KEGG   DRUG: Vecuronium bromide
Entry
D00767                      Drug                                   
Name
Vecuronium bromide (JAN/USP/INN);
Norcuron (TN)
Product
  Generic
Formula
C34H57N2O4. Br
Exact mass
636.3502
Mol weight
637.73
Structure
Simcomp
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
ATC code: M03AC03
Chemical structure group: DG00770
Product (DG00770): D00767<US>
Efficacy
Skeletal muscle relaxant, Neuromuscular blocking agent, Muscarinic acetylcholine receptor antagonist
Comment
Quaternary ammonium compound
Target
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Structure map
map07221  Nicotinic cholinergic receptor antagonists
Other map
map04976  Bile secretion
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
     M03AC03 Vecuronium
      D00767  Vecuronium bromide (JAN/USP/INN) <US>
Drug groups [BR:br08330]
 Musculo-skeletal system agent
  DG02029  Muscle relaxant
   DG01696  Peripherally-acting muscle relaxant
    DG03117  Nondepolarizing neuromuscular blocking agent
     DG00770  Vecuronium
      D00767  Vecuronium bromide
  DG01742  Quaternary ammonium compound type muscle relaxant
   DG00770  Vecuronium
    D00767  Vecuronium bromide
Target-based classification of drugs [BR:br08310]
 Ion channels
  Ligand-gated ion channels
   Acetylcholine (nicotinic)
    CHRN (neuronal type)
     D00767  Vecuronium bromide (JAN/USP/INN) <US>
Drug groups [BR:br08330]
 Musculo-skeletal system agent
  DG02029  Muscle relaxant
   DG01696  Peripherally-acting muscle relaxant
    DG03117  Nondepolarizing neuromuscular blocking agent
     DG00770  Vecuronium
  DG01742  Quaternary ammonium compound type muscle relaxant
   DG00770  Vecuronium
Other DBs
CAS: 50700-72-6
PubChem: 7847832
ChEBI: 9940
LigandBox: D00767
NIKKAJI: J356.147J
LinkDB
KCF data

ATOM        41
            1   C1z C    20.4325  -15.3326
            2   C1y C    20.4151  -16.7073
            3   C1y C    21.6333  -14.6597
            4   C1x C    19.2549  -14.6365
            5   C1a C    20.4211  -13.9577
            6   C1y C    19.2319  -17.3802
            7   C1x C    22.7993  -16.7362
            8   C1y C    22.8109  -15.3615
            9   O7a O    21.6217  -12.9366
            10  C1x C    18.0658  -15.3151
            11  C1y C    18.0543  -16.6841
            12  C1x C    19.2319  -18.7492
            13  N2y N    24.0060  -14.6886 #+
            14  C7a C    20.4325  -12.2520
            15  C1z C    16.8596  -17.3629
            16  C1x C    18.0427  -19.4337
            17  C1x C    25.1951  -15.3731
            18  C1x C    24.0060  -13.3196
            19  C1a C    24.0001  -16.0633
            20  C1a C    19.2433  -12.9366
            21  O6a O    20.4211  -10.8773
            22  C1y C    16.8536  -18.7376
            23  C1x C    15.6701  -16.6783
            24  C1a C    16.8476  -15.9939
            25  C1x C    26.3843  -14.6886
            26  C1x C    25.2009  -12.6350
            27  C1x C    15.6701  -19.4278
            28  C1y C    14.4809  -17.3629
            29  C1x C    26.3843  -13.3196
            30  C1y C    14.4809  -18.7376
            31  N1y N    13.2975  -16.6841
            32  O7a O    13.2860  -19.4164
            33  C1x C    13.2975  -15.3093
            34  C1x C    12.1025  -17.3686
            35  C7a C    13.2860  -20.7852
            36  C1x C    12.1025  -14.6248
            37  C1x C    10.9134  -16.6841
            38  C1a C    12.0967  -21.4640
            39  O6a O    14.4751  -21.4640
            40  C1x C    10.9134  -15.3093
            41  X   Br   23.9581  -17.9438 #-
BOND        45
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1 #Up
            9     4  10 1
            10    6  11 1
            11    6  12 1
            12    8  13 1 #Up
            13    9  14 1
            14   11  15 1
            15   12  16 1
            16   13  17 1
            17   13  18 1
            18   13  19 1
            19   14  20 1
            20   14  21 2
            21   15  22 1
            22   15  23 1
            23   15  24 1 #Up
            24   17  25 1
            25   18  26 1
            26   22  27 1
            27   23  28 1
            28   25  29 1
            29   27  30 1
            30   28  31 1 #Up
            31   30  32 1 #Down
            32   31  33 1
            33   31  34 1
            34   32  35 1
            35   33  36 1
            36   34  37 1
            37   35  38 1
            38   35  39 2
            39   36  40 1
            40    7   8 1
            41   10  11 1
            42   16  22 1
            43   26  29 1
            44   28  30 1
            45   37  40 1

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