Entry |
|
Name |
Alatrofloxacin (INN) |
Formula |
C26H25F3N6O5
|
Exact mass |
558.1839
|
Mol weight |
558.51
|
Structure |

|
Simcomp |
|
Class |
|
Remark |
|
Efficacy |
Antibacterial, Nucleic acid biosynthesis inhibitor |
Comment |
Fluoroquinolones
Parenteral Active form of prodrug: Trovafloxacin [DR: D08654]
|
Target |
|
Interaction |
|
Brite |
Drug groups [BR:br08330]
Antibacterial
DG01550 Quinolone
DG01549 Fluoroquinolone
DG01214 Alatrofloxacin
D07562 Alatrofloxacin
Antimicrobials [BR:br08307]
Antibacterials
Nucleic acid synthesis inhibitor
Fluoroquinolone
D07562 Alatrofloxacin (INN)
Prodrugs [br08324.html]
D07562
Drug groups [BR:br08330]
Antibacterial
DG01550 Quinolone
DG01549 Fluoroquinolone
DG01214 Alatrofloxacin
Prodrugs [br08324.html]
DG01214
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 40
1 N4y N 30.4500 -17.2200
2 C8x C 31.6400 -16.5900
3 C8y C 31.6400 -15.1900
4 C8y C 30.4500 -14.4200
5 C8y C 29.2600 -16.5900
6 C8y C 29.2600 -15.1900
7 C8x C 28.0000 -14.4200
8 C8y C 26.8100 -15.1900
9 C8y C 26.8100 -16.5900
10 N5x N 28.0000 -17.2200
11 N1y N 25.6200 -17.2200
12 X F 25.6200 -14.4200
13 C6a C 32.9000 -14.4200
14 O6a O 34.0900 -15.1900
15 O6a O 32.9000 -13.0200
16 O5x O 30.4500 -13.0200
17 C8y C 30.4500 -18.6200
18 C1x C 24.2900 -16.6600
19 C1x C 25.4100 -18.6200
20 C1y C 24.0800 -18.9700
21 C1y C 23.3800 -17.7100
22 C1y C 22.6800 -18.9700
23 N1b N 21.4200 -19.6700
24 C5a C 20.2300 -18.9700
25 C1c C 19.0400 -19.6700
26 N1b N 17.8500 -18.9700
27 C5a C 16.5900 -19.6700
28 C1c C 15.4000 -18.9700
29 N1a N 14.2100 -19.6700
30 C8x C 29.2600 -19.3900
31 C8x C 29.2600 -20.7900
32 C8y C 30.4500 -21.4200
33 C8x C 31.6400 -20.7200
34 C8y C 31.6400 -19.3200
35 X F 32.9000 -18.6200
36 X F 30.4500 -22.8200
37 O5a O 16.5900 -21.0700
38 O5a O 20.2300 -17.5700
39 C1a C 15.4000 -17.5700
40 C1a C 19.0400 -21.0700
BOND 44
1 20 22 1
2 22 21 1
3 10 5 1
4 22 23 1 #Down
5 4 6 1
6 9 11 1
7 23 24 1
8 8 12 1
9 24 25 1
10 25 26 1
11 3 13 1
12 26 27 1
13 5 1 1
14 27 28 1
15 13 14 1
16 28 29 1
17 1 2 1
18 13 15 2
19 2 3 2
20 4 16 2
21 3 4 1
22 17 30 2
23 30 31 1
24 31 32 2
25 32 33 1
26 33 34 2
27 34 17 1
28 1 17 1
29 34 35 1
30 5 6 2
31 32 36 1
32 6 7 1
33 27 37 2
34 11 18 1
35 24 38 2
36 18 21 1
37 28 39 1 #Up
38 20 19 1
39 25 40 1 #Down
40 19 11 1
41 7 8 2
42 8 9 1
43 9 10 2
44 20 21 1
|