KEGG   DRUG: TroglitazoneHelp
Entry
D00395                      Drug                                   

Name
Troglitazone (JAN/USAN/INN);
Rezulin (TN)
Formula
C24H27NO5S
Exact mass
441.161
Mol weight
441.5399
Structure
Mol fileKCF fileDB searchJmolKegDraw
Class
Antidiabetic agent
 DG01685  Insulin sensitizer
  DG01795  PPAR gamma agonist
   DG01683  Thiazolidinedione
Other
 DG01733  PPAR agonist
  DG01683  Thiazolidinedione
Cyp inducer
 DG01635  CYP3A4 inducer
 DG01897  CYP3A5 inducer
Remark
ATC code: 
Activity
Antidiabetic
Comment
hepatotoxicity
Target
NR1C3 (PPARG) [HSA:5468] [KO:K08530]
  Pathway
PPAR signaling pathway
Interaction
CYP induction: CYP3A4 [HSA:1576], CYP3A5 [HSA:1577], CYP3A7 [HSA:1551]
Drug interaction
Structure map
Antidiabetics
Peroxisome proliferator-activated receptor (PPAR) agonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A10 DRUGS USED IN DIABETES
   A10B BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
    A10BG Thiazolidinediones
     A10BG01 Troglitazone
      D00395  Troglitazone (JAN/USAN/INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Thyroid hormone like receptors
   Peroxisome proliferator-activated receptor (PPAR)
    peroxisome proliferator-activated receptor (PPAR) gamma
     Troglitazone
      D00395  Troglitazone (JAN/USAN/INN)
Cytochrome P450 interactions [BR:br08309]
 CYP inducers
  CYP3A5
   Troglitazone
    D00395  Troglitazone (JAN/USAN/INN)
  CYP3A7
   Troglitazone
    D00395  Troglitazone (JAN/USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
97322-87-7
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        31
            1   C8y C    14.4237  -16.8030
            2   C8y C    14.4237  -18.2037
            3   C8y C    15.6367  -18.9040
            4   C8y C    16.8497  -18.2037
            5   C8y C    16.8497  -16.8030
            6   C8y C    15.6367  -16.1027
            7   C1x C    18.0627  -18.9040
            8   C1x C    19.2757  -18.2037
            9   C1z C    19.2757  -16.8030
            10  O2x O    18.0627  -16.1027
            11  O2a O    21.7017  -16.8030
            12  C1b C    20.4887  -16.1027
            13  C8y C    22.9147  -16.1027
            14  C8x C    22.9147  -14.7020
            15  C8x C    24.1277  -16.8030
            16  C8x C    25.3407  -16.1027
            17  C8y C    25.3407  -14.7020
            18  C8x C    24.1277  -14.0017
            19  O5x O    26.5538  -16.8030
            20  C5x C    27.7668  -16.1027
            21  C1y C    27.7668  -14.7020
            22  C1b C    26.5538  -14.0017
            23  N1x N    29.0989  -16.5355
            24  C5x C    29.9222  -15.4024
            25  S2x S    29.0989  -14.2692
            26  C1a C    15.6367  -14.7022
            27  C1a C    13.2107  -16.1027
            28  O1a O    13.2107  -18.9040
            29  C1a C    15.6367  -20.3045
            30  O5x O    31.3016  -15.4024
            31  C1a C    20.4881  -17.5030
BOND        34
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            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   11  12 1
            13    9  12 1
            14   11  13 1
            15   13  14 2
            16   13  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 2
            20   14  18 1
            21   19  20 2
            22   20  21 1
            23   21  22 1
            24   17  22 1
            25   20  23 1
            26   23  24 1
            27   24  25 1
            28   21  25 1
            29    6  26 1
            30    1  27 1
            31    2  28 1
            32    3  29 1
            33   24  30 2
            34    9  31 1

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