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6890-65-9

6890-65-9 structural image
Product Name: 5-ALPHA-PREGNAN-3-ALPHA, 17-DIOL-20-ONE
Formula: C21H34O3
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COMPUTED DESCRIPTORS

Molecular Weight 334.5 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 334.25079494 g/mol
Monoisotopic Mass 334.25079494 g/mol
Topological Polar Surface Area 57.5 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 545
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

3alpha,17alpha-dihydroxy-5alpha-pregnan-20-one is a 20-oxo steroid, a 3alpha-hydroxy steroid and a 17alpha-hydroxy-C21-steroid. It has a role as a rat metabolite, a mouse metabolite and a human urinary metabolite.