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Paederoside

Paederoside structure

Paederoside 

structure
  • CAS No:

    20547-45-9

  • Formula:

    C18H22O11S

  • Chemical Name:

    Paederoside

  • 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

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Paederoside Basic Attributes

446.43

446.43

305984

Characteristics

187 Ų

1.65±0.1 g/cm3

122-123 °C

737.3±70.0 °C(Predicted)

12.76±0.70

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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