| Entry |
|
|---|
| Name |
Gallamine triethiodide (USP);
Flaxedil (TN) |
|---|
| Formula |
C30H60N3O3. 3I
|
|---|
| Exact mass |
891.1769
|
|---|
| Mol weight |
891.5291
|
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| Structure |
|
|---|
| Class |
Musculo-skeletal system agent
DG02029 Muscle relaxant
DG01696 Peripherally-acting muscle relaxant
DG03117 Nondepolarizing neuromuscular blocking agent
DG01742 Quaternary ammonium compound type muscle relaxant
|
|---|
| Remark |
|
|---|
| Efficacy |
Neuromuscular blocking agent |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07221 | Nicotinic cholinergic receptor antagonists |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
M MUSCULO-SKELETAL SYSTEM
M03 MUSCLE RELAXANTS
M03A MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
M03AC Other quaternary ammonium compounds
M03AC02 Gallamine
D02292 Gallamine triethiodide (USP)
Drug groups [BR:br08330]
Musculo-skeletal system agent
DG02029 Muscle relaxant
DG01696 Peripherally-acting muscle relaxant
DG03117 Nondepolarizing neuromuscular blocking agent
D02292 Gallamine triethiodide
DG01742 Quaternary ammonium compound type muscle relaxant
D02292 Gallamine triethiodide
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Acetylcholine (muscarinic)
CHRM2
D02292 Gallamine triethiodide (USP)
Enzymes
Hydrolases (EC3)
Carboxylic-ester hydrolases
ACHE
D02292 Gallamine triethiodide (USP)
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 39
1 X I 27.5305 -15.6275 #-
2 C8x C 16.9947 -18.1922
3 C8x C 16.9947 -19.5785
4 C8y C 18.1952 -20.2716
5 C8y C 19.3958 -19.5785
6 C8y C 19.3958 -18.1922
7 C8x C 18.1952 -17.4990
8 O2a O 20.6149 -17.0029
9 O2a O 20.6149 -20.7677
10 C1b C 21.8083 -17.6918
11 C1b C 22.9790 -17.0157
12 N1d N 24.1613 -17.6983 #+
13 C1b C 21.8083 -20.0788
14 C1b C 22.9790 -20.7550
15 N1d N 24.1613 -20.0724 #+
16 C1b C 24.1613 -16.3120
17 C1a C 22.9444 -15.6091
18 C1b C 25.3619 -17.0051
19 C1a C 25.3619 -15.6188
20 C1b C 25.3619 -18.3914
21 C1a C 26.5624 -17.6983
22 C1b C 24.1613 -21.4587
23 C1a C 22.9444 -22.1617
24 C1b C 25.3619 -19.3793
25 C1a C 26.5624 -20.0724
26 C1b C 25.3619 -20.7656
27 C1a C 25.3619 -22.1519
28 O2a O 18.1952 -21.6577
29 C1b C 19.3791 -22.3414
30 C1b C 19.3793 -23.7371
31 N1d N 20.5589 -24.4183 #+
32 C1b C 21.7322 -23.7409
33 C1b C 20.5591 -25.8165
34 C1a C 19.3366 -26.5228
35 C1b C 21.7595 -25.1114
36 C1a C 21.7595 -26.4977
37 C1a C 22.9131 -24.4228
38 X I 27.5999 -22.2125 #-
39 X I 20.8763 -27.6883 #-
BOND 36
1 2 3 2
2 3 4 1
3 4 5 2
4 5 6 1
5 6 7 2
6 2 7 1
7 6 8 1
8 5 9 1
9 8 10 1
10 10 11 1
11 11 12 1
12 9 13 1
13 13 14 1
14 14 15 1
15 12 16 1
16 16 17 1
17 12 18 1
18 18 19 1
19 12 20 1
20 20 21 1
21 15 22 1
22 22 23 1
23 15 24 1
24 24 25 1
25 15 26 1
26 26 27 1
27 4 28 1
28 28 29 1
29 29 30 1
30 30 31 1
31 31 32 1
32 31 33 1
33 33 34 1
34 31 35 1
35 35 36 1
36 32 37 1
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