S-[(7R,8R,9S,10R,13S,14S,15R,17S)-17-acetyl-15-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-yl] ethanethioate
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S-[(7R,8R,9S,10R,13S,14S,15R,17S)-17-acetyl-15-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-yl] ethanethioate
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CAS No:
7255-85-8
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Formula:
C23H32O4S
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Chemical Name:
S-[(7R,8R,9S,10R,13S,14S,15R,17S)-17-acetyl-15-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-yl] ethanethioate
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Synonyms:
15beta-Hydroxy-7alpha-mercapto-pregn-4-ene-3,20-dione 7-acetate;C14922;CHEBI:79447;NSC74229;NSC-74229;7255-85-8;Q27148508;15beta-Hydroxy-7alpha-(acetylthio)pregna-4-ene-3,20-dione
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CAS No:
Description
15beta-Hydroxy-7alpha-mercapto-pregn-4-ene-3,20-dione 7-acetate is a corticosteroid hormone.
S-[(7R,8R,9S,10R,13S,14S,15R,17S)-17-acetyl-15-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-yl] ethanethioate Basic Attributes
404.6 g/mol
404.20213067 g/mol
74229
Computed Properties
Molecular Weight:404.6
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:404.20213067
Monoisotopic Mass:404.20213067
Topological Polar Surface Area:96.7
Heavy Atom Count:28
Complexity:758
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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