KEGG   COMPOUND: C03474
Entry
C03474                      Compound                               
Name
4-Nitroquinoline N-oxide;
4-Nitroquinoline 1-oxide;
Nitrochin
Formula
C9H6N2O3
Exact mass
190.0378
Mol weight
190.1555
Structure
Reaction
Enzyme
Other DBs
CAS: 56-57-5
PubChem: 6291
ChEBI: 16907
PDB-CCD: YHX[PDBj]
3DMET: B00590
NIKKAJI: J2.321C
LinkDB
KCF data

ATOM        14
            1   C8y C    26.4603  -16.3681
            2   C8y C    26.4662  -14.9694
            3   C8y C    27.6725  -17.0734
            4   C8x C    25.2538  -17.0675
            5   N5y N    27.6842  -14.2700 #+
            6   C8x C    25.2538  -14.2641
            7   C8x C    28.8907  -16.3798
            8   N2b N    27.6668  -18.4663 #+
            9   C8x C    24.0357  -16.3681
            10  C8x C    28.8966  -14.9811
            11  O3a O    27.6201  -12.8769 #-
            12  C8x C    24.0357  -14.9694
            13  O3a O    26.4545  -19.1600
            14  O3a O    28.8733  -19.1717 #-
BOND        15
            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 2
            13    8  14 1
            14    7  10 1
            15    9  12 1

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