KEGG   COMPOUND: C18320
Entry
C18320                      Compound                               
Name
4-Amino-2-nitrotoluene
Formula
C7H8N2O2
Exact mass
152.0586
Mol weight
152.1506
Structure
Reaction
Pathway
map00633  Nitrotoluene degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.7.1.-
Other DBs
CAS: 119-32-4
PubChem: 103061502
ChEBI: 81670
LinkDB
KCF data

ATOM        11
            1   C8y C    26.3200  -18.9000
            2   C8x C    26.3200  -20.3000
            3   C8y C    27.5324  -21.0000
            4   C8x C    28.7449  -20.3000
            5   C8x C    28.7449  -18.9000
            6   C8y C    27.5324  -18.2000
            7   C1a C    27.5324  -16.8002
            8   N2b N    25.1076  -18.2000 #+
            9   N1a N    27.5324  -22.3998
            10  O3a O    23.9121  -18.8904
            11  O3a O    25.1075  -16.8002 #-
BOND        11
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     6   7 1
            8     1   8 1
            9     3   9 1
            10    8  10 2
            11    8  11 1

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