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1098-45-9

1098-45-9 structural image
Product Name: 5BETA-PREGNANE-3ALPHA,17ALPHA,20ALPHA-TRIOL
Formula: C21H36O3
Synonyms: 3α,17α,20α-Trihydroxy-5β-pregnane;Pregnanetriol
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COMPUTED DESCRIPTORS

Molecular Weight 336.5 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 336.26644501 g/mol
Monoisotopic Mass 336.26644501 g/mol
Topological Polar Surface Area 60.7 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 507
Isotope Atom Count 0
Defined Atom Stereocenter Count 9
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

5beta-Pregnane-3alpha,17alpha,20alpha-triol is a corticosteroid hormone.

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