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7323-86-6

7323-86-6 structural image
Product Name: 6-KETOESTRIOL
Formula: C18H22O4
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid

COMPUTED DESCRIPTORS

Molecular Weight 302.4 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 302.15180918 g/mol
Monoisotopic Mass 302.15180918 g/mol
Topological Polar Surface Area 77.8 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 478
Isotope Atom Count 0
Defined Atom Stereocenter Count 6
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

6-ketoestriol is a 3-hydroxy steroid that is estriol carrying an oxo group at position 6. It has a role as a human urinary metabolite. It is a 3-hydroxy steroid, a 6-oxo steroid, a 16alpha-hydroxy steroid and a 17beta-hydroxy steroid. It is functionally related to an estriol. It derives from a hydride of an estrane.