Paederoside
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Paederoside
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CAS No:
20547-45-9
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Formula:
C18H22O11S
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Chemical Name:
Paederoside
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Synonyms:
Carbonothioic acid,O-[[(2aS,4aS,5S,7bS)-5-(β-D-glucopyranosyloxy)-2a,4a,5,7b-tetrahydro-1-oxo-1H-2,6-dioxacyclopent[cd]inden-4-yl]methyl] S-methyl ester;Pederoside;Carbonothioic acid,O-[[5-(β-D-glucopyranosyloxy)-2a,4a,5,7b-tetrahydro-1-oxo-1H-2,6-dioxacyclopent[cd]inden-4-yl]methyl] S-methyl ester,[2aS-(2aα,4aα,5α,7bα)]-;1H-2,6-Dioxacyclopent[cd]indene,carbonothioic acid deriv.;Paederoside;NSC 305984;27745-19-3
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CAS No:
Computed Properties
Molecular Weight:446.4
XLogP3:-1.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:7
Exact Mass:446.08828269
Monoisotopic Mass:446.08828269
Topological Polar Surface Area:187
Heavy Atom Count:30
Complexity:767
Undefined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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