KEGG   DRUG: Dexamethasone metasulfobenzoate sodium
Entry
D01510                      Drug                                   
Name
Dexamethasone metasulfobenzoate sodium (JAN);
Dexamethazone metasulfobenzoate sodium;
Dexapos;
Santeson (TN)
Formula
C29H32FO9S. Na
Exact mass
598.1649
Mol weight
598.6122
Structure
Simcomp
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Metabolizing enzyme substrate
 DG01633  CYP3A/CYP3A4 substrate
  DG02913  CYP3A4 substrate
Metabolizing enzyme inducer
 DG02853  CYP3A/CYP3A4 inducer
  DG01635  CYP3A4 inducer
Remark
Same as: C12961
Therapeutic category: 1315 1329
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
      D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
 C CARDIOVASCULAR SYSTEM
  C05 VASOPROTECTIVES
   C05A AGENTS FOR TREATMENT OF HEMORRHOIDS AND ANAL FISSURES FOR TOPICAL USE
    C05AA Corticosteroids
     C05AA09 Dexamethasone
      D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
 D DERMATOLOGICALS
  D07 CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
   D07A CORTICOSTEROIDS, PLAIN
    D07AB Corticosteroids, moderately potent (group II)
     D07AB19 Dexamethasone
      D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
   D07X CORTICOSTEROIDS, OTHER COMBINATIONS
    D07XB Corticosteroids, moderately potent, other combinations
     D07XB05 Dexamethasone
      D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
  D10 ANTI-ACNE PREPARATIONS
   D10A ANTI-ACNE PREPARATIONS FOR TOPICAL USE
    D10AA Corticosteroids, combinations for treatment of acne
     D10AA03 Dexamethasone
      D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
 H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
  H02 CORTICOSTEROIDS FOR SYSTEMIC USE
   H02A CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
    H02AB Glucocorticoids
     H02AB02 Dexamethasone
      D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
 R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01A DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
    R01AD Corticosteroids
     R01AD03 Dexamethasone
      D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01B ANTIINFLAMMATORY AGENTS
    S01BA Corticosteroids, plain
     S01BA01 Dexamethasone
      D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
   S01C ANTIINFLAMMATORY AGENTS AND ANTIINFECTIVES IN COMBINATION
    S01CB Corticosteroids/antiinfectives/mydriatics in combination
     S01CB01 Dexamethasone
      D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
  S02 OTOLOGICALS
   S02B CORTICOSTEROIDS
    S02BA Corticosteroids
     S02BA06 Dexamethasone
      D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
  S03 OPHTHALMOLOGICAL AND OTOLOGICAL PREPARATIONS
   S03B CORTICOSTEROIDS
    S03BA Corticosteroids
     S03BA01 Dexamethasone
      D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
USP drug classification [BR:br08302]
 Ophthalmic Agents
  Ophthalmic Anti-inflammatories
   Glucocorticoids, Ophthalmic
    Dexamethasone
     D01510  Dexamethasone metasulfobenzoate sodium (JAN)
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  13  Agents affecting sensory organs
   131  Ophthalmic agents
    1315  Ophthalmic cortisones
     D01510  Dexamethasone metasulfobenzoate sodium (JAN)
   132  Otic and nasal agents
    1329  Others
     D01510  Dexamethasone metasulfobenzoate sodium (JAN)
Drug groups [BR:br08330]
 Anti-inflammatory
  DG01955  Corticosteroid
   DG02068  Glucocorticoid
    DG00011  Dexamethasone
     D01510  Dexamethasone metasulfobenzoate sodium
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG00011  Dexamethasone
     D01510  Dexamethasone metasulfobenzoate sodium
 Metabolizing enzyme inducer
  DG02853  CYP3A/CYP3A4 inducer
   DG01635  CYP3A4 inducer
    DG00011  Dexamethasone
     D01510  Dexamethasone metasulfobenzoate sodium
Drug classes [BR:br08332]
 Anti-inflammatory
  DG01955  Corticosteroid
   D01510  Dexamethasone metasulfobenzoate sodium
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D01510  Dexamethasone metasulfobenzoate sodium (JAN) <JP>
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D01510
Drug groups [BR:br08330]
 Anti-inflammatory
  DG01955  Corticosteroid
   DG02068  Glucocorticoid
    DG00011  Dexamethasone
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG00011  Dexamethasone
 Metabolizing enzyme inducer
  DG02853  CYP3A/CYP3A4 inducer
   DG01635  CYP3A4 inducer
    DG00011  Dexamethasone
Other DBs
CAS: 3936-02-5
PubChem: 7848573
ChEBI: 32132
LigandBox: D01510
NIKKAJI: J217.774I
KCF data

ATOM        41
            1   Z   Na   24.7006  -23.8099 #+
            2   C2x C     8.3300  -30.9400
            3   C5x C     8.3300  -32.2700
            4   C2x C     9.4500  -32.9700
            5   C2y C    10.6400  -32.2700
            6   C1z C    10.6400  -30.9400
            7   C2x C     9.4500  -30.3100
            8   C1x C    11.7600  -32.9700
            9   C1x C    12.9500  -32.2700
            10  C1y C    12.9500  -30.9400
            11  C1z C    11.7600  -30.3100
            12  C1y C    14.0700  -30.3100
            13  C1z C    14.0700  -28.9800
            14  C1x C    12.9500  -28.2800
            15  C1y C    11.7600  -28.9800
            16  C1x C    16.3800  -30.3100
            17  C1y C    16.3800  -28.9800
            18  C1z C    15.2600  -28.2800
            19  C1a C    10.6400  -29.6100
            20  O1a O    10.6400  -28.2800
            21  C1a C    14.0700  -27.6500
            22  C1a C    17.5700  -28.2800
            23  X   F    11.7600  -31.6400
            24  O1a O    16.2400  -27.3000
            25  O5x O     7.1400  -32.9700
            26  C5a C    15.2387  -26.8802
            27  O5a O    14.0320  -26.2076
            28  C1b C    16.4560  -26.1523
            29  O7a O    17.6860  -26.8374
            30  C7a C    18.9174  -26.1013
            31  C8y C    20.1306  -26.7776
            32  O6a O    18.8962  -24.7100
            33  C8x C    21.3390  -26.0551
            34  C8y C    22.5639  -26.7375
            35  C8x C    20.1517  -28.2100
            36  C8x C    22.5854  -28.1393
            37  C8x C    21.4017  -28.8472
            38  S4a S    23.7467  -26.0301
            39  O1d O    24.4231  -27.2564
            40  O1d O    23.1004  -24.7896
            41  O1d O    24.9409  -25.3373 #-
BOND        44
            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   12  16 1
            18   16  17 1
            19   17  18 1
            20   13  18 1
            21    6  19 1 #Up
            22   15  20 1 #Up
            23   13  21 1 #Up
            24   17  22 1 #Down
            25   11  23 1 #Down
            26   18  24 1 #Down
            27    3  25 2
            28   18  26 1 #Up
            29   26  27 2
            30   26  28 1
            31   28  29 1
            32   29  30 1
            33   30  31 1
            34   30  32 2
            35   31  33 2
            36   33  34 1
            37   31  35 1
            38   34  36 2
            39   36  37 1
            40   37  35 2
            41   34  38 1
            42   38  39 2
            43   38  40 2
            44   38  41 1

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