KEGG   DRUG: Balofloxacin hydrate
Entry
D02463                      Drug                                   
Name
Balofloxacin hydrate (JAN)
Formula
C20H24FN3O4. 2H2O
Exact mass
425.1962
Mol weight
425.4512
Structure
Simcomp
Class
Antibacterial
 DG01550  Quinolone
  DG01549  Fluoroquinolone
Efficacy
Antibacterial, Nucleic acid biosynthesis inhibitor
Comment
Fluoroquinolones
Target
DNA gyrase [KO:K02469 K02470]
topoisomerase IV [KO:K02621 K02622]
Interaction
Brite
Drug groups [BR:br08330]
 Antibacterial
  DG01550  Quinolone
   DG01549  Fluoroquinolone
    D02463  Balofloxacin hydrate
Antimicrobials [BR:br08307]
 Antibacterials
  Nucleic acid synthesis inhibitor
   Fluoroquinolone
    D02463  Balofloxacin hydrate (JAN)
Antimicrobials abbreviations [BR:br08327]
 Antibacterials
  Nucleic acid synthesis inhibitor
   Fluoroquinolone
    D02463  Balofloxacin hydrate (JAN)
Other DBs
PubChem: 7849519
LigandBox: D02463
KCF data

ATOM        30
            1   C8y C    22.2239  -18.4885
            2   O2a O    23.4381  -20.5900
            3   C1y C    25.8663  -20.5900
            4   C8y C    23.4381  -19.1891
            5   C8y C    22.2239  -17.0876
            6   C8x C    23.4847  -16.3872
            7   N4y N    25.8663  -19.1891
            8   C8y C    24.6522  -18.4885
            9   C8y C    24.6522  -17.1344
            10  C8y C    25.8663  -16.4339
            11  C8y C    27.0804  -17.0876
            12  C8x C    27.0804  -18.4885
            13  C6a C    28.2945  -16.3872
            14  O6a O    28.2945  -14.9863
            15  O6a O    29.5086  -17.0876
            16  O5x O    25.8663  -15.0330
            17  X   F    21.0098  -16.3872
            18  C1x C    25.1658  -21.8041
            19  C1x C    26.5667  -21.8041
            20  N1y N    21.0098  -19.1891
            21  C1x C    21.0098  -20.5900
            22  C1x C    19.7956  -21.2904
            23  C1x C    18.5814  -20.5900
            24  C1y C    18.5814  -19.1891
            25  C1x C    19.7956  -18.4885
            26  N1b N    17.3674  -18.4885
            27  C1a C    16.1533  -19.1891
            28  C1a C    22.2239  -21.2904
            29  O0  O    30.6600  -20.7200
            30  O0  O    30.6600  -20.7200
BOND        31
            1     1   5 1
            2     5   6 2
            3     6   9 1
            4     2   4 1
            5     7   3 1
            6     7   8 1
            7     8   9 2
            8     9  10 1
            9    10  11 1
            10   11  12 2
            11   12   7 1
            12   11  13 1
            13   13  14 2
            14   13  15 1
            15   10  16 2
            16    8   4 1
            17    5  17 1
            18    4   1 2
            19   18  19 1
            20   19   3 1
            21   18   3 1
            22    1  20 1
            23   20  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   20  25 1
            29   24  26 1 #Up
            30   26  27 1
            31    2  28 1
BRACKET     1    28.5600  -21.7700   28.5600  -19.6700
            1    31.3600  -19.6700   31.3600  -21.7700
            1  2
 ORIGINAL  1   29
 REPEAT    1   30

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Ontology (3)   
   KEGG BRITE (3)   
Drug (2)   
   KEGG DGROUP (1)   
   LigandBox (1)   
Chemical substance (1)   
   PubChem (1)   
Gene (4)   
   KEGG ORTHOLOGY (4)   
All databases (10)   

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