KEGG   DRUG: Tedisamil sesquifumarate
Entry
D06653                      Drug                                   

Name
Tedisamil sesquifumarate (USAN)
Formula
(C19H32N2)2. (C4H4O4)3
Exact mass
924.546
Mol weight
925.158
Structure
Class
Cardiovascular agent
 DG01653  Antiarrhythmics
  DG01648  Class III antiarrhythmic agent
Remark
ATC code: C01BD06
Chemical structure group: DG00206
Efficacy
Antiarrhythmic, Potassium channel blocker
Target
KCNA1 [HSA:3736] [KO:K04874]
Interaction
Structure map
map07232  Potassium channel blocking and opening drugs
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01B ANTIARRHYTHMICS, CLASS I AND III
    C01BD Antiarrhythmics, class III
     C01BD06 Tedisamil
      D06653  Tedisamil sesquifumarate (USAN)
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated ion channels
   Potassium channels
    KCNA1
     D06653  Tedisamil sesquifumarate (USAN)
Other DBs
CAS: 150501-62-5
PubChem: 47208304
ChEMBL: CHEMBL2107378
LigandBox: D06653
LinkDB
KCF data

ATOM        66
            1   C1b C    25.2000  -25.6900
            2   C1y C    23.9400  -24.9900
            3   C1x C    22.7495  -24.2533
            4   C1x C    22.6817  -25.6931
            5   C1x C    28.0700  -26.2500
            6   C1x C    28.2100  -25.3400
            7   C1y C    29.1900  -25.9700
            8   C1y C    29.4700  -24.8500
            9   C1z C    28.2800  -23.5900
            10  C1x C    30.9400  -25.9700
            11  C1x C    30.6600  -24.8500
            12  N1y N    31.9200  -26.4600
            13  C1b C    32.9700  -27.3700
            14  C1y C    34.0900  -27.3700
            15  N1y N    27.0900  -24.8500
            16  C1x C    35.3362  -26.7320
            17  C1x C    35.2873  -28.1725
            18  C1x C    29.4275  -22.7880
            19  C1x C    29.0194  -21.4488
            20  C1x C    27.6196  -21.4231
            21  C1x C    27.1626  -22.7465
            22  O6a O    39.2700  -25.8300
            23  C6a C    40.4824  -25.1300
            24  C2b C    41.6949  -25.8300
            25  C2b C    42.9073  -25.1300
            26  C6a C    44.1197  -25.8300
            27  O6a O    45.3322  -25.1300
            28  O6a O    40.4824  -23.7302
            29  O6a O    44.1197  -27.2299
            30  C1b C    25.2000  -25.6900
            31  C1y C    23.9400  -24.9900
            32  C1x C    22.7495  -24.2533
            33  C1x C    22.6817  -25.6931
            34  N1y N    27.0900  -24.8500
            35  C1x C    28.2100  -25.3400
            36  C1y C    29.4700  -24.8500
            37  C1x C    30.6600  -24.8500
            38  N1y N    31.9200  -26.4600
            39  C1x C    30.9400  -25.9700
            40  C1y C    29.1900  -25.9700
            41  C1x C    28.0700  -26.2500
            42  C1z C    28.2800  -23.5900
            43  C1x C    29.4275  -22.7880
            44  C1x C    29.0194  -21.4488
            45  C1x C    27.6196  -21.4231
            46  C1x C    27.1626  -22.7465
            47  C1b C    32.9700  -27.3700
            48  C1y C    34.0900  -27.3700
            49  C1x C    35.3362  -26.7320
            50  C1x C    35.2873  -28.1725
            51  O6a O    39.2700  -25.8300
            52  C6a C    40.4824  -25.1300
            53  C2b C    41.6949  -25.8300
            54  C2b C    42.9073  -25.1300
            55  C6a C    44.1197  -25.8300
            56  O6a O    45.3322  -25.1300
            57  O6a O    44.1197  -27.2299
            58  O6a O    40.4824  -23.7302
            59  O6a O    39.2700  -25.8300
            60  C6a C    40.4824  -25.1300
            61  C2b C    41.6949  -25.8300
            62  C2b C    42.9073  -25.1300
            63  C6a C    44.1197  -25.8300
            64  O6a O    45.3322  -25.1300
            65  O6a O    44.1197  -27.2299
            66  O6a O    40.4824  -23.7302
BOND        71
            1     1   2 1
            2     3   2 1
            3     2   4 1
            4     4   3 1
            5     5   7 1
            6     6   8 1
            7     7   9 1
            8     7  10 1
            9     8  11 1
            10   10  12 1
            11   12  13 1
            12   13  14 1
            13    8   9 1
            14   11  12 1
            15    6  15 1
            16    5  15 1
            17   14  16 1
            18   16  17 1
            19   17  14 1
            20    1  15 1
            21    9  18 1
            22   18  19 1
            23   19  20 1
            24   20  21 1
            25    9  21 1
            26   30  31 1
            27   32  31 1
            28   31  33 1
            29   33  32 1
            30   41  40 1
            31   35  36 1
            32   40  42 1
            33   40  39 1
            34   36  37 1
            35   39  38 1
            36   38  47 1
            37   47  48 1
            38   36  42 1
            39   37  38 1
            40   35  34 1
            41   41  34 1
            42   48  49 1
            43   49  50 1
            44   50  48 1
            45   30  34 1
            46   42  43 1
            47   43  44 1
            48   44  45 1
            49   45  46 1
            50   42  46 1
            51   22  23 1
            52   23  24 1
            53   24  25 2
            54   25  26 1
            55   26  27 1
            56   23  28 2
            57   26  29 2
            58   51  52 1
            59   52  53 1
            60   53  54 2
            61   54  55 1
            62   55  56 1
            63   52  58 2
            64   55  57 2
            65   59  60 1
            66   60  61 1
            67   61  62 2
            68   62  63 1
            69   63  64 1
            70   60  66 2
            71   63  65 2
BRACKET     1    22.4000  -29.0500   22.4000  -20.8600
            1    35.6300  -20.8600   35.6300  -29.0500
            1  2
 ORIGINAL  1    1   2   3   4  15   6   8  11  12  10   7   5   9  18  19  20
            1   21  13  14  16  17
 REPEAT    1   30  31  32  33  34  35  36  37  38  39  40  41  42  43  44  45
            1   46  47  48  49  50
            2    37.8000  -27.7200   37.8000  -23.3100
            2    47.3200  -23.3100   47.3200  -27.7200
            2  3
 ORIGINAL  2   22  23  24  25  26  27  29  28
 REPEAT    2   51  52  53  54  55  56  57  58  59  60  61  62  63  64  65  66

» Japanese version   » Back

DBGET integrated database retrieval system