Marvin  10120614302D          

  8  8  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6675   -0.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6674   -0.4849    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7144    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2375    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.4125   -1.2695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125   -1.2695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  7  8  2  0  0  0  0
M  CHG  1   6  -1
M  END
> <ID>
CHEBI:27660

> <NAME>
pyrrole-2-carboxylate

> <STAR>
3

> <SECONDARY_ID>
CHEBI:45388; CHEBI:26451

> <SYNONYM>
pyrrole-2-carboxylate

> <IUPAC_NAME>
1H-pyrrole-2-carboxylate

> <FORMULA>
C5H4NO2

> <MASS>
110.09080

> <MONOISOTOPIC_MASS>
110.02475

> <CHARGE>
-1

> <SMILES>
[O-]C(=O)c1ccc[nH]1

> <INCHI>
InChI=1S/C5H5NO2/c7-5(8)4-2-1-3-6-4/h1-3,6H,(H,7,8)/p-1

> <INCHIKEY>
WRHZVMBBRYBTKZ-UHFFFAOYSA-M

> <BEILSTEIN_REGISTRY_NUMBER>
3663073

> <GMELIN_REGISTRY_NUMBER>
1006285

$$$$