-ISIS-  05031710462D

 31 33  0  0  0  0  0  0  0  0999 V2000
    2.9417   -4.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9417   -5.3875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7292   -5.8458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5167   -5.3875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5167   -4.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7292   -4.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3042   -5.8458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0917   -5.3875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0917   -4.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3042   -4.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8750   -5.8417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1500   -5.8458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1500   -6.7542    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.9417   -7.2083    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.7292   -6.7542    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.2750   -6.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6958   -7.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9417   -8.1167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5167   -7.2083    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1542   -8.5708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3708   -8.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1542   -9.4792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5833   -8.5708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3708   -7.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2000   -8.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5167   -8.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3000   -8.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7292   -8.5667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0875   -8.1125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8750   -8.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3000   -9.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  8 11  2  0  0  0  0
  2 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15  3  1  0  0  0  0
 13 16  1  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 21 23  2  0  0  0  0
 21 24  1  0  0  0  0
 23 25  1  0  0  0  0
 19 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  2  0  0  0  0
 27 29  2  0  0  0  0
 29 30  1  0  0  0  0
 27 31  1  0  0  0  0
M  END
>  <Catalog No.>
CFN98140

>  <Name>
Praeruptorin B

>  <CAS Number>
81740-07-0

>  <Purity>
98%

>  <Formula>
C24H26O7

>  <Mol Weight>
426.46

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Praeruptorin-B-CFN98140.html

$$$$