KEGG   DRUG: Dexamethasone sodium hemisulfate
Entry
D07798                      Drug                                   

Name
Dexamethasone sodium hemisulfate;
Dexamethasone 21-sodium sulfate;
Colircusi Dexametasona (TN)
Formula
C22H28FO8S. Na
Exact mass
494.1387
Mol weight
494.5061
Structure
Simcomp
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Metabolizing enzyme substrate
 DG02913  CYP3A4 substrate
Metabolizing enzyme inducer
 DG01635  CYP3A4 inducer
Remark
ATC code: A01AC02 C05AA09 D07AB19 D07XB05 D10AA03 H02AB02 R01AD03 S01BA01 S01CB01 S02BA06 S03BA01
Chemical structure group: DG00011
Product (DG00011): D00292<JP/US> D00975<JP/US> D01510<JP> D01615<JP> D01632<JP> D01948<JP> D07073<JP>
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
CYP induction: CYP3A4 [HSA:1576]
Structure map
map07225  Glucocorticoid and mineralocorticoid receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A01 STOMATOLOGICAL PREPARATIONS
   A01A STOMATOLOGICAL PREPARATIONS
    A01AC Corticosteroids for local oral treatment
     A01AC02 Dexamethasone
      D07798  Dexamethasone sodium hemisulfate
 C CARDIOVASCULAR SYSTEM
  C05 VASOPROTECTIVES
   C05A AGENTS FOR TREATMENT OF HEMORRHOIDS AND ANAL FISSURES FOR TOPICAL USE
    C05AA Corticosteroids
     C05AA09 Dexamethasone
      D07798  Dexamethasone sodium hemisulfate
 D DERMATOLOGICALS
  D07 CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
   D07A CORTICOSTEROIDS, PLAIN
    D07AB Corticosteroids, moderately potent (group II)
     D07AB19 Dexamethasone
      D07798  Dexamethasone sodium hemisulfate
   D07X CORTICOSTEROIDS, OTHER COMBINATIONS
    D07XB Corticosteroids, moderately potent, other combinations
     D07XB05 Dexamethasone
      D07798  Dexamethasone sodium hemisulfate
  D10 ANTI-ACNE PREPARATIONS
   D10A ANTI-ACNE PREPARATIONS FOR TOPICAL USE
    D10AA Corticosteroids, combinations for treatment of acne
     D10AA03 Dexamethasone
      D07798  Dexamethasone sodium hemisulfate
 H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
  H02 CORTICOSTEROIDS FOR SYSTEMIC USE
   H02A CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
    H02AB Glucocorticoids
     H02AB02 Dexamethasone
      D07798  Dexamethasone sodium hemisulfate
 R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01A DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
    R01AD Corticosteroids
     R01AD03 Dexamethasone
      D07798  Dexamethasone sodium hemisulfate
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01B ANTIINFLAMMATORY AGENTS
    S01BA Corticosteroids, plain
     S01BA01 Dexamethasone
      D07798  Dexamethasone sodium hemisulfate
   S01C ANTIINFLAMMATORY AGENTS AND ANTIINFECTIVES IN COMBINATION
    S01CB Corticosteroids/antiinfectives/mydriatics in combination
     S01CB01 Dexamethasone
      D07798  Dexamethasone sodium hemisulfate
  S02 OTOLOGICALS
   S02B CORTICOSTEROIDS
    S02BA Corticosteroids
     S02BA06 Dexamethasone
      D07798  Dexamethasone sodium hemisulfate
  S03 OPHTHALMOLOGICAL AND OTOLOGICAL PREPARATIONS
   S03B CORTICOSTEROIDS
    S03BA Corticosteroids
     S03BA01 Dexamethasone
      D07798  Dexamethasone sodium hemisulfate
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D07798  Dexamethasone sodium hemisulfate
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D07798
Other DBs
CAS: 466-11-5
PubChem: 96024495
LigandBox: D07798
NIKKAJI: J196.186A
LinkDB
KCF data

ATOM        33
            1   Z   Na   21.3933  -25.5423 #+
            2   C2x C    10.0800  -25.7600
            3   C5x C    10.0800  -27.0900
            4   C2x C    11.2700  -27.7900
            5   C2y C    12.4600  -27.0900
            6   C1z C    12.4600  -25.7600
            7   C2x C    11.2700  -25.1300
            8   C1x C    13.5800  -27.7900
            9   C1x C    14.7700  -27.0900
            10  C1y C    14.7700  -25.7600
            11  C1z C    13.5800  -25.1300
            12  C1y C    15.9600  -25.1300
            13  C1z C    15.9600  -23.7300
            14  C1x C    14.7700  -23.1000
            15  C1y C    13.5800  -23.7300
            16  C1x C    18.3400  -25.1300
            17  C1y C    18.3400  -23.7300
            18  C1z C    17.1500  -23.1000
            19  O1a O    18.1300  -22.1200
            20  X   F    13.5800  -26.3900
            21  O5x O     8.9600  -27.7900
            22  C1a C    15.9600  -22.4000
            23  C1a C    12.4600  -24.4300
            24  O1a O    12.6700  -22.8200
            25  C1a C    19.6700  -23.1700
            26  C5a C    17.1500  -21.2800
            27  O5a O    15.9600  -20.5800
            28  C1b C    18.3653  -20.5849
            29  O2a O    19.5537  -21.2777
            30  S4a S    20.7501  -20.5935
            31  O1d O    21.3876  -21.8106
            32  O1d O    20.1631  -19.2955
            33  O1d O    21.9891  -19.9890 #-
BOND        35
            1     2   3 1
            2     3   4 1
            3     4   5 2
            4     5   6 1
            5     6   7 1
            6     2   7 2
            7     5   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11    6  11 1
            12   10  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   11  15 1
            17   16  17 1
            18   17  18 1
            19   13  18 1
            20   18  19 1 #Down
            21   11  20 1 #Down
            22    3  21 2
            23   12  16 1
            24   13  22 1 #Up
            25    6  23 1 #Up
            26   15  24 1 #Up
            27   17  25 1 #Down
            28   26  27 2
            29   18  26 1 #Up
            30   26  28 1
            31   28  29 1
            32   29  30 1
            33   30  31 2
            34   30  32 2
            35   30  33 1

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