KEGG   DRUG: TrovafloxacinHelp
Entry
D08654                      Drug                                   

Name
Trovafloxacin (INN)
Formula
C20H15F3N4O3
Exact mass
416.1096
Mol weight
416.3533
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Antibacterial
 DG01550  Quinolone
  DG01549  Fluoroquinolone
Other
 DG01529  Topoisomerase inhibitor
  DG01528  Topoisomerase IV inhibitor
Remark
Same as: 
ATC code: 
Chemical group: 
Efficacy
Antibacterial, Nucleic acid biosynthesis inhibitor
Comment
Fluoroquinolones
Target
DNA gyrase [KO:K02469 K02470];
topoisomerase IV [KO:K02621 K02622]
Interaction
Drug interaction
Structure map
Quinolones
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01M QUINOLONE ANTIBACTERIALS
    J01MA Fluoroquinolones
     J01MA13 Trovafloxacin
      D08654  Trovafloxacin (INN)
Antiinfectives [BR:br08307]
 Antibacterials
  Nucleic acid synthesis inhibitor
   type II topoisomerase (DNA gyrase, topoisomerase IV) inhibitor
    Fluoroquinolones
     Trovafloxacin
      D08654  Trovafloxacin (INN)
BRITE hierarchy
Other DBs
CAS: 
147059-72-1
PubChem: 
ChEBI: 
ChEMBL: 
DrugBank: 
PDB-CCD: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        30
            1   C8y C    25.6900  -16.5200
            2   N4y N    26.8100  -17.2200
            3   C8y C    25.6900  -15.1200
            4   N5x N    24.4300  -17.2200
            5   C8y C    26.8100  -18.6200
            6   C8x C    28.0000  -16.5200
            7   C8y C    26.7400  -14.4200
            8   C8x C    24.4300  -14.4200
            9   C8y C    23.2400  -16.5200
            10  C8y C    28.0700  -19.3200
            11  C8x C    25.6900  -19.3200
            12  C8y C    28.0000  -15.1200
            13  O5x O    26.7400  -13.0200
            14  C8y C    23.2400  -15.1200
            15  N1y N    22.0500  -17.2900
            16  C8x C    28.0700  -20.7900
            17  X   F    29.2600  -18.6200
            18  C8x C    25.6900  -20.7200
            19  C6a C    29.1900  -14.4200
            20  X   F    22.0500  -14.4200
            21  C8y C    26.8100  -21.4200
            22  O6a O    30.3800  -15.1200
            23  O6a O    29.1900  -13.0200
            24  X   F    26.8100  -22.8200
            25  C1x C    20.7200  -16.7300
            26  C1y C    19.8100  -17.8500
            27  C1y C    20.5800  -19.0400
            28  C1x C    22.0500  -18.6900
            29  C1y C    19.1800  -19.0400
            30  N1a N    17.9200  -19.6700
BOND        34
            1     1   2 1
            2     1   3 2
            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 2
            10    5  11 1
            11    6  12 2
            12    7  13 2
            13    8  14 2
            14    9  15 1
            15   10  16 1
            16   10  17 1
            17   11  18 2
            18   12  19 1
            19   14  20 1
            20   16  21 2
            21   19  22 1
            22   19  23 2
            23   21  24 1
            24    7  12 1
            25    9  14 1
            26   18  21 1
            27   15  25 1
            28   25  26 1
            29   26  27 1
            30   27  28 1
            31   15  28 1
            32   26  29 1
            33   29  27 1
            34   29  30 1 #Down

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