KEGG   COMPOUND: C02086
Entry
C02086                      Compound                               
Name
Thioglycolate;
Mercaptoacetic acid;
Mercaptoethanoic acid;
Thioglycolic acid
Formula
C2H4O2S
Exact mass
91.9932
Mol weight
92.117
Structure
Reaction
Enzyme
Other DBs
CAS: 68-11-1
PubChem: 5171
ChEBI: 30065
PDB-CCD: MCR[PDBj]
3DMET: B00387
NIKKAJI: J4.856I
KCF data

ATOM        5
            1   S1a S    11.3400  -16.0300
            2   C1b C    12.5524  -16.7300
            3   C6a C    13.7649  -16.0300
            4   O6a O    14.9773  -16.7300
            5   O6a O    13.7649  -14.6302
BOND        4
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     3   5 2

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