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1162-53-4

1162-53-4 structural image
Product Name: 16-Dehydropregnenolone
Formula: C21H30O2
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COMPUTED DESCRIPTORS

Molecular Weight 314.5 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 314.224580195 g/mol
Monoisotopic Mass 314.224580195 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 601
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

16,17-didehydropregnenolone is a 3beta-hydroxy-Delta(5)-steroid that is pregnenolone with a double bond between positions 16 and 17. It is a 20-oxo steroid, an enone and a 3beta-hydroxy-Delta(5)-steroid. It is functionally related to a pregnenolone.