KEGG   DRUG: Adenosine
Entry
D00045                      Drug                                   
Name
Adenosine (JAN/USP);
Adenocard (TN);
Adenoscan (TN)
Product
  Generic
Formula
C10H13N5O4
Exact mass
267.0968
Mol weight
267.2413
Structure
Simcomp
Remark
Same as: C00212
Therapeutic category: 7990
ATC code: C01EB10
Chemical structure group: DG00243
Product (DG00243): D00045<JP/US> D02300<JP>
Efficacy
Antiarrhythmic, Cardiac depressant, Diagnostic aid (cardiac stress test), Adenosine receptor agonist
Target
ADORA [HSA:134 135 136 140] [KO:K04265 K04266 K04267 K04268]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04270  Vascular smooth muscle contraction
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01E OTHER CARDIAC PREPARATIONS
    C01EB Other cardiac preparations
     C01EB10 Adenosine
      D00045  Adenosine (JAN/USP) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 7  Agents not mainly for therapeutic purpose
  79  Other agents not mainly for therapeutic purpose
   799  Miscellaneous
    7990  Miscellaneous
     D00045  Adenosine (JAN/USP)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adenosine
    ADORA
     D00045  Adenosine (JAN/USP) <JP/US>
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D00045
Other DBs
CAS: 58-61-7
PubChem: 7847113
ChEBI: 16335
PDB-CCD: ADN[PDBj]
LigandBox: D00045
NIKKAJI: J4.501B
LinkDB
KCF data

ATOM        19
            1   N4y N    27.7735  -15.1762
            2   C8y C    28.7550  -16.0205
            3   C1y C    26.4808  -15.5916
            4   C8x C    28.3947  -13.8350
            5   C8y C    30.0785  -15.2503
            6   N5x N    28.7377  -17.4480
            7   O2x O    25.3403  -14.7435
            8   C1y C    26.0539  -16.8432
            9   N5x N    29.8363  -13.9950
            10  C8y C    31.2648  -15.9301
            11  C8x C    29.9894  -18.1759
            12  C1y C    24.2407  -15.5331
            13  C1y C    24.6677  -16.8432
            14  O1a O    26.4632  -18.1767
            15  N5x N    31.2695  -17.4246
            16  N1a N    32.4508  -15.2334
            17  C1b C    22.9364  -15.1236
            18  O1a O    24.2231  -18.1709
            19  O1a O    21.8253  -15.9600
BOND        21
            1     1   2 1
            2     3   1 1 #Up
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13    8  14 1 #Down
            14   10  15 2
            15   10  16 1
            16   12  17 1 #Up
            17   13  18 1 #Down
            18   17  19 1
            19    5   9 1
            20   11  15 1
            21   12  13 1

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