KEGG   DRUG: Ibutilide
Entry
D08060                      Drug                                   

Name
Ibutilide (INN)
Formula
C20H36N2O3S
Exact mass
384.2447
Mol weight
384.5764
Structure
Simcomp
Class
Cardiovascular agent
 DG01653  Antiarrhythmics
  DG01648  Class III antiarrhythmic agent
Remark
Same as: C07753
ATC code: C01BD05
Chemical structure group: DG00205
Product (DG00205): D00648<US>
Efficacy
Antiarrhythmic, Potassium channel blocker
Comment
Sematilide derivative
Target
KCNH2 [HSA:3757] [KO:K04905]
Interaction
Structure map
map07037  Antiarrhythmic drugs
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
     C01BD05 Ibutilide
      D08060  Ibutilide (INN)
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated ion channels
   Potassium channels
    KCNH2
     D08060  Ibutilide (INN)
Other DBs
CAS: 122647-31-8
PubChem: 96024752
ChEBI: 5856
ChEMBL: CHEMBL533
DrugBank: DB00308
LigandBox: D08060
NIKKAJI: J362.100F
LinkDB
KCF data

ATOM        26
            1   C8y C    26.1100  -18.2700
            2   C8x C    26.1100  -19.6700
            3   C8x C    27.3000  -17.5700
            4   C1c C    24.8500  -17.5700
            5   C8x C    27.3000  -20.4400
            6   C8x C    28.5600  -18.2700
            7   C1b C    23.6600  -18.2700
            8   O1a O    24.8500  -16.1700
            9   C8y C    28.5600  -19.6700
            10  C1b C    22.4000  -17.5700
            11  N1b N    29.7500  -20.3700
            12  C1b C    21.2100  -18.2700
            13  S4a S    31.0100  -19.6700
            14  N1c N    20.0200  -17.5700
            15  C1a C    32.2000  -20.3700
            16  O3c O    29.7500  -18.9700
            17  O3c O    32.0600  -18.9700
            18  C1b C    20.0200  -16.1700
            19  C1a C    21.2100  -15.4700
            20  C1b C    18.8076  -18.2700
            21  C1b C    17.5951  -17.5700
            22  C1b C    16.3827  -18.2700
            23  C1b C    15.1703  -17.5700
            24  C1b C    13.9578  -18.2700
            25  C1b C    12.7454  -17.5700
            26  C1a C    11.5330  -18.2700
BOND        26
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 1
            7     4   8 1
            8     5   9 1
            9     7  10 1
            10    9  11 1
            11   10  12 1
            12   11  13 1
            13   12  14 1
            14   13  15 1
            15   13  16 2
            16   13  17 2
            17   14  18 1
            18    6   9 2
            19   18  19 1
            20   14  20 1
            21   20  21 1
            22   21  22 1
            23   22  23 1
            24   23  24 1
            25   24  25 1
            26   25  26 1

» Japanese version   » Back

DBGET integrated database retrieval system