-OEChem-05031011042D

 11 11  0     0  0  0  0  0  0999 V2000
   -1.6966    2.1138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000    3.6517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3138    1.3379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3724    1.3379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3724   -0.2207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000    2.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7138   -0.9862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9655   -0.9862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7138   -2.5310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9655   -2.5310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3724   -3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  2  0  0  0  0
  2  6  2  0  0  0  0
  3  6  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  2  0  0  0  0
 10 11  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
155227

> <PUBCHEM_SUBSTANCE_VERSION>
4

> <PUBCHEM_EXT_DATASOURCE_NAME>
ChemIDplus

> <PUBCHEM_EXT_DATASOURCE_REGID>
000611734

> <PUBCHEM_SUBSTANCE_SYNONYM>
2-Oxo-2-phenylacetic acid
2-Phenylethanoic acid
4-10-00-02737 (Beilstein Handbook Reference)
43165-51-1 (sodium)
52009-50-4 (calcium)
611-73-4
63468-90-6 (potassium)
AI3-26708
BRN 0606718
Benzeneacetic acid, alpha-oxo- (9CI)
Benzeneglyoxylic acid
Benzoylformic acid
EINECS 210-278-7
Formic acid, benzoyl-
Glyoxylic acid, phenyl-
Glyoxylic acid, phenyl- (8CI)
NSC 28293
Oxophenylacetic acid
Phenylgloxylic acid
Phenylglyoxalate
Phenylglyoxylic acid
Phenyloxoacetic acid
alpha-Ketophenylacetic acid
alpha-Oxobenzeneacetic acid

> <PUBCHEM_GENERIC_REGISTRY_NAME>
611-73-4

> <PUBCHEM_XREF_EXT_ID>
000611734

> <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=000611734

> <PUBCHEM_CID_ASSOCIATIONS>
11915  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$