KEGG   DRUG: Beraprost
Entry
D02720                      Drug                                   
Name
Beraprost (USAN)
Formula
C24H30O5
Exact mass
398.2093
Mol weight
398.49
Structure
Simcomp
Class
Blood modifier agent
 DG01950  Antithrombotic agent
  DG01712  Antiplatelet agent
Hormonal agent
 DG01961  Prostaglandin derivative
  DG01810  Prostacycline derivative
Remark
ATC code: B01AC19
Chemical structure group: DG00160
Product (DG00160): D01551<JP>
Efficacy
Platelet aggregation inhibitor, Prostaglandin I2 receptor agonist
Comment
Prostacycline derivative
Target
PTGIR [HSA:5739] [KO:K04263]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04270  Vascular smooth muscle contraction
hsa04611  Platelet activation
Interaction
Structure map
map07034  Eicosanoids
map07049  Antithrombosis agents
map07228  Eicosanoid receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 B BLOOD AND BLOOD FORMING ORGANS
  B01 ANTITHROMBOTIC AGENTS
   B01A ANTITHROMBOTIC AGENTS
    B01AC Platelet aggregation inhibitors excl. heparin
     B01AC19 Beraprost
      D02720  Beraprost (USAN)
Drug groups [BR:br08330]
 Blood modifier agent
  DG01950  Antithrombotic agent
   DG01712  Antiplatelet agent
    DG00160  Beraprost
     D02720  Beraprost
 Hormonal agent
  DG01961  Prostaglandin derivative
   DG01810  Prostacycline derivative
    DG00160  Beraprost
     D02720  Beraprost
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Prostacyclin
    PTGIR
     D02720  Beraprost (USAN)
Drug groups [BR:br08330]
 Blood modifier agent
  DG01950  Antithrombotic agent
   DG01712  Antiplatelet agent
    DG00160  Beraprost
 Hormonal agent
  DG01961  Prostaglandin derivative
   DG01810  Prostacycline derivative
    DG00160  Beraprost
Other DBs
CAS: 88430-50-6
PubChem: 17396887
ChEBI: 135633
LigandBox: D02720
NIKKAJI: J375.046I
LinkDB
KCF data

ATOM        29
            1   C8y C    15.9561  -15.6378
            2   C8y C    16.6542  -16.8944
            3   C8x C    18.1203  -16.8944
            4   C8x C    18.8184  -15.6378
            5   C8x C    18.0505  -14.3812
            6   C8y C    16.6542  -14.3812
            7   C1y C    15.9561  -18.0812
            8   C1y C    14.6297  -17.6624
            9   C1y C    15.9561  -19.4775
            10  O2x O    14.6297  -16.2661
            11  C1x C    13.8617  -18.7794
            12  C1y C    14.6995  -19.8964
            13  C2b C    17.1429  -20.1756
            14  O1a O    14.2108  -21.2926
            15  C2b C    18.3297  -19.4775
            16  C1c C    19.5165  -20.1756
            17  C1c C    20.7034  -19.4775
            18  O1a O    19.5165  -21.5719
            19  C1b C    21.8902  -20.1756
            20  C3b C    23.1469  -19.4775
            21  C1a C    20.7034  -18.0812
            22  C1b C    15.9561  -13.1944
            23  C3b C    24.3337  -18.7794
            24  C1a C    25.5205  -18.0812
            25  C1b C    14.5599  -13.1944
            26  C1b C    13.8617  -12.0076
            27  C6a C    12.4655  -12.0076
            28  O6a O    11.7674  -10.8207
            29  O6a O    11.7674  -13.1944
BOND        31
            1     7   9 1
            2     7   2 1
            3     8  10 1
            4     8  11 1
            5     9  12 1
            6     9  13 1
            7    12  14 1
            8    13  15 2
            9    15  16 1
            10   16  17 1
            11   16  18 1
            12   17  19 1
            13   19  20 1
            14   10   1 1
            15   11  12 1
            16    5   6 2
            17   17  21 1
            18    6   1 1
            19    6  22 1
            20    1   2 2
            21    2   3 1
            22    3   4 2
            23    4   5 1
            24   20  23 3
            25    7   8 1
            26   23  24 1
            27   22  25 1
            28   25  26 1
            29   26  27 1
            30   27  28 1
            31   27  29 2

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