4-[1-[(10R,13S,17S)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethylamino]-4-oxobutanoic acid
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![4-[1-[(10R,13S,17S)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethylamino]-4-oxobutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/34b9b12e69494904a20b034bfc06b192.png "4-[1-[(10R,13S,17S)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethylamino]-4-oxobutanoic acid")
4-[1-[(10R,13S,17S)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethylamino]-4-oxobutanoic acid
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CAS No:
134332-55-1
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Formula:
C25H35NO4
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Chemical Name:
4-[1-[(10R,13S,17S)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethylamino]-4-oxobutanoic acid
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Synonyms:
20-SPDO;20-succinamylpregna-1,4-dien-3-one;134332-55-1;20-Spdo;20-Succinamylpregna-1,4-dien-3-one;DTXSID80928571;4-[1-[(10R,13S,17S)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethylamino]-4-oxobutanoic acid;Butanoic acid, 4-oxo-4-((oxopregna-1,4-dien-20-yl)amino)-;4-Hydroxy-4-[(3-oxopregna-1,4-dien-20-yl)imino]butanoic acid
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CAS No:
4-[1-[(10R,13S,17S)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethylamino]-4-oxobutanoic acid Basic Attributes
413.5 g/mol
413.25660860 g/mol
Computed Properties
Molecular Weight:413.5
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:413.25660860
Monoisotopic Mass:413.25660860
Topological Polar Surface Area:83.5
Heavy Atom Count:30
Complexity:814
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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