KEGG   DRUG: D02825Help
Entry
D02825                      Drug                                   

Name
Almotriptan malate (USAN);
Axert (TN)
Product
Formula
C17H25N3O2S. C4H6O5
Exact mass
469.1883
Mol weight
469.5517
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antimigraine [5HT1D agonist]
Remark
ATC code: 
Drug group: 
Target
5-HT1B-receptor agonist [HSA:3351] [KO:K04153];
5-HT1D-receptor agonist [HSA:3352] [KO:K04153]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04726  Serotonergic synapse  
 
Interaction
Drug interaction
Structure map
Antimigraines
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N02 ANALGESICS
   N02C ANTIMIGRAINE PREPARATIONS
    N02CC Selective serotonin (5HT1) agonists
     N02CC05 Almotriptan
      D02825  Almotriptan malate (USAN)
USP drug classification [BR:br08302]
 Antimigraine Agents
  Serotonin (5-HT) 1b/1d Receptor Agonists
   Almotriptan
    D02825  Almotriptan malate (USAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Serotonin
    5-HT1B-receptor
     Almotriptan
      D02825  Almotriptan malate (USAN)
    5-HT1D-receptor
     Almotriptan
      D02825  Almotriptan malate (USAN)
BRITE hierarchy
Other DBs
CAS: 
181183-52-8
PubChem: 
DrugBank: 
LigandBox: 
KCF data Show

ATOM        32
            1   O6a O    32.3870  -18.3686
            2   C6a C    33.5912  -19.0639
            3   C1c C    34.7956  -18.3686
            4   C1b C    35.9998  -19.0639
            5   C6a C    37.2041  -18.3686
            6   O6a O    38.4085  -19.0639
            7   O6a O    33.5912  -20.4544
            8   O6a O    37.2041  -16.9782
            9   O1a O    34.7956  -16.9783
            10  C8y C    27.2363  -19.5213
            11  C8y C    27.2363  -20.9261
            12  C8y C    28.5707  -19.0999
            13  C8x C    26.0422  -18.8188
            14  N4x N    28.5707  -21.3475
            15  C8x C    26.0422  -21.6284
            16  C8x C    29.4136  -20.2236
            17  C8y C    24.8481  -19.5213
            18  C8x C    24.8481  -20.9261
            19  C1b C    23.5839  -18.8188
            20  S4a S    22.3898  -19.5213
            21  O3c O    23.3732  -20.5046
            22  O3c O    21.4065  -20.5046
            23  N1y N    21.3979  -18.5267
            24  C1x C    21.8322  -17.1908
            25  C1x C    20.6958  -16.3648
            26  C1x C    19.5592  -17.1903
            27  C1x C    19.9930  -18.5263
            28  C1b C    28.5707  -17.6998
            29  C1b C    29.7716  -17.0065
            30  N1c N    29.7716  -15.5905
            31  C1a C    30.9879  -14.8882
            32  C1a C    28.5662  -14.8946
BOND        33
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     2   7 2
            7     5   8 2
            8     3   9 1
            9    10  11 1
            10   10  12 1
            11   10  13 2
            12   11  14 1
            13   11  15 2
            14   12  16 2
            15   13  17 1
            16   15  18 1
            17   17  19 1
            18   19  20 1
            19   20  21 2
            20   20  22 2
            21   14  16 1
            22   17  18 2
            23   20  23 1
            24   23  24 1
            25   24  25 1
            26   25  26 1
            27   26  27 1
            28   23  27 1
            29   12  28 1
            30   28  29 1
            31   29  30 1
            32   30  31 1
            33   30  32 1

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