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857402-63-2

857402-63-2 structural image
Product Name: Retaspimycin Hydrochloride
Formula: C31H47N3O8.ClH
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COMPUTED DESCRIPTORS

Molecular Weight 624.2 g/mol
Hydrogen Bond Donor Count 7
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 7
Exact Mass 623.2973431 g/mol
Monoisotopic Mass 623.2973431 g/mol
Topological Polar Surface Area 173 Ų
Heavy Atom Count 43
Formal Charge 0
Complexity 999
Isotope Atom Count 0
Defined Atom Stereocenter Count 6
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 3
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Retaspimycin hydrochloride is a hydrochloride that is the monohydrochloride salt of retaspimycin. A semi-synthetic water-soluble analogue of geldanamycin used in cancer treatment. It has a role as a Hsp90 inhibitor and an antineoplastic agent. It contains a retaspimycin(1+).