KEGG   DRUG: D08111Help
Entry
D08111                      Drug                                   

Name
Lercanidipine (INN);
Lercanil (TN)
Formula
C36H41N3O6
Exact mass
611.2995
Mol weight
611.7272
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Calcium antagonist
Remark
ATC code: 
Drug group: 
Comment
dihydropyridine calcium channel blocker
Target
L-type calcium channel blocker [HSA:775 776 778 779] [KO:K04850 K04851 K04853 K04857]
  Pathway
hsa04020  Calcium signaling pathway
hsa04260  Cardiac muscle contraction
hsa04270  Vascular smooth muscle contraction  
 
Metabolism
Enzyme: CYP3A4 [HSA:1576], CYP3A5 [HSA:1577], CYP3A7 [HSA:1551]
Interaction
Drug interaction
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
     C08CA13 Lercanidipine
      D08111  Lercanidipine (INN)
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated cation channels
   Ca2+ channel, CACN alpha-1, CaVx.x
    calcium channel
     Lercanidipine
      D08111  Lercanidipine (INN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP3A4
   Lercanidipine
    D08111  Lercanidipine (INN)
  CYP3A5
   Lercanidipine
    D08111  Lercanidipine (INN)
  CYP3A7
   Lercanidipine
    D08111  Lercanidipine (INN)
BRITE hierarchy
Other DBs
CAS: 
100427-26-7
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        45
            1   C1y C    19.3200  -17.5000
            2   C8y C    19.3200  -18.8300
            3   C2y C    20.5100  -16.8000
            4   C2y C    18.1300  -16.8000
            5   C8x C    20.5100  -19.5300
            6   C8x C    18.1300  -19.5300
            7   C2y C    20.5100  -15.4000
            8   C7a C    21.7000  -17.5000
            9   C2y C    18.1300  -15.4000
            10  C7a C    16.9400  -17.5000
            11  C8y C    20.5100  -20.9300
            12  C8x C    18.1300  -20.9300
            13  N1x N    19.3200  -14.7000
            14  C1a C    21.7000  -14.7000
            15  O7a O    22.8900  -16.8000
            16  O6a O    21.7000  -18.8300
            17  C1a C    16.9400  -14.7000
            18  O7a O    15.7500  -16.8000
            19  O6a O    16.9400  -18.8300
            20  C8x C    19.3200  -21.6300
            21  N2b N    21.7000  -21.6300 #+
            22  C1d C    24.0800  -17.5000
            23  C1a C    14.5600  -17.5000
            24  O3a O    23.2400  -20.6500
            25  O3a O    21.7000  -23.3100 #-
            26  C1b C    25.2700  -16.8000
            27  N1c N    26.4600  -17.5000
            28  C1b C    27.7200  -16.8000
            29  C1a C    26.4600  -18.8300
            30  C1b C    28.9100  -17.5000
            31  C1c C    30.1000  -16.8000
            32  C8y C    31.2900  -17.5000
            33  C8y C    30.1000  -15.4000
            34  C8x C    31.2900  -14.7000
            35  C8x C    31.2900  -13.3000
            36  C8x C    30.1000  -12.6000
            37  C8x C    28.9100  -13.3000
            38  C8x C    28.9100  -14.7000
            39  C8x C    31.2900  -18.8300
            40  C8x C    32.4800  -19.5300
            41  C8x C    33.7400  -18.8300
            42  C8x C    33.7400  -17.4300
            43  C8x C    32.4800  -16.8000
            44  C1a C    23.3800  -18.6900
            45  C1a C    24.7800  -18.6900
BOND        48
            1     8  15 1
            2     8  16 2
            3     9  17 1
            4    10  18 1
            5    10  19 2
            6    11  20 1
            7    11  21 1
            8    15  22 1
            9    18  23 1
            10   21  24 2
            11   21  25 1
            12   22  26 1
            13   26  27 1
            14   27  28 1
            15   27  29 1
            16   28  30 1
            17    9  13 1
            18   12  20 2
            19   30  31 1
            20   31  32 1
            21    1   2 1
            22   31  33 1
            23    1   3 1
            24    1   4 1
            25    2   5 1
            26    2   6 2
            27    3   7 2
            28   33  34 1
            29   34  35 2
            30   35  36 1
            31   36  37 2
            32   37  38 1
            33   38  33 2
            34    3   8 1
            35    4   9 2
            36    4  10 1
            37    5  11 2
            38    6  12 1
            39   32  39 1
            40   39  40 2
            41   40  41 1
            42   41  42 2
            43   42  43 1
            44   43  32 2
            45    7  13 1
            46   22  44 1
            47    7  14 1
            48   22  45 1

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