-OEChem-05171211432D

 10 10  0     0  0  0  0  0  0999 V2000
    0.8575    2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8575   -2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4620    0.5017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7300    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8600    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7300   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8600   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5955    1.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  2  7  1  0  0  0  0
  3 10  2  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4 10  1  0  0  0  0
  5  8  2  0  0  0  0
  6  7  1  0  0  0  0
  7  9  2  0  0  0  0
  8  9  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
135026429

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
ChemIDplus

> <PUBCHEM_EXT_DATASOURCE_REGID>
0001194985

> <PUBCHEM_SUBSTANCE_SYNONYM>
1194-98-5
2,5-Dihydroxybenzaldehyde
Benzaldehyde, 2,5-dihydroxy-
EINECS 214-789-6
Gentisaldehyde
NSC 72387

> <PUBCHEM_GENERIC_REGISTRY_NAME>
1194-98-5

> <PUBCHEM_XREF_EXT_ID>
0001194985

> <PUBCHEM_EXT_DATASOURCE_URL>
http://chem.sis.nlm.nih.gov/chemidplus/

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://chem.sis.nlm.nih.gov/chemidplus/direct.jsp?result=advanced&regno=0001194985

> <PUBCHEM_CID_ASSOCIATIONS>
70949  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$