KEGG   DRUG: Acorafloxacin hydrochloride
Entry
D10544                      Drug                                   
Name
Acorafloxacin hydrochloride (USAN);
Avarofloxacin hydrochloride
Formula
C21H23F2N3O4. HCl
Exact mass
455.1423
Mol weight
455.8828
Structure
Simcomp
Class
Antibacterial
 DG01550  Quinolone
  DG01549  Fluoroquinolone
Remark
Chemical structure group: DG01626
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
    DG01626  Acorafloxacin
     D10544  Acorafloxacin hydrochloride
Antimicrobials [BR:br08307]
 Antibacterials
  Nucleic acid synthesis inhibitor
   Fluoroquinolone
    D10544  Acorafloxacin hydrochloride (USAN)
Drug groups [BR:br08330]
 Antibacterial
  DG01550  Quinolone
   DG01549  Fluoroquinolone
    DG01626  Acorafloxacin
Other DBs
CAS: 1001162-01-1
PubChem: 254741506
KCF data

ATOM        31
            1   C8y C    10.7800  -14.6300
            2   O2a O    12.0400  -16.7300
            3   C1y C    14.4900  -16.7300
            4   C8y C    12.0400  -15.3300
            5   C8y C    10.7800  -13.2300
            6   C8x C    12.0400  -12.5300
            7   N4y N    14.4900  -15.3300
            8   C8y C    13.2300  -14.6300
            9   C8y C    13.2300  -13.3000
            10  C8y C    14.4900  -12.6000
            11  C8y C    15.6800  -13.2300
            12  C8x C    15.6800  -14.6300
            13  C6a C    16.8700  -12.5300
            14  O6a O    16.8700  -11.1300
            15  O6a O    18.1300  -13.2300
            16  O5x O    14.4900  -11.2000
            17  X   F     9.5900  -12.5300
            18  C1x C    13.7900  -17.9200
            19  C1x C    15.1900  -17.9200
            20  N1y N     9.5900  -15.3300
            21  C1x C     9.5900  -16.7300
            22  C1x C     8.4000  -17.4300
            23  C1x C     7.1400  -16.7300
            24  C2y C     7.1400  -15.3300
            25  C1x C     8.4000  -14.6300
            26  C1a C    10.7800  -17.4300
            27  C2c C     5.9500  -14.6300
            28  X   F     4.6900  -15.2600
            29  C1b C     5.9500  -13.2300
            30  N1a N     4.7600  -12.5300
            31  X   Cl   17.9900  -17.6400
BOND        33
            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    2  26 1
            30   24  27 2
            31   27  28 1
            32   27  29 1
            33   29  30 1

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