| Entry |
|
|---|
| Name |
Methylnaltrexone bromide (JAN/USAN);
Relistor (TN)
|
|---|
| Product |
|
|---|
| Formula |
C21H26NO4. Br
|
|---|
| Exact mass |
435.1045
|
|---|
| Mol weight |
436.3394
|
|---|
| Structure |
   |
|---|
| Simcomp |
 |
|---|
| Class |
Gastrointestinal agent
DG01770 Laxative
DG01768 Opioid-induced laxative
Analgesic
DG01586 Opioid receptor antagonist
|
|---|
| Remark |
| Product (mixture): | D10751<US> |
|
|---|
| Efficacy |
Laxative, Opioid receptor antagonist |
|---|
| Comment |
Treatment of peripheral side effects of opioid therapy
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07224 | Opioid receptor agonists/antagonists |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A06 DRUGS FOR CONSTIPATION
A06A DRUGS FOR CONSTIPATION
A06AH Peripheral opioid receptor antagonist
A06AH01 Methylnaltrexone bromide
D06618 Methylnaltrexone bromide (JAN/USAN) <US>
USP drug classification [BR:br08302]
Gastrointestinal Agents
Anti-Constipation Agents
Methylnaltrexone
D06618 Methylnaltrexone bromide (JAN/USAN)
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRM1
D06618 Methylnaltrexone bromide (JAN/USAN) <US>
New drug approvals in the USA [br08319.html]
New molecular entities and new therapeutic biological products
D06618
New drug approvals in Europe [br08329.html]
European public assessment reports (EPAR) authorised medicine
D06618
New drug approvals in the USA, Europe and Japan [br08328.html]
Approval dates by FDA, EMA and PMDA
D06618
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| Other DBs |
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| LinkDB |
 |
|---|
| KCF data |
ATOM 27
1 C1z C 20.5488 -23.1468
2 C8y C 20.5488 -21.8205
3 C1z C 21.7355 -23.8449
4 C1y C 19.4318 -23.7751
5 C1x C 21.7355 -22.5185
6 C8y C 19.4318 -21.2620
7 C8y C 21.7355 -21.2620
8 C1y C 22.8524 -23.1468
9 C1x C 21.7355 -25.1014
10 O2x O 18.1055 -22.4487
11 C5x C 19.4318 -25.1014
12 C1x C 23.9694 -22.5185
13 C8y C 19.4318 -19.9356
14 C1x C 22.8524 -21.8903
15 C8x C 21.7355 -19.9356
16 N2y N 23.9694 -23.8449 #+
17 C1x C 20.5488 -25.7995
18 O5x O 18.3149 -25.7995
19 C8x C 20.6186 -19.3074
20 O1a O 18.3149 -19.3074
21 O1a O 22.9921 -24.8222
22 C1b C 25.3655 -23.8449
23 C1y C 26.0636 -25.1014
24 C1x C 26.0611 -26.4783
25 C1x C 27.2658 -25.7726
26 C1a C 23.9694 -25.2411
27 X Br 25.9240 -21.6808 #-
BOND 31
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 2
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1 #Down
10 4 11 1
11 5 12 1
12 6 13 1
13 7 14 1
14 7 15 2
15 8 16 1 #Up
16 9 17 1
17 11 18 2
18 13 19 2
19 13 20 1
20 6 10 1
21 8 14 1
22 11 17 1
23 12 16 1
24 15 19 1
25 3 21 1 #Up
26 16 22 1
27 22 23 1
28 24 25 1
29 25 23 1
30 23 24 1
31 16 26 1
|
|---|
