566-65-4
Product Name:
5α-Pregnane-3,20-dione
Formula:
C21H32O2
Synonyms:
5α-Dihydroprogesterone;Allopregnane-3,20-dione
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CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid |
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Melting Point | 200 °C |
Kovats Retention Index | 2665 |
COMPUTED DESCRIPTORS
Molecular Weight | 316.5 g/mol |
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XLogP3 | 4.4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 1 |
Exact Mass | 316.240230259 g/mol |
Monoisotopic Mass | 316.240230259 g/mol |
Topological Polar Surface Area | 34.1 Ų |
Heavy Atom Count | 23 |
Formal Charge | 0 |
Complexity | 538 |
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
5alpha-pregnane-3,20-dione is a C21-steroid hormone that is 5alpha-pregnane substituted by oxo groups at positions 3 and 20. It is a metabolite of progestrone. It has a role as a human metabolite and a progestogen. It is a 20-oxo steroid, a C21-steroid hormone and a 3-oxo-5alpha-steroid. It is functionally related to a progesterone. It derives from a hydride of a 5alpha-pregnane.