Decoquinate.cdx
csChFnd80/01081415032D

 30 31  0  0  0  0  0  0  0  0999 V2000
    2.4249    4.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6415    2.0976    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8582    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8582    4.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6415    4.9073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0748    2.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2915    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2915    4.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0748    4.9073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.9049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    6.3049    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2049    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.8049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6415    6.3073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5039    4.9049    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5039    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5039    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2915    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5039    6.3049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7164    7.0049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7164    8.4049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9288    9.1049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9288   10.5049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1412   11.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1412   12.6049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3537   13.3049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3537   14.7049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5661   15.4049    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  2  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
  1 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
  6 16  1  0  0  0  0
  9 17  1  0  0  0  0
  8 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 17 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
M  END
>  <Mol_ID> (1)
1796

>  <Formula> (1)
C24H35NO5

>  <MolWeight> (1)
417.5384

>  <Item Name> (1)
Decoquinate

>  <Catalog Number> (1)
S4145

>  <Synonyms> (1)
N/A

>  <Target> (1)
Others

>  <Form> (1)
Free Base

>  <URL> (1)
http://www.selleckchem.com/products/decoquinate.html

>  <CAS Number> (1)
18507-89-6

$$$$
