| Entry |
|
|---|
| Name |
Domiphen bromide (JAN/USAN/INN);
Oradol (TN) |
|---|
| Formula |
C22H40NO. Br
|
|---|
| Exact mass |
413.2293
|
|---|
| Mol weight |
414.4631
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Remark |
| Therapeutic category: | 2399 |
|
|---|
| Efficacy |
Anti-infective (dental) |
|---|
| Comment |
Cationic surfactant
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A01 STOMATOLOGICAL PREPARATIONS
A01A STOMATOLOGICAL PREPARATIONS
A01AB Antiinfectives and antiseptics for local oral treatment
A01AB06 Domiphen
D01588 Domiphen bromide (JAN/USAN/INN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
2 Agents affecting individual organs
23 Digestive organ agents
239 Miscellaneous
2399 Others
D01588 Domiphen bromide (JAN/USAN/INN)
Risk category of Japanese OTC drugs [BR:br08312]
Third-class OTC drugs
Inorganic and organic chemicals
Domiphen bromide
D01588 Domiphen bromide (JAN/USAN/INN)
Antimicrobials [BR:br08307]
Antibacterials
Bactericidal action
Quaternary ammonium compound
D01588 Domiphen bromide (JAN/USAN/INN) <JP>
|
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| Other DBs |
|
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| KCF data |
ATOM 25
1 C8x C 19.1100 -15.7500
2 C8x C 19.1100 -14.3500
3 C8x C 20.3700 -13.6500
4 C8y C 21.5600 -14.3500
5 C8x C 21.5600 -15.7500
6 C8x C 20.3700 -16.4500
7 O2a O 22.7500 -13.6500
8 C1b C 23.9400 -14.3500
9 C1b C 25.1300 -13.6500
10 N1d N 26.3200 -14.3500 #+
11 C1b C 27.7200 -13.6500
12 C1b C 28.9100 -14.3500
13 C1b C 30.1700 -13.6500
14 C1a C 31.3600 -14.3500
15 C1a C 26.3200 -15.7500
16 C1a C 26.3200 -12.8100
17 X Br 24.1500 -15.4700 #-
18 C1b C 27.7200 -13.6500
19 C1b C 28.9100 -14.3500
20 C1b C 27.7200 -13.6500
21 C1b C 28.9100 -14.3500
22 C1b C 27.7200 -13.6500
23 C1b C 28.9100 -14.3500
24 C1b C 27.7200 -13.6500
25 C1b C 28.9100 -14.3500
BOND 24
1 5 6 2
2 6 1 1
3 13 14 1
4 4 7 1
5 7 8 1
6 1 2 2
7 8 9 1
8 2 3 1
9 9 10 1
10 3 4 2
11 4 5 1
12 10 15 1
13 10 16 1
14 11 12 1
15 12 13 1
16 18 19 1
17 11 19 1
18 20 21 1
19 18 21 1
20 22 23 1
21 20 23 1
22 24 25 1
23 22 25 1
24 24 10 1
BRACKET 1 27.6500 -15.1200 27.6500 -13.1600
1 29.3300 -13.1600 29.3300 -15.1200
1 5
ORIGINAL 1 11 12
REPEAT 1 18 19 20 21 22 23 24 25
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