Atropine sulfate monohydrate.cdx
csChFnd80/01301313122D

 52 54  0  0  0  0  0  0  0  0999 V2000
    6.1896   11.3702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5896   11.3702    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.2872   12.5784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2872   10.1620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4921   10.1620    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4921   12.5784    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6872   10.1620    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6872   12.5784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3872   13.7909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6872   15.0033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2872   15.0033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5872   13.7909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4487   10.5826    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1458   10.0709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7441   11.3366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0271   11.8953    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4487   13.3465    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3126   11.3416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7564   10.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0126   10.1291    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.2396   12.5953    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4553    9.1875    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1856   14.7166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0438    2.1827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4438    2.1827    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.1414    3.3909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1414    0.9745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3462    0.9745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3462    3.3909    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5414    0.9745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5414    3.3909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2414    4.6034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5414    5.8158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1414    5.8158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4414    4.6034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3028    1.3951    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0000    0.8834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5983    2.1491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8813    2.7078    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.3028    4.1590    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1668    2.1541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6106    0.8958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8668    0.9416    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.0937    3.4078    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3095    0.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0398    5.5291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8667    8.5264    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2667    8.5264    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   17.6667    8.5264    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2667    9.9216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2667    7.1313    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5599    3.8014    0.0000 O   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
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  4  7  1  0  0  0  0
  3  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12  3  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 13 17  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 13 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 20  1  0  0  0  0
 20  5  1  6  0  0  0
 16 21  1  6  0  0  0
 13 22  1  1  0  0  0
 17 23  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
 24 28  1  0  0  0  0
 24 29  2  0  0  0  0
 27 30  1  0  0  0  0
 26 31  2  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 34  1  0  0  0  0
 34 35  2  0  0  0  0
 35 26  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 36 40  1  0  0  0  0
 39 40  1  0  0  0  0
 39 41  1  0  0  0  0
 36 42  1  0  0  0  0
 41 43  1  0  0  0  0
 42 43  1  0  0  0  0
 43 28  1  6  0  0  0
 39 44  1  6  0  0  0
 36 45  1  1  0  0  0
 40 46  1  0  0  0  0
 47 48  1  0  0  0  0
 48 49  1  0  0  0  0
 48 50  2  0  0  0  0
 48 51  2  0  0  0  0
M  END
>  <Mol_ID> (1)
632

>  <Formula> (1)
C34H50N2O11S

>  <MolWeight> (1)
694.8326

>  <Item Name> (1)
Atropine 

>  <Catalog Number> (1)
S2130

>  <Synonyms> (1)
Tropine 

>  <Target> (1)
Others

>  <URL> (1)
http://www.selleckchem.com/products/Atropine-sulfate-monohydrate.html

>  <CAS Number> (1)
5908-99-6

$$$$
