KEGG   DRUG: Benzododecinium chloride
Entry
D07210                      Drug                                   
Name
Benzododecinium chloride (INN)
Formula
C21H38N. Cl
Exact mass
339.2693
Mol weight
339.9861
Structure
Simcomp
Remark
ATC code: D09AA05
Efficacy
Antiseptic, Desinfectant
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D09 MEDICATED DRESSINGS
   D09A MEDICATED DRESSINGS
    D09AA Medicated dressings with antiinfectives
     D09AA05 Benzododecinium
      D07210  Benzododecinium chloride (INN)
Other DBs
CAS: 139-07-1
PubChem: 51091548
ChEBI: 167208
LigandBox: D07210
NIKKAJI: J410.858B
KCF data

ATOM        23
            1   C8x C    17.2691  -19.0806
            2   C8x C    17.2691  -20.4641
            3   C8x C    18.4672  -21.1558
            4   C8x C    19.6654  -20.4641
            5   C8y C    19.6654  -19.0806
            6   C8x C    18.4672  -18.3889
            7   C1b C    20.8883  -18.3889
            8   N1d N    22.0865  -19.0806 #+
            9   C1b C    23.2846  -18.3889
            10  C1b C    24.4826  -19.0806
            11  C1b C    25.6808  -18.3889
            12  C1b C    26.8790  -19.0806
            13  C1b C    28.0771  -18.3889
            14  C1b C    29.2753  -19.0806
            15  C1b C    30.4734  -18.3889
            16  C1b C    31.6716  -19.0806
            17  C1b C    32.8697  -18.3889
            18  C1b C    34.0678  -19.0806
            19  C1b C    35.2660  -18.3889
            20  C1a C    36.4640  -19.0806
            21  C1a C    22.0858  -20.5096
            22  C1a C    22.0872  -17.7104
            23  X   Cl   24.8500  -16.1000 #-
BOND        22
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     5   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   17  18 1
            19   18  19 1
            20   19  20 1
            21    8  21 1
            22    8  22 1

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