-OEChem-10201113242D

  9  9  0     0  0  0  0  0  0999 V2000
   30.6414  -15.5514    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.2146  -14.1619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.2146  -19.7582    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.4376  -16.2492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.2211  -15.5514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.2211  -18.3687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.4376  -17.6581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.0108  -16.2492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.0108  -17.6581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  5  1  0  0  0  0
  4  7  2  0  0  0  0
  5  8  2  0  0  0  0
  6  7  1  0  0  0  0
  6  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>
5764

> <PUBCHEM_SUBSTANCE_VERSION>
9

> <PUBCHEM_EXT_DATASOURCE_NAME>
KEGG

> <PUBCHEM_EXT_DATASOURCE_REGID>
C02814

> <PUBCHEM_SUBSTANCE_COMMENT>
Pathway: <a href="http://www.genome.jp/kegg-bin/show_pathway?map00361+C02814">map00361</a> Chlorocyclohexane and chlorobenzene degradation
Pathway: <a href="http://www.genome.jp/kegg-bin/show_pathway?map00362+C02814">map00362</a> Benzoate degradation
Pathway: <a href="http://www.genome.jp/kegg-bin/show_pathway?map00627+C02814">map00627</a> Aminobenzoate degradation
Is a reactant of enzyme EC: 1.1.-.-
Is a reactant of enzyme EC: 1.6.5.7
Is a reactant of enzyme EC: 1.13.11.37
Is a reactant of enzyme EC: 1.13.11.-
Is a reactant of enzyme EC: 1.14.13.7
Is a reactant of enzyme EC: 1.14.13.64
Is a reactant of enzyme EC: 1.14.13.-
Is a reactant of enzyme EC: 1.14.-.-

> <PUBCHEM_SUBSTANCE_SYNONYM>
1,2,4-Benzenetriol
1,2,4-Trihydroxybenzene
533-73-3
Benzene-1,2,4-triol
C02814
Hydroxyhydroquinone
Hydroxyquinol

> <PUBCHEM_GENERIC_REGISTRY_NAME>
533-73-3

> <PUBCHEM_XREF_EXT_ID>
C02814

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.genome.jp/kegg/

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.genome.jp/dbget-bin/www_bget?cpd:C02814

> <PUBCHEM_CID_ASSOCIATIONS>
10787  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$