α-Methyldigoxin
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α-Methyldigoxin
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CAS No:
31962-94-4
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Formula:
C42H66O14
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Chemical Name:
α-Methyldigoxin
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Synonyms:
Card-20(22)-enolide,3-[(O-2,6-dideoxy-3-O-methyl-β-D-ribo-hexopyranosyl-(1→4)-O-2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-2,6-dideoxy-β-D-ribo-hexopyranosyl)oxy]-12,14-dihydroxy-,(3β,5β,12β)-;Digoxin,3′′′-O-methyl-;(3β,5β,12β)-3-[(O-2,6-Dideoxy-3-O-methyl-β-D-ribo-hexopyranosyl-(1→4)-O-2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-2,6-dideoxy-β-D-ribo-hexopyranosyl)oxy]-12,14-dihydroxycard-20(22)-enolide;3′′′-O-Methyldigoxin;α-Methyldigoxin
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CAS No:
Computed Properties
Molecular Weight:795.0
XLogP3:1.8
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:8
Exact Mass:794.44525677
Monoisotopic Mass:794.44525677
Topological Polar Surface Area:192
Heavy Atom Count:56
Complexity:1460
Undefined Atom Stereocenter Count:21
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes