KEGG   DRUG: TixocortolHelp
Entry
D08610                      Drug                                   

Name
Tixocortol (INN)
Formula
C21H30O4S
Exact mass
378.1865
Mol weight
378.5255
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Remark
ATC code: A07EA05 R01AD07
Chemical structure group: DG00096
Efficacy
Anti-inflammatory, Glucocorticoid receptor agonist
Target
NR3C1 (GR) [HSA:2908] [KO:K05771]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Drug interaction
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
     A07EA05 Tixocortol
      D08610  Tixocortol (INN)
 R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01A DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
    R01AD Corticosteroids
     R01AD07 Tixocortol
      D08610  Tixocortol (INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D08610  Tixocortol (INN)
BRITE hierarchy
Other DBs
CAS: 61951-99-3
PubChem: 96025294
ChEBI: 63560
LigandBox: D08610
NIKKAJI: J18.528K
LinkDB All DBs
KCF data Show

ATOM        26
            1   C1x C    14.4678  -17.5792
            2   C5x C    14.4678  -18.9494
            3   C2x C    15.6544  -19.6345
            4   C2y C    16.8411  -18.9494
            5   C1z C    16.8411  -17.5792
            6   C1x C    15.6544  -16.8941
            7   C1x C    18.0277  -19.6345
            8   C1x C    19.2143  -18.9494
            9   C1y C    19.2143  -17.5792
            10  C1y C    18.0277  -16.8941
            11  C1y C    20.4011  -16.8941
            12  C1z C    20.4011  -15.5238
            13  C1x C    19.2143  -14.8387
            14  C1y C    18.0277  -15.5238
            15  C1x C    22.7743  -16.8941
            16  C1x C    22.7743  -15.5238
            17  C1z C    21.5877  -14.8387
            18  O5x O    13.2812  -19.6345
            19  C5a C    21.5877  -13.4685
            20  C1b C    22.7783  -12.7811
            21  O5a O    20.4050  -12.7856
            22  S1a S    23.9503  -13.4579
            23  O1a O    22.7743  -14.2906
            24  O1a O    16.8411  -14.8387
            25  C1a C    16.8411  -16.2089
            26  C1a C    20.4011  -14.1238
BOND        29
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 1
            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   17  19 1 #Up
            23   19  20 1
            24   19  21 2
            25   20  22 1
            26   17  23 1 #Down
            27   14  24 1 #Up
            28    5  25 1 #Up
            29   12  26 1 #Up

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