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53-00-9

53-00-9 structural image
Product Name: 7-alpha-Hydroxydehydroepiandrosterone
Formula: C19H28O3
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 182 - 183 °C

COMPUTED DESCRIPTORS

Molecular Weight 304.4 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 304.20384475 g/mol
Monoisotopic Mass 304.20384475 g/mol
Topological Polar Surface Area 57.5 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 539
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
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

7alpha-hydroxydehydroepiandrosterone is an androstanoid that is dehydroepiandrosterone carrying an additional hydroxy substituent at the 7alpha-position. It has a role as an estrogen, an anti-inflammatory agent, an antioxidant, a rat metabolite and a human xenobiotic metabolite. It is a 17-oxo steroid, a 3beta-hydroxy-Delta(5)-steroid, an androstanoid and a 7alpha-hydroxy steroid. It is functionally related to a dehydroepiandrosterone.