KEGG   DRUG: FluticasoneHelp
Entry
D07981                      Drug                                   

Name
Fluticasone (INN);
Fluticaps (TN)
Formula
C22H27F3O4S
Exact mass
444.1582
Mol weight
444.5076
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Remark
Same as: C07815
ATC code: D07AC17 R01AD08 R03BA05
Chemical structure group: DG00420
Product (DG00420): D01708<JP/US> D06315<JP/US>
Efficacy
Anti-inflammatory, Glucocorticoid receptor agonist
Target
NR3C1 (GR) [HSA:2908] [KO:K05771]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Interaction
Drug interaction
Structure map
map07225  Glucocorticoid and mineralocorticoid receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D07 CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
   D07A CORTICOSTEROIDS, PLAIN
    D07AC Corticosteroids, potent (group III)
     D07AC17 Fluticasone
      D07981  Fluticasone (INN)
 R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01A DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
    R01AD Corticosteroids
     R01AD08 Fluticasone
      D07981  Fluticasone (INN)
  R03 DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
   R03B OTHER DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES, INHALANTS
    R03BA Glucocorticoids
     R03BA05 Fluticasone
      D07981  Fluticasone (INN)
USP drug classification [BR:br08302]
 Hormonal Agents, Stimulant/Replacement/Modifying (Adrenal)
  Fluticasone
   D07981  Fluticasone (INN)
 Respiratory Tract/Pulmonary Agents
  Anti-inflammatories, Inhaled Corticosteroids
   Fluticasone
    D07981  Fluticasone (INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D07981  Fluticasone (INN)
BRITE hierarchy
Other DBs
CAS: 90566-53-3
PubChem: 96024676
ChEBI: 5134
ChEMBL: CHEMBL1201396
LigandBox: D07981
NIKKAJI: J22.755B
LinkDB All DBs
KCF data Show

ATOM        30
            1   C2x C    19.5739  -28.3860
            2   C5x C    19.5739  -29.7339
            3   C2x C    20.7799  -30.4434
            4   C2y C    21.9150  -29.7339
            5   C1z C    21.9150  -28.3860
            6   C2x C    20.7799  -27.7475
            7   C1y C    23.1211  -30.4434
            8   C1x C    24.3271  -29.7339
            9   C1y C    24.3271  -28.3860
            10  C1z C    23.1211  -27.7475
            11  C1y C    25.3913  -27.7475
            12  C1z C    25.3913  -26.3996
            13  C1x C    24.3271  -25.6901
            14  C1y C    23.1211  -26.3996
            15  C1x C    27.7324  -27.7475
            16  C1y C    27.7324  -26.3996
            17  C1z C    26.5264  -25.6901
            18  O5x O    18.4388  -30.4434
            19  C1a C    21.9150  -27.0381
            20  X   F    23.1211  -29.0245
            21  O1a O    21.9150  -25.6901
            22  C1a C    25.3913  -24.9807
            23  O1a O    27.9452  -24.7679
            24  C1a C    29.1513  -26.3996
            25  X   F    23.1211  -31.8622
            26  C5a C    26.5264  -24.2713
            27  O5a O    27.7551  -23.5618
            28  S2a S    25.2976  -23.5618
            29  C1b C    24.0860  -24.2615
            30  X   F    22.8826  -23.5668
BOND        33
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   10  14 1
            17   11  15 1
            18   15  16 1
            19   16  17 1
            20   12  17 1
            21    2  18 2
            22    5  19 1 #Up
            23   10  20 1 #Down
            24   14  21 1 #Up
            25   12  22 1 #Up
            26   17  23 1 #Down
            27   16  24 1 #Down
            28    7  25 1 #Down
            29   17  26 1 #Up
            30   26  27 2
            31   26  28 1
            32   28  29 1
            33   29  30 1

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