KEGG   DRUG: D07494Help
Entry
D07494                      Drug                                   

Name
Barnidipine (INN);
Vasexten (TN)
Formula
C27H29N3O6
Exact mass
491.2056
Mol weight
491.5357
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Calcium antagonist
Remark
ATC code: 
Drug group: 
Target
calcium channel L type blocker [HSA:775 776 778 779] [KO:K04850 K04851 K04853 K04857]
  Pathway
hsa04010  MAPK signaling pathway
hsa04020  Calcium signaling pathway
hsa04260  Cardiac muscle contraction
hsa04270  Vascular smooth muscle contraction  
 
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Interaction
Drug interaction
Structure map
Calcium channel blocking drugs
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C08 CALCIUM CHANNEL BLOCKERS
   C08C SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
    C08CA Dihydropyridine derivatives
     C08CA12 Barnidipine
      D07494  Barnidipine (INN)
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated cation channels
   Ca2+ channel, CACN alpha-1, CaVx.x
    calcium channel L type
     Barnidipine
      D07494  Barnidipine (INN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP3A4
   Barnidipine
    D07494  Barnidipine (INN)
BRITE hierarchy
Other DBs
CAS: 
104713-75-9
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        36
            1   C1b C    29.8200  -18.2000
            2   N1y N    28.6300  -17.5700
            3   C1x C    29.0500  -16.2400
            4   C1x C    27.9300  -15.4000
            5   C1y C    26.8100  -16.2400
            6   C1x C    27.2300  -17.5700
            7   C2y C    20.7900  -14.1400
            8   C2y C    20.7900  -15.5400
            9   C1y C    22.0500  -16.2400
            10  C2y C    23.2400  -15.5400
            11  C2y C    23.2400  -14.1400
            12  N1x N    22.0500  -13.4400
            13  C8y C    22.0500  -17.6400
            14  C8x C    20.8600  -18.3400
            15  C8x C    20.8600  -19.6700
            16  C8x C    22.0500  -20.3700
            17  C8y C    23.2400  -19.6700
            18  C8x C    23.2400  -18.2700
            19  C7a C    24.4300  -16.2400
            20  O6a O    24.4300  -17.6400
            21  O7a O    25.6200  -15.5400
            22  C1a C    24.4300  -13.4400
            23  C1a C    19.6000  -13.4400
            24  C7a C    19.6000  -16.2400
            25  O7a O    18.4100  -15.5400
            26  O6a O    19.6000  -17.6400
            27  C1a C    17.2200  -16.2400
            28  N2b N    24.4300  -20.3700 #+
            29  O3a O    24.4300  -21.7700 #-
            30  O3a O    25.9700  -19.3200
            31  C8y C    29.8200  -19.6000
            32  C8x C    28.6300  -20.3000
            33  C8x C    28.6300  -21.7000
            34  C8x C    29.8200  -22.4000
            35  C8x C    31.0800  -21.7000
            36  C8x C    31.0800  -20.3000
BOND        39
            1    17  18 1
            2    18  13 2
            3     3   4 1
            4    10  19 1
            5     4   5 1
            6    19  20 2
            7     7   8 2
            8    19  21 1
            9     5  21 1 #Up
            10    8   9 1
            11   11  22 1
            12    9  10 1
            13    7  23 1
            14   10  11 2
            15    8  24 1
            16   11  12 1
            17   24  25 1
            18   12   7 1
            19   24  26 2
            20    5   6 1
            21   25  27 1
            22    9  13 1 #Up
            23   17  28 1
            24    6   2 1
            25   28  29 1
            26   28  30 2
            27    1   2 1
            28    1  31 1
            29    2   3 1
            30   13  14 1
            31   14  15 2
            32   15  16 1
            33   31  32 2
            34   32  33 1
            35   33  34 2
            36   34  35 1
            37   35  36 2
            38   36  31 1
            39   16  17 2

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