precursors and inhibition of DNA, RNA and protein synthesis. (NCI04)