KEGG   DRUG: DifloxacinHelp
Entry
D07828                      Drug                                   

Name
Difloxacin (INN);
Marbocyl (TN)
Formula
C21H19F2N3O3
Exact mass
399.1394
Mol weight
399.3907
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antibacterial
 DG01550  Quinolone
  DG01549  Fluoroquinolone
Remark
Same as: C11234
Chemical structure group: DG01228
Efficacy
Antibacterial (veterinary), Nucleic acid biosynthesis inhibitor
Comment
Fluoroquinolones
Target
DNA gyrase [KO:K02469 K02470]
Interaction
Drug interaction
Other DBs
CAS: 98106-17-3
PubChem: 96024525
ChEBI: 4537
ChEMBL: CHEMBL6259
LigandBox: D07828
NIKKAJI: J22.039F
LinkDB All DBs
KCF data Show

ATOM        29
            1   C8y C    25.3400  -16.5900
            2   C8y C    25.3400  -15.1900
            3   N4y N    26.5300  -17.2900
            4   C8x C    24.0800  -17.2900
            5   C8y C    26.5300  -14.4900
            6   C8x C    24.0800  -14.4900
            7   C8x C    27.7900  -16.5900
            8   C8y C    26.5300  -18.6900
            9   C8y C    22.8900  -16.5900
            10  C8y C    27.7900  -15.1900
            11  O5x O    26.5300  -13.0900
            12  C8y C    22.8900  -15.1900
            13  N1y N    21.7000  -17.2200
            14  C6a C    28.9800  -14.4900
            15  X   F    21.7000  -14.4900
            16  C1x C    20.4400  -16.5200
            17  C1x C    21.7000  -18.6200
            18  O6a O    30.2400  -15.1900
            19  O6a O    28.9800  -13.0200
            20  C1x C    19.2500  -17.2200
            21  C1x C    20.4400  -19.3200
            22  N1y N    19.2500  -18.6200
            23  C8x C    25.3400  -19.3900
            24  C8x C    25.3400  -20.7900
            25  C8y C    26.6000  -21.4900
            26  C8x C    27.7900  -20.7900
            27  C8x C    27.7900  -19.3900
            28  X   F    26.6000  -22.8900
            29  C1a C    18.0600  -19.3200
BOND        32
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    5  11 2
            11    6  12 2
            12    9  13 1
            13   10  14 1
            14   12  15 1
            15   13  16 1
            16   13  17 1
            17   14  18 1
            18   14  19 2
            19   16  20 1
            20   17  21 1
            21   20  22 1
            22    7  10 2
            23    9  12 1
            24   21  22 1
            25    8  23 2
            26   23  24 1
            27   24  25 2
            28   25  26 1
            29   26  27 2
            30    8  27 1
            31   25  28 1
            32   22  29 1

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