D-Glucopyranosyl Thiosemicarbazide
  -molcms-05272601402D

 16 16  0  0  1  0  0  0  0  0999 V2000
    3.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000   -0.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000   -0.8660    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5000   -0.8660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000   -0.8660    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.0000   -1.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000   -2.5981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0000    0.0000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    0.8660    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.0000    1.7321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5000    0.8660    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0000    1.7321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000   -1.7321    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  6  0  0  0
  8  9  1  0  0  0  0
  7 10  1  0  0  0  0
 10 11  1  1  0  0  0
 10 12  1  0  0  0  0
 12 13  1  6  0  0  0
 12 14  1  0  0  0  0
 14  5  1  0  0  0  0
 14 15  1  1  0  0  0
  2 16  2  0  0  0  0
M  END
>  <ProductName>
D-Glucopyranosyl Thiosemicarbazide

>  <CASNumber>
154634-24-9

>  <MolecularFormula>
C7H15N3O5S

>  <MDLNo>


>  <MolWt>
253.28

>  <BoilingPoint>


>  <MeltingPoint>


>  <MolFile>


>  <Smiles>
NC(NNC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=S

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