-OEChem-10311114432D

  8  8  0     0  0  0  0  0  0999 V2000
    6.0265   -5.2453    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7222   -3.3954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5720   -2.5653    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4297   -3.9764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9040   -3.3005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6906   -4.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6115   -3.9764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3506   -4.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1  8  1  0  0  0  0
  2  5  2  0  0  0  0
  3  5  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
8147959

> <PUBCHEM_SUBSTANCE_VERSION>
6

> <PUBCHEM_EXT_DATASOURCE_NAME>
ChEBI

> <PUBCHEM_EXT_DATASOURCE_REGID>
CHEBI:30846

> <PUBCHEM_SUBSTANCE_SYNONYM>
3-carboxyfuran
3-furancarboxylic acid
3-furoic acid
CHEBI:30846
furan-3-carboxylic acid

> <PUBCHEM_XREF_EXT_ID>
CHEBI:30846

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.ebi.ac.uk/chebi/

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:30846

> <PUBCHEM_CID_ASSOCIATIONS>
10268  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$