[(3S,5S,10S,13R,14S)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate
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[(3S,5S,10S,13R,14S)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate
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CAS No:
37811-84-0
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Formula:
C30H36O7
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Chemical Name:
[(3S,5S,10S,13R,14S)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate
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Synonyms:
37811-84-0;Strophanthidin 3-benzoate;BRN 0069333;(3-beta,5-beta)-3-(Benzoyloxy)-5,14-dihydroxy-19-oxocard-20(22)-enolide;DTXSID30958848;CARD-20(22)-ENOLIDE, 3-(BENZOYLOXY)-5,14-DIHYDROXY-19-OXO-, (3-beta,5-beta)-;3-(Benzoyloxy)-5,14-dihydroxy-19-oxocard-20(22)-enolide
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CAS No:
[(3S,5S,10S,13R,14S)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate Basic Attributes
508.6 g/mol
508.24610348 g/mol
Computed Properties
Molecular Weight:508.6
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:508.24610348
Monoisotopic Mass:508.24610348
Topological Polar Surface Area:110
Heavy Atom Count:37
Complexity:1000
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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