KEGG   COMPOUND: C06825Help
Entry
C06825                      Compound                               

Name
Amlodipine
Formula
C20H25ClN2O5
Exact mass
408.1452
Mol weight
408.8759
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
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
     C08CA01 Amlodipine
      D07450  Amlodipine (INN)
USP drug classification [BR:br08302]
 Cardiovascular Agents
  Calcium Channel Blocking Agents
   Amlodipine
    D07450  Amlodipine (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
     Amlodipine
      D07450  Amlodipine (INN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP3A4
   Amlodipine
    D07450  Amlodipine (INN)
  CYP3A5
   Amlodipine
    D07450  Amlodipine (INN)
  CYP3A7
   Amlodipine
    D07450  Amlodipine (INN)
 Inhbitors
  CYP3A
   Amlodipine
    D07450  Amlodipine (INN)
BRITE hierarchy
Other DBs
CAS: 
88150-42-9
PubChem: 
ChEBI: 
NIKKAJI: 
KCF data Show

ATOM        28
            1   C1y C    20.8600  -15.8900
            2   C2y C    22.0500  -15.1900
            3   C2y C    19.6700  -15.1900
            4   C8y C    20.8600  -18.2700
            5   C2y C    22.0500  -13.7900
            6   C7a C    23.2400  -15.8900
            7   C2y C    19.6700  -13.7900
            8   C7a C    18.4800  -15.8200
            9   C8y C    22.0500  -18.9700
            10  C8x C    19.6700  -18.9700
            11  N1x N    20.8600  -13.0900
            12  C1b C    23.2400  -13.0900
            13  O7a O    24.4300  -15.1900
            14  O6a O    23.2400  -17.2200
            15  C1a C    18.4800  -13.0900
            16  O7a O    17.2900  -15.1900
            17  O6a O    18.4800  -17.2200
            18  C8x C    22.0500  -20.3000
            19  X   Cl   23.2400  -18.2700
            20  C8x C    19.6700  -20.3000
            21  O2a O    24.4300  -13.7900
            22  C1b C    25.6200  -15.8900
            23  C1a C    16.1000  -15.8200
            24  C8x C    20.8600  -21.0000
            25  C1b C    25.6200  -13.0900
            26  C1a C    26.8100  -15.1900
            27  C1b C    26.8100  -13.7900
            28  N1a N    28.0000  -13.0900
BOND        29
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     4  10 2
            10    5  11 1
            11    5  12 1
            12    6  13 1
            13    6  14 2
            14    7  15 1
            15    8  16 1
            16    8  17 2
            17    9  18 2
            18    9  19 1
            19   10  20 1
            20   12  21 1
            21   13  22 1
            22   16  23 1
            23   18  24 1
            24   21  25 1
            25   22  26 1
            26   25  27 1
            27   27  28 1
            28    7  11 1
            29   20  24 2

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