KEGG   DRUG: Prednisolone steaglate
Entry
D08415                      Drug                                   

Name
Prednisolone steaglate (BAN);
Prednisolone 21-steaglate;
Sintisone (TN)
Formula
C41H64O8
Exact mass
684.4601
Mol weight
684.9421
Structure
Simcomp
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Remark
ATC code: A07EA01 C05AA04 D07AA03 D07XA02 H02AB06 R01AD02 S01BA04 S01CB02 S02BA03 S03BA02
Chemical structure group: DG00093
Product (DG00093): D00472<JP/US> D00980<JP/US> D00981<JP/US> D01239<JP> D03301<JP>
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
     A07EA01 Prednisolone
      D08415  Prednisolone steaglate (BAN)
 C CARDIOVASCULAR SYSTEM
  C05 VASOPROTECTIVES
   C05A AGENTS FOR TREATMENT OF HEMORRHOIDS AND ANAL FISSURES FOR TOPICAL USE
    C05AA Corticosteroids
     C05AA04 Prednisolone
      D08415  Prednisolone steaglate (BAN)
 D DERMATOLOGICALS
  D07 CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
   D07A CORTICOSTEROIDS, PLAIN
    D07AA Corticosteroids, weak (group I)
     D07AA03 Prednisolone
      D08415  Prednisolone steaglate (BAN)
   D07X CORTICOSTEROIDS, OTHER COMBINATIONS
    D07XA Corticosteroids, weak, other combinations
     D07XA02 Prednisolone
      D08415  Prednisolone steaglate (BAN)
 H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
  H02 CORTICOSTEROIDS FOR SYSTEMIC USE
   H02A CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
    H02AB Glucocorticoids
     H02AB06 Prednisolone
      D08415  Prednisolone steaglate (BAN)
 R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01A DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
    R01AD Corticosteroids
     R01AD02 Prednisolone
      D08415  Prednisolone steaglate (BAN)
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01B ANTIINFLAMMATORY AGENTS
    S01BA Corticosteroids, plain
     S01BA04 Prednisolone
      D08415  Prednisolone steaglate (BAN)
   S01C ANTIINFLAMMATORY AGENTS AND ANTIINFECTIVES IN COMBINATION
    S01CB Corticosteroids/antiinfectives/mydriatics in combination
     S01CB02 Prednisolone
      D08415  Prednisolone steaglate (BAN)
  S02 OTOLOGICALS
   S02B CORTICOSTEROIDS
    S02BA Corticosteroids
     S02BA03 Prednisolone
      D08415  Prednisolone steaglate (BAN)
  S03 OPHTHALMOLOGICAL AND OTOLOGICAL PREPARATIONS
   S03B CORTICOSTEROIDS
    S03BA Corticosteroids
     S03BA02 Prednisolone
      D08415  Prednisolone steaglate (BAN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D08415  Prednisolone steaglate (BAN)
Other DBs
CAS: 5060-55-9
PubChem: 96025101
ChEMBL: CHEMBL2105774
LigandBox: D08415
NIKKAJI: J203.273B
LinkDB
KCF data

ATOM        49
            1   C2x C    11.2700  -19.9500
            2   C5x C    11.2700  -21.3500
            3   C2x C    12.3900  -21.9100
            4   C2y C    13.5800  -21.3500
            5   C1z C    13.5800  -19.9500
            6   C2x C    12.3900  -19.2500
            7   C1x C    14.7700  -21.9100
            8   C1x C    15.9600  -21.3500
            9   C1y C    15.9600  -19.9500
            10  C1y C    14.7700  -19.2500
            11  C1y C    17.1500  -19.2500
            12  C1z C    17.1500  -17.9200
            13  C1x C    15.9600  -17.2200
            14  C1y C    14.7700  -17.9200
            15  C1x C    19.4600  -19.2500
            16  C1x C    19.4600  -17.9200
            17  C1z C    18.3400  -17.2200
            18  O5x O    10.0800  -21.9100
            19  C1a C    13.5800  -18.6200
            20  O1a O    13.5800  -17.2200
            21  C1a C    17.1500  -16.5900
            22  C5a C    18.3400  -15.5400
            23  O1a O    19.4600  -16.5900
            24  C1b C    19.5300  -14.8400
            25  O5a O    17.1500  -14.8400
            26  O7a O    20.6500  -15.5400
            27  C7a C    21.9800  -14.8400
            28  O6a O    21.9800  -13.4400
            29  C1b C    23.2400  -15.5400
            30  C7a C    25.6200  -15.5400
            31  O7a O    24.4300  -14.8400
            32  O6a O    25.6200  -16.9400
            33  C1b C    26.8324  -14.8400
            34  C1b C    28.0449  -15.5400
            35  C1b C    29.2573  -14.8400
            36  C1b C    30.4697  -15.5400
            37  C1b C    31.6822  -14.8400
            38  C1b C    32.8946  -15.5400
            39  C1b C    34.1070  -14.8400
            40  C1b C    35.3195  -15.5400
            41  C1b C    36.5319  -14.8400
            42  C1b C    37.7444  -15.5400
            43  C1b C    38.9568  -14.8400
            44  C1b C    40.1692  -15.5400
            45  C1b C    41.3817  -14.8400
            46  C1b C    42.5941  -15.5400
            47  C1b C    43.8065  -14.8400
            48  C1b C    45.0190  -15.5400
            49  C1a C    46.2314  -14.8400
BOND        52
            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   14  20 1 #Up
            24   12  21 1 #Up
            25   17  22 1 #Up
            26   17  23 1 #Down
            27   22  24 1
            28   22  25 2
            29   24  26 1
            30   26  27 1
            31   27  28 2
            32   27  29 1
            33   30  31 1
            34   29  31 1
            35   30  32 2
            36   30  33 1
            37   33  34 1
            38   34  35 1
            39   35  36 1
            40   36  37 1
            41   37  38 1
            42   38  39 1
            43   39  40 1
            44   40  41 1
            45   41  42 1
            46   42  43 1
            47   43  44 1
            48   44  45 1
            49   45  46 1
            50   46  47 1
            51   47  48 1
            52   48  49 1

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