KEGG   DRUG: D03941Help
Entry
D03941                      Drug                                   

Name
Edaglitazone sodium (USAN)
Formula
C24H19N2O4S2. Na
Exact mass
486.0684
Mol weight
486.5384
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of type 2 diabetes
Target
peroxisome proliferator-activated receptor (PPAR) gamma agonist [HSA:5468] [KO:K08530]
  Pathway
hsa03320  PPAR signaling pathway  
 
Brite
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Thyroid hormone like receptors
   Peroxisome proliferator-activated receptor (PPAR)
    peroxisome proliferator-activated receptor (PPAR) gamma
     Edaglitazone
      D03941  Edaglitazone sodium (USAN)
BRITE hierarchy
Other DBs
CAS: 
369631-81-2
PubChem: 
LigandBox: 
KCF data Show

ATOM        33
            1   C1y C    33.8533  -21.0740
            2   C5x C    33.8533  -22.4863
            3   N1x N    35.1949  -22.9099 #-
            4   C5x C    36.0423  -21.7801
            5   S2x S    35.1949  -20.6503
            6   O5x O    37.4545  -21.7801
            7   O5x O    32.7234  -23.3336
            8   C1b C    32.6528  -20.3679
            9   C8y C    31.4524  -21.0740
            10  C8y C    30.2236  -20.3779
            11  C8y C    29.0770  -21.0939
            12  C8y C    29.0179  -22.5061
            13  C8x C    30.2466  -23.2023
            14  C8x C    31.4639  -22.4863
            15  O2a O    27.8172  -23.1725
            16  C1b C    26.6400  -22.4661
            17  C1b C    25.4050  -23.1515
            18  C8y C    24.1622  -22.4062
            19  C8y C    24.2037  -21.0036
            20  O2x O    22.8840  -20.5325
            21  C8y C    22.0282  -21.6419
            22  N5x N    22.8188  -22.7987
            23  C1a C    25.3532  -20.2184
            24  C8y C    20.6491  -21.6728
            25  C8x C    19.9003  -20.4412
            26  C8x C    18.4884  -20.4732
            27  C8x C    17.8101  -21.7118
            28  C8x C    18.5589  -22.9435
            29  C8x C    19.9708  -22.9116
            30  S2x S    29.8970  -19.0660
            31  C8x C    28.5484  -18.9713
            32  C8x C    28.0417  -20.2246
            33  Z   Na   36.1200  -24.2900 #+
BOND        36
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     4   6 2
            7     2   7 2
            8     8   1 1
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 2
            15    9  14 1
            16   12  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 2
            21   19  20 1
            22   20  21 1
            23   21  22 2
            24   18  22 1
            25   19  23 1
            26   21  24 1
            27   24  25 2
            28   25  26 1
            29   26  27 2
            30   27  28 1
            31   28  29 2
            32   24  29 1
            33   10  30 1
            34   30  31 1
            35   31  32 2
            36   11  32 1

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