1-[(3S,8S,9S,10R,13S,14S,17S)-3-chloro-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
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1-[(3S,8S,9S,10R,13S,14S,17S)-3-chloro-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
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CAS No:
1906-01-0
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Formula:
C21H31ClO
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Chemical Name:
1-[(3S,8S,9S,10R,13S,14S,17S)-3-chloro-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
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Synonyms:
1906-01-0;3-beta-Chloropregn-5-en-20-one;3-chloropregn-5-en-20-one;Pregn-5-en-20-one, 3-beta-chloro-;3-beta-Chloro-delta(sup 5)-pregnen-20-one;Pregn-5-en-20-one, 3-chloro-, (3-beta)-;SCHEMBL9622743;3beta-Chloropregn-5-en-20-one;DTXSID10940625;ZINC5434404
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CAS No:
1-[(3S,8S,9S,10R,13S,14S,17S)-3-chloro-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone Basic Attributes
334.9 g/mol
334.2063433 g/mol
Computed Properties
Molecular Weight:334.9
XLogP3:5.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:334.2063433
Monoisotopic Mass:334.2063433
Topological Polar Surface Area:17.1
Heavy Atom Count:23
Complexity:552
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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