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29802-94-6

29802-94-6 structural image
Product Name: Pregnan-20-one, 3-(sulfooxy)-, (3α,5α)-
Formula: C21H34O5S
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COMPUTED DESCRIPTORS

Molecular Weight 398.6 g/mol
XLogP3 4.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 398.21269535 g/mol
Monoisotopic Mass 398.21269535 g/mol
Topological Polar Surface Area 89 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 713
Isotope Atom Count 0
Defined Atom Stereocenter Count 8
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

5alpha-pregnan-3alpha-ol,20-one sulfate is a steroid sulfate.