KEGG   DRUG: Iloprost
Entry
D02721                      Drug                                   

Name
Iloprost (USAN/INN);
Ventavis (TN)
Product
Formula
C22H32O4
Exact mass
360.2301
Mol weight
360.4871
Structure
Simcomp
Class
Cardiovascular agent
 DG01712  Antiplatelet agent
 DG01950  Antithrombotic agent
  DG01712  Antiplatelet agent
 DG01810  Prostacycline derivative
Other
 DG01961  Prostaglandin derivative
  DG01810  Prostacycline derivative
 DG02573  Prostanoid derivative
  DG01961  Prostaglandin derivative
   DG01810  Prostacycline derivative
Remark
Therapeutic category: 2190
ATC code: B01AC11
Chemical structure group: DG00158
Product (DG00158): D02721<JP/US>
Efficacy
Antihypertensive, Platelet aggregation inhibitor, Prostaglandin I2 receptor agonist
  Disease
Pulmonary arterial hypertension [DS:H01621]
Comment
Prostacycline derivative
Treatment of pulmonary hypertension
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
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
     B01AC11 Iloprost
      D02721  Iloprost (USAN/INN) <JP/US>
USP drug classification [BR:br08302]
 Respiratory Tract/Pulmonary Agents
  Pulmonary Antihypertensives
   Prostacyclin Vasodilators
    Iloprost
     D02721  Iloprost (USAN/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  21  Cardiovascular agents
   219  Miscellaneous
    2190  Miscellaneous
     D02721  Iloprost (USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Prostacyclin
    PTGIR
     D02721  Iloprost (USAN/INN) <JP/US>
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D02721
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D02721
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D02721
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D02721
Other DBs
CAS: 78919-13-8
PubChem: 17396888
ChEBI: 63916
ChEMBL: CHEMBL494
DrugBank: DB01088
LigandBox: D02721
NIKKAJI: J685.840F
LinkDB
KCF data

ATOM        26
            1   C1x C     8.0500  -25.0600
            2   C1y C     8.8900  -26.1800
            3   C1y C    10.2200  -25.6900
            4   C1y C    10.2200  -24.2900
            5   C1y C     8.8900  -23.8700
            6   O1a O     8.4000  -27.5100
            7   C1x C    11.0600  -23.1700
            8   C2y C    10.2200  -22.0500
            9   C1x C     8.8900  -22.4700
            10  C2b C    11.4800  -26.3900
            11  C2b C    12.6700  -25.6900
            12  C1c C    13.8600  -26.3900
            13  C1c C    15.0500  -25.7600
            14  C1b C    16.2400  -26.3900
            15  C1a C    15.0500  -24.2900
            16  C3b C    17.4300  -25.7600
            17  C3b C    18.6900  -25.0600
            18  C1a C    19.8800  -24.3600
            19  O1a O    13.8600  -27.8600
            20  C2b C    10.6480  -20.7170
            21  C1b C     9.7055  -19.6775
            22  C1b C     8.3621  -19.9679
            23  C1b C     7.3986  -18.9047
            24  C6a C     6.0516  -19.1956
            25  O6a O     5.0897  -18.1338
            26  O6a O     5.6246  -20.5230
BOND        27
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     2   6 1 #Down
            7     4   7 1 #Down
            8     7   8 1
            9     8   9 1
            10    5   9 1 #Down
            11    3  10 1 #Up
            12   10  11 2
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   13  15 1
            17   14  16 1
            18   16  17 3
            19   17  18 1
            20   12  19 1 #Down
            21    8  20 2
            22   20  21 1
            23   21  22 1
            24   22  23 1
            25   23  24 1
            26   24  25 1
            27   24  26 2

» Japanese version   » Back

KEGG   DRUG: Iloprost tromethamine
Entry
D08065                      Drug                                   

Name
Iloprost tromethamine;
Iloprost trometamol;
Ventavis (TN)
Formula
C22H32O4. C4H11NO3
Exact mass
481.304
Mol weight
481.6221
Structure
Simcomp
Class
Cardiovascular agent
 DG01712  Antiplatelet agent
 DG01950  Antithrombotic agent
  DG01712  Antiplatelet agent
 DG01810  Prostacycline derivative
Other
 DG01961  Prostaglandin derivative
  DG01810  Prostacycline derivative
 DG02573  Prostanoid derivative
  DG01961  Prostaglandin derivative
   DG01810  Prostacycline derivative
Remark
ATC code: B01AC11
Chemical structure group: DG00158
Product (DG00158): D02721<JP/US>
Efficacy
Anticoagulant, Antihypertensive, 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
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
     B01AC11 Iloprost
      D08065  Iloprost tromethamine
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Prostacyclin
    PTGIR
     D08065  Iloprost tromethamine
Other DBs
CAS: 697225-02-8
PubChem: 96024757
LigandBox: D08065
LinkDB
KCF data

ATOM        34
            1   C1b C    27.5562  -15.9840
            2   C1d C    28.7702  -16.6849
            3   O1a O    26.3422  -16.6849
            4   C1b C    29.9673  -15.9936
            5   O1a O    31.1563  -16.6800
            6   C1b C    28.7703  -18.0866
            7   N1a N    28.7938  -15.2833
            8   O1a O    29.9675  -18.7779
            9   C1x C    11.8300  -19.3200
            10  C1y C    12.6700  -20.4400
            11  C1y C    14.0000  -19.9500
            12  C1y C    14.0000  -18.5500
            13  C1y C    12.6700  -18.1300
            14  O1a O    12.1800  -21.7700
            15  C1x C    14.8400  -17.4300
            16  C2y C    14.0000  -16.3100
            17  C1x C    12.6700  -16.7300
            18  C2b C    15.2600  -20.6500
            19  C2b C    16.4500  -19.9500
            20  C1c C    17.5700  -20.6500
            21  C1c C    18.7600  -20.0200
            22  C1b C    19.9500  -20.6500
            23  C1a C    18.7600  -18.5500
            24  C3b C    21.1400  -20.0200
            25  C3b C    22.4000  -19.3200
            26  C1a C    23.5900  -18.6200
            27  O1a O    17.5700  -22.1200
            28  C2b C    14.4200  -14.9800
            29  C1b C    13.4400  -13.9300
            30  C1b C    12.1100  -14.2100
            31  C1b C    11.1300  -13.1600
            32  C6a C     9.8000  -13.4400
            33  O6a O     8.8900  -12.3900
            34  O6a O     9.3800  -14.7700
BOND        34
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     4   5 1
            5     2   6 1
            6     2   7 1
            7     6   8 1
            8     9  10 1
            9    10  11 1
            10   11  12 1
            11   12  13 1
            12    9  13 1
            13   10  14 1 #Down
            14   12  15 1 #Down
            15   15  16 1
            16   16  17 1
            17   13  17 1 #Down
            18   11  18 1 #Up
            19   18  19 2
            20   19  20 1
            21   20  21 1
            22   21  22 1
            23   21  23 1
            24   22  24 1
            25   24  25 3
            26   25  26 1
            27   20  27 1 #Down
            28   16  28 2
            29   28  29 1
            30   29  30 1
            31   30  31 1
            32   31  32 1
            33   32  33 1
            34   32  34 2

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