| Entry |
|
|---|
| Name |
Cetocycline hydrochloride (USAN) |
|---|
| Formula |
C22H21NO7. HCl
|
|---|
| Exact mass |
447.1085
|
|---|
| Mol weight |
447.86
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Antibacterial
DG01197 Tetracycline antibiotic
|
|---|
| Efficacy |
Antibacterial |
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antibacterial
DG01197 Tetracycline antibiotic
D03451 Cetocycline hydrochloride
Antimicrobials [BR:br08307]
Antibacterials
Protein biosynthesis inhibitor
Tetracycline
D03451 Cetocycline hydrochloride (USAN)
|
|---|
| Other DBs |
| CAS: | 53274-41-2 56433-46-6 |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 31
1 C8y C 26.3900 -19.3200
2 C8x C 26.3900 -17.9200
3 C8x C 27.5800 -17.2200
4 C8y C 28.8400 -17.9200
5 C8y C 28.8400 -19.3200
6 C8y C 27.5800 -20.0200
7 C8y C 30.0300 -17.2200
8 C8y C 31.2200 -17.9200
9 C8y C 31.2200 -19.3200
10 C8y C 30.0300 -20.0200
11 C1x C 32.4100 -17.2200
12 C1y C 33.6700 -17.9200
13 C1z C 33.6700 -19.3200
14 C5x C 32.4100 -20.0200
15 C1y C 34.8600 -17.2200
16 C2y C 36.0500 -17.9200
17 C2y C 36.0500 -19.3200
18 C5x C 34.8600 -20.0200
19 C1a C 25.2000 -20.0200
20 O1a O 27.5800 -21.4200
21 C1a C 30.0300 -15.8200
22 O1a O 30.0300 -21.4200
23 O5x O 32.4100 -21.4200
24 O5x O 34.8600 -21.4200
25 C5a C 37.3100 -20.0200
26 C1a C 38.5000 -19.3200
27 O5a O 37.3100 -21.4200
28 O1a O 37.3100 -17.2200
29 N1a N 34.8600 -15.8200
30 O1a O 33.6700 -20.7200
31 X Cl 42.9100 -19.3900
BOND 33
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 5 10 1
12 8 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 9 14 1
17 12 15 1
18 15 16 1
19 16 17 2
20 17 18 1
21 13 18 1
22 1 19 1
23 6 20 1
24 7 21 1
25 10 22 1
26 14 23 2
27 18 24 2
28 17 25 1
29 25 26 1
30 25 27 2
31 16 28 1
32 15 29 1 #Up
33 13 30 1 #Down
|
|---|
