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5560-59-8

5560-59-8 structural image
Product Name: Alverine citrate
Formula: C26H35NO7
Synonyms: N-Ethyl-3,3′-diphenyldipropylamine;NSC 35459
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 168.4 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

COMPUTED DESCRIPTORS

Molecular Weight 473.6 g/mol
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 14
Exact Mass 473.24135246 g/mol
Monoisotopic Mass 473.24135246 g/mol
Topological Polar Surface Area 135 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 442
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Alverine citrate is the citrate salt of alverine, resulting from the reaction of equimolar amounts of alvarine and citric acid. An antispasmodic that acts directly on intestinal and uterine smooth muscle, it is used in the treatment of irritable bowel syndrome. It has a role as a cholinergic antagonist and an antispasmodic drug. It is a citrate salt and an organoammonium salt. It contains an alverine(1+).