-OEChem-04131210272D

 18 20  0     1  0  0  0  0  0999 V2000
    5.0626   -6.9529    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9195   -3.5336    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7690   -7.8330    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8960   -8.7970    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2803   -5.6388    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2803   -4.4218    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9195   -5.7768    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2699   -4.6518    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5703   -5.4047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5052   -6.3517    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.5703   -4.6518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7370   -5.0268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9195   -4.2794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4988   -7.5640    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.2161   -6.5889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2123   -7.3341    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.2699   -5.4047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3419   -8.2928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  1 14  1  0  0  0  0
  2 13  2  0  0  0  0
 16  3  1  6  0  0  0
  4 18  1  0  0  0  0
  5  9  1  0  0  0  0
 10  5  1  1  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 13  1  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 13  1  0  0  0  0
 14 16  1  0  0  0  0
 14 18  1  1  0  0  0
 15 16  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
24893935

> <PUBCHEM_SUBSTANCE_VERSION>
3

> <PUBCHEM_EXT_DATASOURCE_NAME>
Sigma-Aldrich

> <PUBCHEM_EXT_DATASOURCE_REGID>
D5287_SIGMA

> <PUBCHEM_SUBSTANCE_SYNONYM>
2'-Deoxyinosine
9-(2-Deoxy-beta-D-ribofuranosyl)hypoxanthine
D5287_SIGMA

> <PUBCHEM_XREF_EXT_ID>
D5287_SIGMA

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.sigmaaldrich.com?cm_mmc=affiliate-_-PubChem-_-product-_-link

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.sigmaaldrich.com/catalog/search/ProductDetail/SIGMA/D5287?cm_mmc=affiliate-_-PubChem-_-product-_-link

> <PUBCHEM_CID_ASSOCIATIONS>
65058  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

> <PUBCHEM_BONDANNOTATIONS>
14  18  5
16  3  6
10  5  5

$$$$