4-Methoxyestrone
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4-Methoxyestrone
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CAS No:
58562-33-7
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Formula:
C19H24O3
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Chemical Name:
4-Methoxyestrone
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Synonyms:
Estra-1,3,5(10)-trien-17-one,3-hydroxy-4-methoxy-;Estrone,4-methoxy-;3-Hydroxy-4-methoxyestra-1,3,5(10)-trien-17-one;4-Methoxyestrone
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CAS No:
Description
4-methoxyestrone is a 17-oxo steroid that is estrone in which the hydrogen at position 4 has been replaced by a methoxy group. It has a role as an estrogen, a human metabolite, a genotoxin and a biomarker. It is a 17-oxo steroid, a 3-hydroxy steroid, an aromatic ether and a member of phenols. It derives from an estrone.
Drug Information
4-methoxyestrone is a known human metabolite of 4-hydroxyestrone.
4-hydroxyestrone-4-methyl ether
Computed Properties
Molecular Weight:300.4
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:300.17254462
Monoisotopic Mass:300.17254462
Topological Polar Surface Area:46.5
Heavy Atom Count:22
Complexity:462
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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