3-{[2,6-Dideoxy-4-O-(6-deoxyhexopyranosyl)hexopyranosyl]oxy}-12,14-dihydroxycard-20(22)-enolide
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3-{[2,6-Dideoxy-4-O-(6-deoxyhexopyranosyl)hexopyranosyl]oxy}-12,14-dihydroxycard-20(22)-enolide
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CAS No:
88673-30-7
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Formula:
C35H54O12
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Chemical Name:
3-{[2,6-Dideoxy-4-O-(6-deoxyhexopyranosyl)hexopyranosyl]oxy}-12,14-dihydroxycard-20(22)-enolide
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Synonyms:
88673-30-7;Digoxigenin-3-O-beta-D-digitoxosido-beta-D-glucomethyloside;DTXSID301008298;3-{[2,6-Dideoxy-4-O-(6-deoxyhexopyranosyl)hexopyranosyl]oxy}-12,14-dihydroxycard-20(22)-enolide;Card-20(22)-enolide, 3-((2,6-dideoxy-4-O-(6-deoxy-beta-D-glucopyranosyl)-beta-D-ribo-hexopyranosyl)oxy)-12,14-dihydroxy-, (3beta,5beta,12beta)-
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CAS No:
3-{[2,6-Dideoxy-4-O-(6-deoxyhexopyranosyl)hexopyranosyl]oxy}-12,14-dihydroxycard-20(22)-enolide Basic Attributes
666.8 g/mol
666.36152715 g/mol
Computed Properties
Molecular Weight:666.8
XLogP3:0.3
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:5
Exact Mass:666.36152715
Monoisotopic Mass:666.36152715
Topological Polar Surface Area:185
Heavy Atom Count:47
Complexity:1230
Undefined Atom Stereocenter Count:18
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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