Acalyphin

Catalog No. :
ACICYS400
CAS No. :
81861-72-5
Molecular Formula :
C14H20N2O9
Molecular Weight :
360.32

IUPAC Name:(2S,3R)-2-hydroxy-4-methoxy-1-methyl-6-oxo-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,2,3,6-tetrahydropyridine-3-carbonitrile

Acalyphin structure diagram
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Product Information

Product NameAcalyphin
IUPAC Name(2S,3R)-2-hydroxy-4-methoxy-1-methyl-6-oxo-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,2,3,6-tetrahydropyridine-3-carbonitrile
Molecular FormulaC14H20N2O9
Molecular Weight360.32
SMILESCOC1=CC(=O)N(C)[C@@H](O)[C@]1(C#N)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChI KeyQZRKNNXRNBTODR-JKTRLFLGSA-N
Synonym2-hydroxy-4-methoxy-1-methyl-6-oxo-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2H-pyridine-3-carbonitrile;acalyphin;3-Pyridinecarbonitrile, 3-(β-D-glucopyranosyloxy)-1,2,3,6-tetrahydro-2-hydroxy-4-methoxy-1-methyl-6-oxo-, (5R,6S)-
CAS No.81861-72-5

Synthetic Route by SureRoute

1. ACICYS400 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACICYS400 route product structure diagram
    ACICYS40081861-72-5
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2. ACICYS400 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACICYS400 route product structure diagram
    ACICYS40081861-72-5
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