(8S,9S,10R,13S,14S,17S)-17-ethanethioyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
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(8S,9S,10R,13S,14S,17S)-17-ethanethioyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
structure -
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CAS No:
5717-03-3
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Formula:
C21H30OS
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Chemical Name:
(8S,9S,10R,13S,14S,17S)-17-ethanethioyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
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Synonyms:
20-Thioxopregn-4-en-3-one;5717-03-3;BRN 3155228;Pregn-4-en-3-one, 20-thioxo-;DTXSID00972632;20-Sulfanylidenepregn-4-en-3-one;(8S,9S,10R,13S,14S,17S)-17-ethanethioyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
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CAS No:
(8S,9S,10R,13S,14S,17S)-17-ethanethioyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Basic Attributes
330.5 g/mol
330.20173675 g/mol
Computed Properties
Molecular Weight:330.5
XLogP3:4.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:330.20173675
Monoisotopic Mass:330.20173675
Topological Polar Surface Area:49.2
Heavy Atom Count:23
Complexity:591
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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