KEGG   COMPOUND: C06679Help
Entry
C06679                      Compound                               

Name
4-Sulfobenzaldehyde;
4-Formylbenzenesulfonate
Formula
C7H6O4S
Exact mass
185.9987
Mol weight
186.1851
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Toluene degradation
Microbial metabolism in diverse environments
Degradation of aromatic compounds
Enzyme
1.1.1.257       1.2.1.62
Other DBs
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        12
            1   C8y C    27.8962  -20.4346
            2   C8x C    26.7078  -19.7547
            3   C8x C    29.0788  -19.7547
            4   S4a S    27.8962  -21.8058
            5   C8x C    26.7078  -18.3836
            6   C8x C    29.0788  -18.3836
            7   O1d O    27.9141  -23.4674
            8   O1d O    26.7136  -22.4856
            9   O1d O    29.2896  -22.3488
            10  C8y C    27.8962  -17.7038
            11  C4a C    27.8962  -16.3384
            12  O4a O    29.1464  -15.6169
BOND        12
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 1
            7     4   8 2
            8     4   9 2
            9     5  10 1
            10   10  11 1
            11    6  10 2
            12   11  12 2

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