KEGG   DRUG: Beclometasone
Entry
D07495                      Drug                                   
Name
Beclometasone (INN);
Beclometason (TN)
Formula
C22H29ClO5
Exact mass
408.1704
Mol weight
408.9157
Structure
Simcomp
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Remark
Same as: C06842
ATC code: A07EA07 D07AC15 R01AD01 R03BA01
Chemical structure group: DG00097
Product (DG00097): D00689<JP/US> D11572<US>
Efficacy
Anti-inflammatory, Glucocorticoid receptor agonist
Target
NR3C1 (GR) [HSA:2908] [KO:K05771]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Structure map
map07225  Glucocorticoid and mineralocorticoid receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A07 ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
   A07E INTESTINAL ANTIINFLAMMATORY AGENTS
    A07EA Corticosteroids acting locally
     A07EA07 Beclometasone
      D07495  Beclometasone (INN)
 D DERMATOLOGICALS
  D07 CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
   D07A CORTICOSTEROIDS, PLAIN
    D07AC Corticosteroids, potent (group III)
     D07AC15 Beclometasone
      D07495  Beclometasone (INN)
 R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01A DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
    R01AD Corticosteroids
     R01AD01 Beclometasone
      D07495  Beclometasone (INN)
  R03 DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
   R03B OTHER DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES, INHALANTS
    R03BA Glucocorticoids
     R03BA01 Beclometasone
      D07495  Beclometasone (INN)
Drug groups [BR:br08330]
 Anti-inflammatory
  DG01955  Corticosteroid
   DG02068  Glucocorticoid
    DG00097  Beclometasone
     D07495  Beclometasone
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D07495  Beclometasone (INN)
Drug groups [BR:br08330]
 Anti-inflammatory
  DG01955  Corticosteroid
   DG02068  Glucocorticoid
    DG00097  Beclometasone
Other DBs
CAS: 4419-39-0
PubChem: 51091820
ChEBI: 3001
PDB-CCD: GXR[PDBj]
LigandBox: D07495
NIKKAJI: J8.720C
KCF data

ATOM        28
            1   C1z C    25.9700  -17.5700
            2   C1z C    24.7800  -18.2000
            3   C1y C    27.1600  -18.2700
            4   C1y C    24.7800  -19.6000
            5   C1x C    23.5900  -17.5000
            6   C1a C    24.7800  -16.8000
            7   C1x C    27.1600  -19.6000
            8   C1a C    28.3500  -18.9000
            9   C1y C    23.5900  -20.2300
            10  C1y C    22.4000  -18.2000
            11  C1z C    22.4000  -19.5300
            12  C1x C    23.5900  -21.5600
            13  O1a O    21.2800  -17.5000
            14  C1z C    21.2100  -20.2300
            15  X   Cl   22.4000  -20.9300
            16  C1x C    22.4000  -22.2600
            17  C2y C    21.2100  -21.5600
            18  C2x C    20.0900  -19.5300
            19  C1a C    21.2100  -18.8300
            20  C2x C    20.0900  -22.2600
            21  C2x C    18.9000  -20.2300
            22  C5x C    18.9000  -21.5600
            23  O5x O    17.7100  -22.2600
            24  O1a O    27.3223  -17.2077
            25  C5a C    25.9700  -16.1700
            26  C1b C    27.1824  -15.4700
            27  O5a O    24.7576  -15.4700
            28  O1a O    28.3779  -16.1604
BOND        31
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 1
            5     2   6 1 #Up
            6     3   7 1
            7     3   8 1 #Up
            8     4   9 1
            9     5  10 1
            10    9  11 1
            11    9  12 1
            12   10  13 1 #Up
            13   11  14 1
            14   11  15 1 #Down
            15   12  16 1
            16   14  17 1
            17   14  18 1
            18   14  19 1 #Up
            19   17  20 2
            20   18  21 2
            21   20  22 1
            22   22  23 2
            23    4   7 1
            24   10  11 1
            25   16  17 1
            26   21  22 1
            27    1  24 1 #Down
            28    1  25 1 #Up
            29   25  26 1
            30   25  27 2
            31   26  28 1

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