KEGG   DRUG: Iloprost tromethamineHelp
Entry
D08065                      Drug                                   

Name
Iloprost tromethamine;
Iloprost trometamol;
Ventavis (TN)
Formula
C22H32O4. C4H11NO3
Exact mass
481.304
Mol weight
481.6221
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp 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 in 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
Drug 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
USP drug classification [BR:br08302]
 Respiratory Tract/Pulmonary Agents
  Pulmonary Antihypertensives
   Iloprost
    D08065  Iloprost tromethamine
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Prostacyclin
    prostaglandin I2 receptor
     Iloprost
      D08065  Iloprost tromethamine
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D08065
BRITE hierarchy
Other DBs
CAS: 697225-02-8
PubChem: 96024757
LigandBox: D08065
KCF data Show

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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