-OEChem-04131210272D

 18 20  0     1  0  0  0  0  0999 V2000
    0.9160   -0.7462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6226    2.6108    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1236   -2.6108    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3371   -1.7206    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1236    0.2933    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1236    1.6282    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6226    0.1358    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3371    1.3733    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9082    0.5483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1314   -0.4913    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.9082    1.3733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3614    0.9608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9160   -1.5712    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.6226    1.7858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3535   -1.1587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1314   -1.8262    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.3371    0.5483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5834   -2.0561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  1 13  1  0  0  0  0
  2 14  1  0  0  0  0
 16  3  1  1  0  0  0
  4 18  1  0  0  0  0
  5  9  1  0  0  0  0
 10  5  1  6  0  0  0
  5 12  1  0  0  0  0
  6 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7  9  1  0  0  0  0
  7 17  2  0  0  0  0
  8 14  2  0  0  0  0
  8 17  1  0  0  0  0
  9 11  2  0  0  0  0
 10 15  1  0  0  0  0
 11 14  1  0  0  0  0
 13 16  1  0  0  0  0
 13 18  1  6  0  0  0
 15 16  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
92297511

> <PUBCHEM_SUBSTANCE_VERSION>
2

> <PUBCHEM_EXT_DATASOURCE_NAME>
Golm Metabolome Database (GMD), Max Planck Institute of Molecular Plant Physiology

> <PUBCHEM_EXT_DATASOURCE_REGID>
1871BC26-669C-4B3A-8203-11AAECAA0F70

> <PUBCHEM_SUBSTANCE_SYNONYM>
1871BC26-669C-4B3A-8203-11AAECAA0F70
Inosine, 2'-deoxy-

> <PUBCHEM_XREF_EXT_ID>
1871BC26-669C-4B3A-8203-11AAECAA0F70

> <PUBCHEM_EXT_DATASOURCE_URL>
http://gmd.mpimp-golm.mpg.de/

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://gmd.mpimp-golm.mpg.de/Metabolites/1871BC26-669C-4B3A-8203-11AAECAA0F70.aspx

> <PUBCHEM_CID_ASSOCIATIONS>
65058  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

> <PUBCHEM_BONDANNOTATIONS>
13  18  6
16  3  5
10  5  6

$$$$