[(8S,11S,13S,14S)-9-hydroxy-13-methyl-11-nitrooxy-17-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-yl] acetate
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[(8S,11S,13S,14S)-9-hydroxy-13-methyl-11-nitrooxy-17-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-yl] acetate
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CAS No:
33767-88-3
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Formula:
C20H23NO7
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Chemical Name:
[(8S,11S,13S,14S)-9-hydroxy-13-methyl-11-nitrooxy-17-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-yl] acetate
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Synonyms:
9-hydroxyestrone-3-acetate-11-nitrate;9alpha-hydroxyestrone-3-acetate-11beta-nitrate;33767-88-3;9-Hydroxyestrone-3-acetate-11-nitrate;9alpha-Hydroxyestrone-3-acetate-11beta-nitrate;DTXSID50955354;9-Hydroxy-11-(nitrooxy)-17-oxoestra-1(10),2,4-trien-3-yl acetate;Estra-1,3,5(10)-trien-17-one, 3-(acetyloxy)-9-hydroxy-11-(nitrooxy)-, (11beta)-
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CAS No:
[(8S,11S,13S,14S)-9-hydroxy-13-methyl-11-nitrooxy-17-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-yl] acetate Basic Attributes
389.4 g/mol
389.14745207 g/mol
Computed Properties
Molecular Weight:389.4
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:389.14745207
Monoisotopic Mass:389.14745207
Topological Polar Surface Area:119
Heavy Atom Count:28
Complexity:691
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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