5α-Cholestan-3-one
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5α-Cholestan-3-one
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CAS No:
566-88-1
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Formula:
C27H46O
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Chemical Name:
5α-Cholestan-3-one
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Synonyms:
Cholestan-3-one,(5α)-;5α-Cholestan-3-one;(5α)-Cholestan-3-one;5α-Cholestanone;5α(H)-Cholestan-3-one;(5α,17β)-17-Octylandrostan-3-one;NSC 11920;118167-49-0;127794-12-1
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CAS No:
Description
white fine crystalline powder or needles
Solid
5alpha-cholestan-3-one is a 3-oxo-5alpha- steroid that is 5alpha-cholestane substituted by an oxo group at position 3. It has a role as a mammalian metabolite. It is a 3-oxo-5alpha-steroid and a 3-oxocholestane. It derives from a hydride of a 5alpha-cholestane.
Characteristics
17.1
9.64
Solid
1.0±0.1 g/cm3
128-129 °C
452.9±13.0 °C at 760 mmHg
219.3±12.1 °C
1.498
Insoluble in water.
5α-Cholestan-3-one Use and Manufacturing
Lipids -> Sterol Lipids [ST] -> Sterols [ST01] -> Cholesterol and derivatives [ST0101]
Computed Properties
Molecular Weight:386.7
XLogP3:8.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:386.354866087
Monoisotopic Mass:386.354866087
Topological Polar Surface Area:17.1
Heavy Atom Count:28
Complexity:579
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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