KEGG   DRUG: Butaprost
Entry
D03187                      Drug                                   
Name
Butaprost (USAN/INN)
Formula
C24H40O5
Exact mass
408.2876
Mol weight
408.5714
Structure
Simcomp
Class
Hormonal agent
 DG01961  Prostaglandin derivative
  DG01611  Prostaglandin E1 derivative
Efficacy
Bronchodilator, Prostaglandin E2 receptor agonist
Comment
Prostaglandin derivative
Target
PTGER2 [HSA:5732] [KO:K04259]
  Pathway
hsa04024  cAMP signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Structure map
map07228  Eicosanoid receptor agonists/antagonists
Brite
Drug groups [BR:br08330]
 Hormonal agent
  DG01961  Prostaglandin derivative
   DG01611  Prostaglandin E1 derivative
    D03187  Butaprost
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Prostaglandin
    PTGER2
     D03187  Butaprost (USAN/INN)
Other DBs
CAS: 69648-38-0
PubChem: 17397341
LigandBox: D03187
NIKKAJI: J22.802H
LinkDB
KCF data

ATOM        29
            1   C1y C     7.2903   -9.7199
            2   C1y C     7.2838  -11.1299
            3   C5x C     5.9512   -9.2800
            4   C1b C     8.5193   -8.3277
            5   C1y C     5.9384  -11.5569
            6   C2b C     8.5000  -12.5351
            7   C1x C     5.1235  -10.4184
            8   O5x O     5.5179   -7.9411
            9   C1b C     9.7353   -9.0328
            10  O1a O     5.4920  -12.6781
            11  C2b C     9.7158  -11.8299
            12  C1b C    10.9385  -12.5351
            13  C1c C    12.1544  -11.8299
            14  C1z C    13.3770  -12.5351
            15  C1b C    14.5930  -11.8299
            16  C1b C    15.8091  -12.5351
            17  C1a C    17.0316  -11.8299
            18  O1a O    12.1528  -10.4303
            19  C1x C    12.3871  -13.5250
            20  C1x C    13.3770  -14.5150
            21  C1x C    14.3670  -13.5250
            22  C1b C    10.9463   -8.3367
            23  C1b C    12.1347   -9.0260
            24  C1b C    13.3282   -8.3400
            25  C1b C    14.5138   -9.0276
            26  C7a C    15.7086   -8.3408
            27  O7a O    16.8936   -9.0280
            28  C1a C    18.0887   -8.3409
            29  O6a O    15.7115   -6.9304
BOND        30
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 1 #Up
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     5  10 1 #Down
            10    6  11 2
            11   11  12 1
            12   12  13 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 1
            17    5   7 1
            18   13  18 1 #Up
            19   14  19 1
            20   19  20 1
            21   20  21 1
            22   14  21 1
            23    9  22 1
            24   22  23 1
            25   23  24 1
            26   24  25 1
            27   25  26 1
            28   26  27 1
            29   27  28 1
            30   26  29 2

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