| Entry |
|
|---|
| Name |
Piroctone olamine (USAN);
Octopirox (TN) |
|---|
| Formula |
C14H23NO2. C2H7NO
|
|---|
| Exact mass |
298.2256
|
|---|
| Mol weight |
298.42
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Remark |
|
|---|
| Efficacy |
Antiseborrheic |
|---|
| Brite |
Risk category of Japanese OTC drugs [BR:br08312]
Second-class OTC drugs
Inorganic and organic chemicals
Piroctone olamine
D05505 Piroctone olamine (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 21
1 C8y C 3.7316 -6.6824
2 C8x C 3.7316 -8.0852
3 C8y C 4.9465 -8.7867
4 C8x C 6.1614 -8.0852
5 C8y C 6.1614 -6.6824
6 N4y N 4.9465 -5.9810
7 O1b O 4.9465 -4.5783
8 O5x O 2.5167 -5.9810
9 C1b C 7.3950 -5.9700
10 C1c C 8.6027 -6.6671
11 C1b C 9.7874 -5.9829
12 C1d C 10.9838 -6.6736
13 C1a C 8.6031 -8.0848
14 C1a C 12.1816 -7.3653
15 C1a C 11.6742 -5.4773
16 C1a C 10.2719 -7.9070
17 C1a C 4.9465 -10.1893
18 C1b C 18.1770 -7.4902
19 C1b C 16.9615 -6.7888
20 N1a N 19.3867 -6.7888
21 O1a O 15.7518 -7.4902
BOND 20
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 6 7 1
8 1 8 2
9 5 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 10 13 1
14 12 14 1
15 12 15 1
16 12 16 1
17 3 17 1
18 18 19 1
19 18 20 1
20 19 21 1
|
|---|
