Marvin  11230709422D          

  5  4  0  0  0  0            999 V2000
   -1.0717    0.2062    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3572   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3572    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0717   -0.2062    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.3572    1.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  3  5  2  0  0  0  0
  3  4  1  0  0  0  0
M  CHG  1   4  -1
M  END
> <ID>
CHEBI:30066

> <NAME>
thioglycolate(1-)

> <STAR>
3

> <SECONDARY_ID>
CHEBI:15236; CHEBI:26966

> <SYNONYM>
thioglycollate; thioglycolate; mercaptoacetate

> <IUPAC_NAME>
sulfanylacetate

> <FORMULA>
C2H3O2S

> <MASS>
91.11002

> <MONOISOTOPIC_MASS>
90.98592

> <CHARGE>
-1

> <SMILES>
[O-]C(=O)CS

> <INCHI>
InChI=1S/C2H4O2S/c3-2(4)1-5/h5H,1H2,(H,3,4)/p-1

> <INCHIKEY>
CWERGRDVMFNCDR-UHFFFAOYSA-M

> <BEILSTEIN_REGISTRY_NUMBER>
3903690

> <GMELIN_REGISTRY_NUMBER>
324390

$$$$