KEGG   COMPOUND: C06676
Entry
C06676                      Compound                               
Name
4-Sulfolactone;
4-Carboxymethyl-4-sulfobut-2-en-4-olide;
4-Sulfomuconolactone
Formula
C6H6O7S
Exact mass
221.9834
Mol weight
222.1726
Structure
Reaction
Pathway
map00627  Aminobenzoate degradation
map01120  Microbial metabolism in diverse environments
Enzyme
3.1.1.92        5.5.1.-
Other DBs
PubChem: 8901
ChEBI: 28947
NIKKAJI: J2.763.432J
KCF data

ATOM        14
            1   C2x C    27.3014  -22.0705
            2   C1z C    26.8683  -20.7538
            3   C2x C    28.6882  -22.0705
            4   O7x O    27.9977  -19.9346
            5   C1b C    25.5516  -20.3266
            6   C7x C    29.1213  -20.7538
            7   C6a C    25.2649  -18.9747
            8   O6a O    30.4380  -20.3266
            9   O6a O    26.2889  -18.0444
            10  O6a O    23.9482  -18.5418
            11  S4a S    25.8783  -21.7437
            12  O1d O    25.8783  -23.1437
            13  O1d O    24.8884  -20.7538
            14  O1d O    24.6659  -22.4437
BOND        14
            1     1   2 1
            2     1   3 2
            3     2   4 1
            4     2   5 1
            5     3   6 1
            6     5   7 1
            7     6   8 2
            8     7   9 1
            9     7  10 2
            10    4   6 1
            11    2  11 1
            12   11  12 2
            13   11  13 2
            14   11  14 1

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