| Entry |
|
|---|
| Name |
Octotiamine (JAN/INN);
Neuvita (TN);
Puroffit (TN) |
|---|
| Formula |
C23H36N4O5S3
|
|---|
| Exact mass |
544.1848
|
|---|
| Mol weight |
544.7507
|
|---|
| Structure |
|
|---|
| Remark |
| Therapeutic category: | 3122 |
| Product (mixture): | D04917<JP> |
|
|---|
| Efficacy |
Supplement (vitamin B1) |
|---|
| Comment |
Vitamin B1 derivative
|
|---|
| Brite |
Therapeutic category of drugs in Japan [BR:br08301]
3 Agents affecting metabolism
31 Vitamins
312 Vitamin B1 preparations
3122 Vitamin B1 derivatives
D01184 Octotiamine (JAN/INN)
Classification of Japanese OTC drugs [BR:br08313]
Nourishing tonics and health supplements
35 Vitamin B1 based drugs
D01184 Octotiamine (JAN/INN)
42 Vitamin B1B6B12 based drugs
D01184 Octotiamine (JAN/INN)
Risk category of Japanese OTC drugs [BR:br08312]
Third-class OTC drugs
Inorganic and organic chemicals
Octotiamine
D01184 Octotiamine (JAN/INN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 35
1 C1b C 15.1200 -14.9800
2 N1c N 16.3100 -15.6800
3 C8y C 13.9300 -15.6800
4 C4a C 17.5000 -14.9800
5 C2c C 16.3100 -17.0800
6 C2c C 17.5000 -17.7800
7 C1a C 15.1200 -17.7800
8 S3a S 18.6900 -17.0800
9 C1b C 17.5000 -19.1800
10 S3a S 19.8800 -17.7800
11 C1b C 18.6900 -19.8800
12 O1a O 19.8800 -19.1800
13 O4a O 18.6900 -15.6800
14 C8y C 12.7400 -14.9800
15 N5x N 11.4800 -15.6800
16 C8y C 11.4800 -17.0800
17 N5x N 12.6700 -17.7800
18 C8x C 13.9300 -17.0800
19 C1a C 10.2900 -17.7800
20 N1a N 12.7400 -13.5800
21 C1b C 21.0700 -17.0800
22 C1b C 22.2600 -17.7800
23 C1c C 23.4500 -17.0800
24 C1b C 24.6400 -17.7800
25 C1b C 25.8300 -17.0800
26 C1b C 27.0200 -17.7800
27 C1b C 28.2100 -17.0800
28 C7a C 29.4000 -17.7800
29 O7a O 30.5900 -17.0800
30 C1a C 31.7800 -17.7800
31 S2a S 23.4500 -15.6800
32 C5a C 24.6400 -14.9800
33 C1a C 25.8300 -15.6800
34 O5a O 24.6400 -13.5800
35 O6a O 29.4000 -19.1800
BOND 35
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 1
5 5 6 2
6 5 7 1
7 6 8 1
8 6 9 1
9 8 10 1
10 9 11 1
11 11 12 1
12 4 13 2
13 3 14 2
14 14 15 1
15 15 16 2
16 16 17 1
17 17 18 2
18 3 18 1
19 16 19 1
20 14 20 1
21 10 21 1
22 21 22 1
23 22 23 1
24 23 24 1
25 24 25 1
26 25 26 1
27 26 27 1
28 27 28 1
29 28 29 1
30 29 30 1
31 23 31 1
32 31 32 1
33 32 33 1
34 32 34 2
35 28 35 2
|
|---|
