KEGG   COMPOUND: C19788
Entry
C19788                      Compound                               
Name
5-Nitroanthranilate;
2-Amino-5-nitrobenzoate
Formula
C7H6N2O4
Exact mass
182.0328
Mol weight
182.13
Structure
Reaction
R09661
Enzyme
3.5.99.8
Other DBs
CAS: 616-79-5
PubChem: 135626255
KNApSAcK: C00042156
PDB-CCD: 6R6[PDBj]
LinkDB
KCF data

ATOM        13
            1   C8x C    18.4800  -16.6600
            2   C8x C    18.4800  -18.0600
            3   C8y C    19.6700  -18.7600
            4   C8x C    20.9300  -18.0600
            5   C8y C    20.9300  -16.6600
            6   C8y C    19.6700  -15.9600
            7   N1a N    19.6700  -14.5600
            8   N2b N    19.6700  -20.1600 #+
            9   C6a C    22.1200  -15.9600
            10  O6a O    23.3100  -16.6600
            11  O6a O    22.1200  -14.5600
            12  O3a O    18.4800  -20.8600
            13  O3a O    20.8600  -20.8600 #-
BOND        13
            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     3   8 1
            9     5   9 1
            10    9  10 1
            11    9  11 2
            12    8  12 2
            13    8  13 1

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