KEGG   COMPOUND: C16392Help
Entry
C16392                      Compound                               

Name
4-Hydroxylamino-2,6-dinitrotoluene
Formula
C7H7N3O5
Exact mass
213.0386
Mol weight
213.1476
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00633  Nitrotoluene degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.7.1.-         1.-.-.-
Other DBs
CAS: 59283-75-9
PubChem: 47205690
ChEBI: 20408
NIKKAJI: J652.388I
KCF data Show

ATOM        15
            1   C8y C    28.1033  -23.7134
            2   C8x C    28.1033  -25.1138
            3   C8y C    29.3200  -25.8175
            4   C8x C    30.5293  -25.1138
            5   C8y C    30.5293  -23.7134
            6   C8y C    29.3200  -23.0168
            7   C1a C    29.3217  -21.6166
            8   N2b N    31.7436  -23.0178 #+
            9   N1b N    29.3217  -27.2177
            10  O3a O    32.9567  -23.7152
            11  O3a O    31.7446  -21.6174 #-
            12  N2b N    26.8770  -23.0020 #+
            13  O3a O    25.6540  -23.7044
            14  O3a O    26.8800  -21.6315 #-
            15  O1b O    30.5466  -27.9228
BOND        15
            1     6   7 1
            2     1   2 2
            3     5   8 1
            4     2   3 1
            5     3   9 1
            6     3   4 2
            7     8  10 2
            8     4   5 1
            9     8  11 1
            10    5   6 2
            11    6   1 1
            12    1  12 1
            13   12  13 2
            14   12  14 1
            15    9  15 1

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