-ISIS-  05031710462D

 22 25  0  0  0  0  0  0  0  0999 V2000
    3.5125  -15.7875    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.0333  -16.6167    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.9583  -16.3542    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.8875  -16.6167    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.3667  -15.7875    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.4417  -16.0500    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.8083  -16.3542    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.7375  -16.6167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2208  -15.7875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2958  -16.0500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5125  -14.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9583  -15.3917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3667  -14.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.4708  -14.3417    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.4708  -13.3792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9208  -15.2167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1042  -16.3708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0333  -17.5792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4250  -17.0500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3292  -17.1875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9750  -15.1958    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1917  -14.3333    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
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  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  1  0  0  0  0
 10  5  1  0  0  0  0
  1 11  1  0  0  0  0
  3 12  1  0  0  0  0
  5 13  1  0  0  0  0
 11 14  1  0  0  0  0
 13 14  1  0  0  0  0
 14 12  1  0  0  0  0
 14 15  1  0  0  0  0
  6 16  1  0  0  0  0
  2 17  1  0  0  0  0
  2 18  1  0  0  0  0
 17 19  1  0  0  0  0
  7 20  1  0  0  0  0
  9 21  2  0  0  0  0
 13 22  1  1  0  0  0
M  END
>  <Catalog No.>
CFN99936

>  <Name>
Tetrodotoxin

>  <CAS Number>
4368-28-9

>  <Purity>
98%

>  <Formula>
C11H17N3O8

>  <Mol Weight>
319.27

>  <Physical Description>
Powder

>  <Type of Compound>
Alkaloids

>  <Solvent>
Pyridine, Methanol, Ethanol, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Tetrodotoxin-CFN99936.html

$$$$