KEGG   COMPOUND: C06673Help
Entry
C06673                      Compound                               

Name
4-Carboxy-4'-sulfoazobenzene
Formula
C13H10N2O5S
Exact mass
306.031
Mol weight
306.2939
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00627  Aminobenzoate degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.7.1.-
Other DBs
PubChem: 8898
ChEBI: 28585
3DMET: B01022
NIKKAJI: J960.410C
KCF data Show

ATOM        21
            1   C8y C    30.7063  -16.6135
            2   C8x C    31.9192  -17.3131
            3   C8x C    30.7004  -15.2080
            4   N2b N    29.4875  -17.3190
            5   C8x C    33.1321  -16.6135
            6   C8x C    31.9133  -14.5082
            7   N2b N    28.2744  -16.6135
            8   C8y C    33.1321  -15.2080
            9   C8y C    27.0615  -17.3190
            10  S4a S    34.3392  -14.5082
            11  C8x C    27.0615  -18.7186
            12  C8x C    25.8544  -16.6135
            13  O1d O    35.6048  -13.5227
            14  O1d O    35.5464  -15.2022
            15  O1d O    34.3392  -13.1145
            16  C8x C    25.8544  -19.4184
            17  C8x C    24.6356  -17.3190
            18  C8y C    24.6356  -18.7186
            19  C6a C    23.4284  -19.4184
            20  O6a O    22.2155  -18.7244
            21  O6a O    23.4284  -20.8121
BOND        22
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 2
            6     4   7 2
            7     5   8 2
            8     7   9 1
            9     8  10 1
            10    9  11 1
            11    9  12 2
            12   10  13 1
            13   10  14 2
            14   10  15 2
            15   11  16 2
            16   12  17 1
            17   16  18 1
            18   18  19 1
            19   19  20 1
            20   19  21 2
            21    6   8 1
            22   17  18 2

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