KEGG   DRUG: EdoxabanHelp
Entry
D09710                      Drug                                   

Name
Edoxaban (USAN/INN)
Formula
C24H30ClN7O4S
Exact mass
547.1769
Mol weight
548.0575
Structure
Mol fileKCF fileDB search
Class
Cardiovascular agent
 DG01662  Factor Xa inhibitor
 DG01950  Antithrombotic agent
  DG01662  Factor Xa inhibitor
Transporter substrate
 DG01665  ABCB1(P-GP) substrate
Remark
ATC code: B01AF03
Chemical structure group: DG01398
Product (DG01398): D09546<JP/US>
Efficacy
Antithrombotic, Factor Xa inhibitor
Target
F10 [HSA:2159] [KO:K01314]
  Pathway
hsa04610  Complement and coagulation cascades
Metabolism
Transporter: ABCB1 [HSA:5243]
Interaction
Drug interaction
Structure map
map07049  Antithrombosis agents
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 B BLOOD AND BLOOD FORMING ORGANS
  B01 ANTITHROMBOTIC AGENTS
   B01A ANTITHROMBOTIC AGENTS
    B01AF Direct factor Xa inhibitors
     B01AF03 Edoxaban
      D09710  Edoxaban (USAN/INN)
USP drug classification [BR:br08302]
 Blood Products/Modifiers/Volume Expanders
  Anticoagulants
   Edoxaban
    D09710  Edoxaban (USAN/INN)
Target-based classification of drugs [BR:br08310]
 Not elsewhere classified
  Immune system
   Complement and coagulation
    F10
     D09710  Edoxaban (USAN/INN)
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D09710
BRITE hierarchy
Other DBs
CAS: 480449-70-5
PubChem: 124490450
ChEBI: 85973
ChEMBL: CHEMBL1269025
LigandBox: D09710
LinkDB All DBs
KCF data Show

ATOM        37
            1   C1x C    19.6700  -24.9200
            2   C1y C    19.6700  -26.3200
            3   C1y C    20.9300  -27.0200
            4   C1x C    22.1200  -26.3200
            5   C1x C    22.1200  -24.9200
            6   C1y C    20.9300  -24.2200
            7   C5a C    20.9300  -22.8200
            8   O5a O    19.6700  -22.1200
            9   N1c N    22.1200  -22.1200
            10  C1a C    23.3100  -22.8200
            11  C1a C    22.1200  -20.7200
            12  N1b N    20.9300  -28.4900
            13  C5a C    22.1200  -29.1200
            14  C5a C    23.3100  -28.4900
            15  O5a O    22.1200  -30.5900
            16  N1b N    24.5000  -29.1200
            17  O5a O    23.3100  -27.0200
            18  C8y C    25.6900  -28.4900
            19  N5x N    26.8800  -29.1200
            20  C8x C    28.0700  -28.4200
            21  C8y C    28.0700  -27.0200
            22  C8x C    26.8800  -26.3200
            23  C8x C    25.6900  -27.0900
            24  X   Cl   29.3300  -26.3200
            25  N1b N    18.4800  -27.0200
            26  C5a C    17.2900  -26.3900
            27  C8y C    16.1000  -27.0200
            28  O5a O    17.2900  -24.9200
            29  N5x N    14.8400  -26.4600
            30  C8y C    13.8600  -27.5100
            31  C8y C    14.5600  -28.7000
            32  S2x S    15.9600  -28.4200
            33  C1x C    12.4600  -27.5100
            34  C1x C    11.7600  -28.7000
            35  N1y N    12.4600  -29.8900
            36  C1x C    13.8600  -29.8900
            37  C1a C    11.7600  -31.1500
BOND        40
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     6   7 1 #Up
            8     7   8 2
            9     7   9 1
            10    9  10 1
            11    9  11 1
            12    3  12 1 #Down
            13   12  13 1
            14   13  14 1
            15   13  15 2
            16   14  16 1
            17   14  17 2
            18   16  18 1
            19   18  19 2
            20   19  20 1
            21   20  21 2
            22   21  22 1
            23   22  23 2
            24   18  23 1
            25   21  24 1
            26    2  25 1 #Down
            27   25  26 1
            28   26  27 1
            29   26  28 2
            30   27  29 2
            31   29  30 1
            32   30  31 2
            33   31  32 1
            34   27  32 1
            35   30  33 1
            36   33  34 1
            37   34  35 1
            38   35  36 1
            39   31  36 1
            40   35  37 1

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