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189453-10-9

189453-10-9 structural image
Product Name: Epothilone D
Formula: C27H41NO5S
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COMPUTED DESCRIPTORS

Molecular Weight 491.7 g/mol
XLogP3 5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 2
Exact Mass 491.27054458 g/mol
Monoisotopic Mass 491.27054458 g/mol
Topological Polar Surface Area 125 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 777
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Epothilone D is an epithilone that is epithilone C in which the hydrogen at position 13 of the oxacyclohexadec-13-ene-2,6-dione macrocycle has been replaced by a methyl group. It has a role as a microtubule-stabilising agent.