| Entry |
|
|---|
| Name |
Telotristat ethyl (USAN);
Xermelo (TN)
|
|---|
| Product |
|
|---|
| Formula |
C27H26ClF3N6O3
|
|---|
| Exact mass |
574.1707
|
|---|
| Mol weight |
574.982
|
|---|
| Structure |
   |
|---|
| Simcomp |
 |
|---|
| Remark |
| Product (DG02809): | D09974<US> |
|
|---|
| Efficacy |
Antidiarrheal, Tryptophan hydroxylase inhibitor |
|---|
| Comment |
Treatment of carcinoid syndrome diarrhea
|
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Enzymes
Oxidoreductases (EC1)
Other monooxygenases
TPH
D09974 Telotristat ethyl (USAN) <US>
New drug approvals in the USA [br08319.html]
New Molecular Entity and New Therapeutic Biological Product Approvals
D09974
New drug approvals in Europe [br08329.html]
European public assessment reports (EPAR) authorised medicine
D09974
New drug approvals in the USA, Europe and Japan [br08328.html]
Approval dates by FDA, EMA and PMDA
D09974
 |
|---|
| Other DBs |
|
|---|
| LinkDB |
 |
|---|
| KCF data |
ATOM 40
1 C8y C 22.2600 -25.9000
2 C8x C 22.2600 -27.3000
3 C8x C 23.4500 -28.0000
4 C8y C 24.7100 -27.3000
5 C8y C 24.7100 -25.9000
6 C8x C 23.4500 -25.2000
7 C1c C 25.9000 -28.0000
8 O2a O 27.0900 -27.3000
9 C8y C 28.2800 -28.0000
10 C1d C 25.9000 -29.4700
11 X F 24.7100 -30.1700
12 X F 27.0900 -30.1700
13 X F 25.9000 -30.8700
14 N5x N 28.2800 -29.4700
15 C8y C 29.5400 -30.1700
16 N5x N 30.8000 -29.4700
17 C8y C 30.8000 -28.0000
18 C8x C 29.5400 -27.3000
19 C8y C 31.9900 -27.3000
20 C8x C 33.1800 -28.0000
21 C8x C 34.4400 -27.3000
22 C8y C 34.4400 -25.9000
23 C8x C 33.2500 -25.2000
24 C8x C 31.9900 -25.9000
25 C1b C 35.6300 -25.2000
26 C1c C 36.8200 -25.9000
27 C7a C 38.0100 -25.2000
28 O7a O 39.2000 -25.9000
29 O6a O 38.0100 -23.8000
30 N1a N 36.8200 -27.3000
31 N4y N 25.9000 -25.2000
32 C8x C 25.9000 -23.8000
33 N5x N 27.2300 -25.6200
34 C8y C 28.0700 -24.5000
35 C8x C 27.2300 -23.3800
36 C1a C 29.4700 -24.5000
37 X Cl 21.0700 -25.2000
38 N1a N 29.5400 -31.5700
39 C1b C 40.4181 -25.2099
40 C1a C 41.5995 -25.9050
BOND 43
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 1
9 8 9 1
10 7 10 1 #Up
11 10 11 1
12 10 12 1
13 10 13 1
14 9 14 2
15 14 15 1
16 15 16 2
17 16 17 1
18 17 18 2
19 9 18 1
20 17 19 1
21 19 20 1
22 20 21 2
23 21 22 1
24 22 23 2
25 23 24 1
26 19 24 2
27 22 25 1
28 25 26 1
29 26 27 1
30 27 28 1
31 27 29 2
32 26 30 1 #Up
33 5 31 1
34 32 31 1
35 31 33 1
36 33 34 2
37 34 35 1
38 32 35 2
39 34 36 1
40 1 37 1
41 15 38 1
42 28 39 1
43 39 40 1
|
|---|
