KEGG   COMPOUND: C04050
Entry
C04050                      Compound                               
Name
4-Hydroxyaminoquinoline N-oxide
Formula
C9H8N2O2
Exact mass
176.0586
Mol weight
176.172
Structure
Reaction
Enzyme
Other DBs
CAS: 4637-56-3
PubChem: 6751
ChEBI: 28469
NIKKAJI: J2.218G
KCF data

ATOM        13
            1   C8y C    28.3913  -18.3513
            2   C8y C    28.3970  -16.9467
            3   C8y C    29.6034  -19.0506
            4   C8x C    27.1907  -19.0447
            5   N5y N    29.6150  -16.2474 #+
            6   C8x C    27.1907  -16.2416
            7   C8x C    30.8214  -18.3630
            8   N1b N    29.5976  -20.4493
            9   C8x C    25.9726  -18.3513
            10  C8x C    30.8271  -16.9584
            11  O3a O    29.6208  -14.8546 #-
            12  C8x C    25.9726  -16.9467
            13  O1b O    30.8038  -21.1485
BOND        14
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 2
            9     5  10 2
            10    5  11 1
            11    6  12 2
            12    8  13 1
            13    7  10 1
            14    9  12 1

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