KEGG   DRUG: Amlodipine maleateHelp
Entry
D02914                      Drug                                   

Name
Amlodipine maleate (USAN);
Amvaz (TN)
Formula
C20H25ClN2O5. C4H4O4
Exact mass
524.1562
Mol weight
524.9481
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01928  Dihydropyridine calcium channel blocker
Other
 DG01575  Calcium channel blocker
  DG01496  Calcium channel L type blocker
Cyp substrate
 DG01633  CYP3A substrate
Remark
ATC code: C08CA01
Chemical structure group: DG00322
Product (DG00322): D00615<JP/US>
Product (mixture): D11069<US> D10805<JP>
Efficacy
Antihypertensive, Vasodilator, Calcium channel blocker
Comment
Dihydropyridine derivative
Target
CACNA1-L [HSA:775 776 778 779] [KO:K04850 K04851 K04853 K04857]
  Pathway
hsa04020  Calcium signaling pathway
hsa04260  Cardiac muscle contraction
hsa04261  Adrenergic signaling in cardiomyocytes
hsa04270  Vascular smooth muscle contraction
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Interaction
Drug interaction
Structure map
map07036  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
     C08CA01 Amlodipine
      D02914  Amlodipine maleate (USAN)
USP drug classification [BR:br08302]
 Cardiovascular Agents
  Calcium Channel Blocking Agents
   Amlodipine
    D02914  Amlodipine maleate (USAN)
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated ion channels
   Calcium channels
    CACNA1-L
     D02914  Amlodipine maleate (USAN)
BRITE hierarchy
Other DBs
CAS: 88150-47-4
PubChem: 17397071
ChEMBL: CHEMBL1200984
DrugBank: DB00381
LigandBox: D02914
NIKKAJI: J2.204.618G
KCF data Show

ATOM        36
            1   C6a C    28.6629  -16.1156
            2   O6a O    29.3546  -17.3137
            3   O6a O    31.2223  -17.3137
            4   C6a C    31.9140  -16.1156
            5   C2b C    31.2223  -14.9175
            6   C2b C    29.3546  -14.9175
            7   O6a O    33.2975  -16.1156
            8   O6a O    27.2794  -16.1156
            9   C1y C    21.0168  -13.2762
            10  C2y C    22.1998  -12.5803
            11  C2y C    19.8339  -12.5803
            12  C8y C    21.0168  -15.6421
            13  C2y C    22.1998  -11.1886
            14  C7a C    23.3828  -13.2762
            15  C2y C    19.8339  -11.1886
            16  C7a C    18.6509  -13.2066
            17  C8y C    22.1998  -16.3380
            18  C8x C    19.8339  -16.3380
            19  N1x N    21.0168  -10.4927
            20  C1b C    23.3828  -10.4927
            21  O7a O    24.5658  -12.5803
            22  O6a O    23.3828  -14.5983
            23  C1a C    18.6509  -10.4927
            24  O7a O    17.4679  -12.5803
            25  O6a O    18.6509  -14.5983
            26  C8x C    22.1998  -17.6601
            27  X   Cl   23.3828  -15.6421
            28  C8x C    19.8339  -17.6601
            29  O2a O    24.5658  -11.1886
            30  C1b C    25.7487  -13.2762
            31  C1a C    16.2849  -13.2066
            32  C8x C    21.0168  -18.3560
            33  C1b C    25.7487  -10.4927
            34  C1a C    26.9317  -12.5803
            35  C1b C    26.9317  -11.1886
            36  N1a N    28.1147  -10.4927
BOND        36
            1     1   2 2
            2     3   4 1
            3     4   5 1
            4     5   6 2
            5     1   6 1
            6     4   7 2
            7     1   8 1
            8     9  10 1
            9     9  11 1
            10    9  12 1
            11   10  13 2
            12   10  14 1
            13   11  15 2
            14   11  16 1
            15   12  17 1
            16   12  18 2
            17   13  19 1
            18   13  20 1
            19   14  21 1
            20   14  22 2
            21   15  23 1
            22   16  24 1
            23   16  25 2
            24   17  26 2
            25   17  27 1
            26   18  28 1
            27   20  29 1
            28   21  30 1
            29   24  31 1
            30   26  32 1
            31   29  33 1
            32   30  34 1
            33   33  35 1
            34   35  36 1
            35   15  19 1
            36   28  32 2

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