(3S,5S,10S,13R,14S,17R)-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-[(2S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
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(3S,5S,10S,13R,14S,17R)-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-[(2S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
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CAS No:
15596-26-6
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Formula:
C28H40O10
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Chemical Name:
(3S,5S,10S,13R,14S,17R)-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-[(2S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
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Synonyms:
15596-26-6;Strophanthidin-D-xylose;Strophanthidin-beta-d-xyloside;5,14-Dihydroxy-3-beta-((D-xylopyranosyl)oxy)-19-oxo-5-beta-card-20(22)-enolide;DTXSID90935332;5-beta-CARD-20(22)-ENOLIDE, 5,14-DIHYDROXY-3-beta-((D-XYLOPYRANOSYL)OXY)-19-OXO-;5,14-Dihydroxy-19-oxo-3-(pentopyranosyloxy)card-20(22)-enolide
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CAS No:
(3S,5S,10S,13R,14S,17R)-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-[(2S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde Basic Attributes
536.6 g/mol
536.26214747 g/mol
Computed Properties
Molecular Weight:536.6
XLogP3:-0.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:4
Exact Mass:536.26214747
Monoisotopic Mass:536.26214747
Topological Polar Surface Area:163
Heavy Atom Count:38
Complexity:1020
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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