KEGG   DRUG: Ipratropium bromide
Entry
D02212                      Drug                                   
Name
Ipratropium bromide (USP);
Ipratropium bromide hydrate (JP18);
Atrovent (TN)
Product
  Generic
Formula
C20H30NO3. Br. H2O
Exact mass
429.1515
Mol weight
430.3764
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01491  Muscarinic cholinergic receptor antagonist
Remark
Therapeutic category: 2259
ATC code: R01AX03 R03BB01
Product: D02212<JP/US>
Product (mixture): D10256<US>
Efficacy
Bronchodilator, Muscarinic acetylcholine receptor antagonist
  Disease
Chronic obstructive pulmonary disease [DS:H01714]
Emphysema [DS:H01714]
Comment
Tropane derivative, Quaternary ammonium compound
Target
  Pathway
hsa04024  cAMP signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse
Interaction
Structure map
map07220  Cholinergic and anticholinergic drugs
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01A DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
    R01AX Other nasal preparations
     R01AX03 Ipratropium bromide
      D02212  Ipratropium bromide (USP) <JP/US>
  R03 DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
   R03B OTHER DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES, INHALANTS
    R03BB Anticholinergics
     R03BB01 Ipratropium bromide
      D02212  Ipratropium bromide (USP) <JP/US>
USP drug classification [BR:br08302]
 Respiratory Tract/Pulmonary Agents
  Bronchodilators, Anticholinergic
   Ipratropium
    D02212  Ipratropium bromide (USP)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  22  Respiratory organ agents
   225  Bronchodilators
    2259  Others
     D02212  Ipratropium bromide (USP); Ipratropium bromide hydrate (JP18)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01491  Muscarinic cholinergic receptor antagonist
   D02212  Ipratropium bromide
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    CHRM
     D02212  Ipratropium bromide (USP) <JP/US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D02212  Ipratropium bromide hydrate
Other DBs
CAS: 22254-24-6
PubChem: 7849272
ChEBI: 5957
LigandBox: D02212
NIKKAJI: J252.827D
KCF data

ATOM        26
            1   O0  O    36.0414  -15.4183
            2   C1x C    21.9338  -15.2408
            3   C1x C    22.2619  -14.0691
            4   C1y C    23.1055  -14.9596
            5   C1y C    23.4336  -13.7879
            6   N2y N    22.1682  -12.4756 #+
            7   C1x C    24.9802  -14.9596
            8   C1x C    24.6990  -13.7879
            9   C1y C    26.0113  -15.5220
            10  O7a O    27.0893  -16.4125
            11  C7a C    28.3079  -16.4125
            12  C1c C    28.9172  -15.3345
            13  O6a O    28.9172  -17.5373
            14  C8y C    30.1358  -15.3345
            15  C1b C    28.3079  -14.3034
            16  O1a O    28.9172  -13.2255
            17  C8x C    30.8420  -16.5582
            18  C8x C    32.2420  -16.5585
            19  C8x C    32.9422  -15.3462
            20  C8x C    32.2361  -14.1225
            21  C8x C    30.8361  -14.1222
            22  C1a C    21.4191  -11.2914
            23  C1c C    20.9389  -13.0883
            24  C1a C    19.7662  -12.3118
            25  C1a C    20.9231  -14.4879
            26  X   Br   25.9700  -11.4800 #-
BOND        26
            1     2   3 1
            2     2   4 1
            3     3   5 1
            4     4   6 1
            5     4   7 1
            6     5   8 1
            7     7   9 1
            8     9  10 1 #Down
            9    10  11 1
            10   11  12 1
            11   11  13 2
            12   12  14 1
            13   12  15 1
            14   15  16 1
            15    5   6 1
            16    8   9 1
            17   14  17 2
            18   17  18 1
            19   18  19 2
            20   19  20 1
            21   20  21 2
            22   14  21 1
            23    6  22 1
            24    6  23 1
            25   23  24 1
            26   23  25 1

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