| Entry |
|
|---|
| Name |
Bisoxatin (INN) |
|---|
| Formula |
C20H15NO4
|
|---|
| Exact mass |
333.1001
|
|---|
| Mol weight |
333.34
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Remark |
|
|---|
| Efficacy |
Laxative |
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A06 DRUGS FOR CONSTIPATION
A06A DRUGS FOR CONSTIPATION
A06AB Contact laxatives
A06AB09 Bisoxatin
D07531 Bisoxatin (INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 25
1 C8x C 17.9200 -20.5800
2 C8x C 17.9200 -21.9800
3 C8x C 19.1100 -22.6800
4 C8x C 19.1100 -19.8800
5 C8y C 20.3700 -20.5800
6 C8y C 20.3700 -21.9800
7 N1x N 21.5600 -22.6800
8 C5x C 22.7500 -21.9800
9 C1z C 22.7500 -20.5800
10 O2x O 21.5600 -19.8800
11 C8y C 24.1500 -20.5800
12 O5x O 24.0100 -22.6800
13 C8y C 22.7500 -19.1800
14 C8x C 23.9400 -18.4800
15 C8x C 23.9400 -17.0800
16 C8y C 22.7500 -16.3800
17 C8x C 21.5600 -17.0800
18 C8x C 21.5600 -18.4800
19 C8x C 24.9200 -21.7700
20 C8x C 26.3200 -21.7700
21 C8y C 26.9500 -20.5800
22 C8x C 26.2500 -19.3200
23 C8x C 24.8500 -19.3200
24 O1a O 22.7500 -14.9800
25 O1a O 28.3499 -20.5659
BOND 28
1 6 7 1
2 7 8 1
3 8 9 1
4 9 10 1
5 10 5 1
6 1 2 2
7 9 11 1
8 2 3 1
9 3 6 2
10 5 4 2
11 4 1 1
12 5 6 1
13 8 12 2
14 9 13 1
15 13 14 2
16 14 15 1
17 15 16 2
18 16 17 1
19 17 18 2
20 13 18 1
21 11 19 2
22 19 20 1
23 20 21 2
24 21 22 1
25 22 23 2
26 11 23 1
27 16 24 1
28 21 25 1
|
|---|
