| Entry |
|
|---|
| Name |
Xanomeline tartrate (USAN) |
|---|
| Formula |
C14H23N3OS. C4H6O6
|
|---|
| Exact mass |
431.1726
|
|---|
| Mol weight |
431.51
|
|---|
| Structure |
|
|---|
| Class |
Neuropsychiatric agent
DG01490 Muscarinic cholinergic receptor agonist
|
|---|
| Remark |
|
|---|
| Efficacy |
Dementia therapeutic agent, Muscarinic acetylcholine receptor agonist |
|---|
| Comment |
Alzheimer's disease treatment
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07220 | Cholinergic and anticholinergic drugs |
|
|---|
| Brite |
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01490 Muscarinic cholinergic receptor agonist
DG01300 Xanomeline
D06331 Xanomeline tartrate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Acetylcholine (muscarinic)
CHRM1
D06331 Xanomeline tartrate (USAN)
CHRM4
D06331 Xanomeline tartrate (USAN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01490 Muscarinic cholinergic receptor agonist
DG01300 Xanomeline
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 29
1 O6a O 19.6232 -16.3806
2 C6a C 20.8357 -17.0806
3 C1c C 22.0482 -16.3806
4 C1c C 23.2606 -17.0806
5 C6a C 24.4732 -16.3806
6 O6a O 25.6856 -17.0806
7 O6a O 20.8357 -18.4805
8 O1a O 22.0482 -14.9805
9 O1a O 23.2606 -18.4806
10 O6a O 24.4732 -14.9808
11 N1y N 5.0400 -16.7300
12 C1x C 5.0400 -18.1300
13 C1x C 6.2300 -18.8300
14 C2x C 7.4200 -18.1300
15 C2y C 7.4200 -16.7300
16 C1x C 6.2300 -16.0300
17 C1a C 3.8500 -16.0300
18 C8y C 8.6800 -16.0300
19 C8y C 9.8000 -16.8000
20 N5x N 10.9200 -15.9600
21 S2x S 10.5000 -14.7000
22 N5x N 9.1000 -14.7000
23 O2a O 9.8000 -18.2000
24 C1b C 10.9900 -18.9000
25 C1b C 12.1800 -18.2700
26 C1b C 13.3700 -19.0400
27 C1b C 14.6300 -18.3400
28 C1b C 15.8900 -19.1100
29 C1a C 17.0800 -18.4800
BOND 29
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 2 7 2
7 3 8 1 #Down
8 4 9 1 #Down
9 5 10 2
10 11 12 1
11 12 13 1
12 13 14 1
13 14 15 2
14 15 16 1
15 11 16 1
16 11 17 1
17 15 18 1
18 18 19 1
19 19 20 2
20 20 21 1
21 21 22 1
22 18 22 2
23 19 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
|
|---|
