[(1S,2R,7S,9R,11R,12S,16S)-2,16-dimethyl-15-oxo-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-5-yl] acetate
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[(1S,2R,7S,9R,11R,12S,16S)-2,16-dimethyl-15-oxo-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-5-yl] acetate
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CAS No:
68974-62-9
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Formula:
C21H30O4
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Chemical Name:
[(1S,2R,7S,9R,11R,12S,16S)-2,16-dimethyl-15-oxo-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-5-yl] acetate
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Synonyms:
3-(Acetyloxy)-5,6-epoxyandrostan-17-one (5alpha,6alpha)-;Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)-;68974-62-9
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CAS No:
[(1S,2R,7S,9R,11R,12S,16S)-2,16-dimethyl-15-oxo-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-5-yl] acetate Basic Attributes
346.5 g/mol
346.21440943 g/mol
Computed Properties
Molecular Weight:346.5
XLogP3:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:346.21440943
Monoisotopic Mass:346.21440943
Topological Polar Surface Area:55.9
Heavy Atom Count:25
Complexity:644
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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