KEGG   DRUG: Gallamine triethiodideHelp
Entry
D02292                      Drug                                   

Name
Gallamine triethiodide (USP);
Flaxedil (TN)
Formula
C30H60N3O3. 3I
Exact mass
891.1769
Mol weight
891.5291
Structure
Mol fileKCF fileDB search
Class
Other
 DG02029  Muscle relaxant
  DG01696  Peripherally-acting muscle relaxant
   DG01742  Quaternary ammonium compound type muscle relaxant
 DG01696  Peripherally-acting muscle relaxant
  DG01742  Quaternary ammonium compound type muscle relaxant
Remark
ATC code: M03AC02
Efficacy
Neuromuscular blocking agent
Target
CHRM2 [HSA:1129] [KO:K04130]
ACHE [HSA:43] [KO:K01049]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse
Interaction
Drug 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)
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)
BRITE hierarchy
Other DBs
CAS: 65-29-2
PubChem: 7849351
ChEMBL: CHEMBL1200993
DrugBank: DB00483
LigandBox: D02292
NIKKAJI: J231.272G
LinkDB All DBs
KCF data Show

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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