-OEChem-11021115562D

  8  8  0     0  0  0  0  0  0999 V2000
   -0.8927    0.4397    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.9140    1.4936    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7640   -0.0413    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0386    0.0173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9140    0.4783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0973   -0.9699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5655   -0.2678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0779   -1.1485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  7  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
  6  8  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>
154002

> <PUBCHEM_SUBSTANCE_VERSION>
4

> <PUBCHEM_EXT_DATASOURCE_NAME>
ChemIDplus

> <PUBCHEM_EXT_DATASOURCE_REGID>
000527720

> <PUBCHEM_SUBSTANCE_COMMENT>
Drug / Therapeutic Agent

> <PUBCHEM_SUBSTANCE_SYNONYM>
2-Carboxythiophene
2-TCA
2-Thenoic acid
2-Thienylcarboxylic acid
2-Thiophenecarboxylic acid
2-Thiophenic acid
25112-68-9 (hydrochloride salt)
5-18-06-00158 (Beilstein Handbook Reference)
527-72-0
AI3-16118
BRN 0110150
EINECS 208-423-4
NSC 2188
Thiophene-2-carboxylate
alpha-Thiophenecarboxylic acid

> <PUBCHEM_GENERIC_REGISTRY_NAME>
527-72-0

> <PUBCHEM_XREF_EXT_ID>
000527720

> <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=000527720

> <PUBCHEM_CID_ASSOCIATIONS>
10700  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$