KEGG   DRUG: EtoposideHelp
Entry
D00125                      Drug                                   

Name
Etoposide (JP17/USP/INN);
Vepesid (TN)
Product
  Generic
Formula
C29H32O13
Exact mass
588.1843
Mol weight
588.5566
Structure
Mol fileKCF fileDB searchJmolKegDraw
Class
Other
 DG01529  Topoisomerase inhibitor
  DG01527  Topoisomerase II inhibitor
Cyp substrate
 DG01633  CYP3A4 substrate
Remark
Same as: 
Therapeutic category: 
ATC code: 
Chemical group: 
Activity
Antineoplastic
Comment
podophyllotoxin [DR:D05529] derivative
Target
topoisomerase II [HSA:7153 7155] [KO:K03164]
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Transporter: ABCC2 [HSA:1244]
Interaction
Drug interaction
Structure map
Antineoplastics - agents from natural products
Other map
Bile secretion
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01C PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
    L01CB Podophyllotoxin derivatives
     L01CB01 Etoposide
      D00125  Etoposide (JP17/USP/INN)
USP drug classification [BR:br08302]
 Antineoplastics
  Enzyme Inhibitors
   Etoposide
    D00125  Etoposide (JP17/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  42  Antineoplastics
   424  Plant extract preparations
    4240  Plant extract preparations
     D00125  Etoposide (JP17/USP/INN)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Isomerases
   topoisomerase II
    Etoposide
     D00125  Etoposide (JP17/USP/INN)
Cytochrome P450 interactions [BR:br08309]
 CYP substrates
  CYP3A4
   Etoposide
    D00125  Etoposide (JP17/USP/INN)
 Transporter substrates
  ABCC2
   Etoposide
    D00125  Etoposide (JP17/USP/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00125  Etoposide
Phytochemicals used as drugs [BR:br08306]
 Phenylpropanoids and related compounds
  Lignans
   Lignans
    D00125  Etoposide (JP15/USP/INN)
Antineoplastics [br08340.html]
 D00125
BRITE hierarchy
Other DBs
CAS: 
33419-42-0
PubChem: 
DrugBank: 
PDB-CCD: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        42
            1   C8y C    27.7309  -19.0593
            2   C8y C    27.7309  -20.4607
            3   C8x C    28.9445  -21.1614
            4   C8y C    30.1582  -20.4607
            5   C8y C    30.1582  -19.0593
            6   C8x C    28.9445  -18.3586
            7   C1y C    31.3718  -21.1614
            8   C1y C    32.5854  -20.4607
            9   C1y C    32.5854  -19.0593
            10  C1y C    31.3718  -18.3586
            11  O2x O    26.3980  -18.6263
            12  C1x C    25.5743  -19.7600
            13  O2x O    26.3980  -20.8938
            14  C7x C    33.9182  -20.8938
            15  O7x O    34.7420  -19.7600
            16  C1x C    33.9182  -18.6263
            17  O6a O    34.3454  -22.2089
            18  C8y C    31.3718  -22.5628
            19  C8x C    30.1602  -23.2623
            20  C8y C    30.1602  -24.6637
            21  C8y C    31.3738  -25.3644
            22  C8y C    32.5854  -24.6649
            23  C8x C    32.5854  -23.2635
            24  O2a O    28.9635  -25.3548
            25  O2a O    33.7842  -25.3571
            26  C1a C    34.9737  -24.6704
            27  C1a C    27.7760  -24.6693
            28  O1a O    31.3738  -26.7670
            29  O2a O    31.3718  -16.9572
            30  C1y C    30.1602  -16.2577
            31  C1y C    30.1602  -14.8553
            32  C1y C    28.9465  -14.1546
            33  C1y C    27.7329  -14.8553
            34  C1y C    27.7329  -16.2577
            35  O2x O    28.9466  -16.9584
            36  O2x O    26.5192  -14.1546
            37  C1y C    25.3055  -14.8553
            38  O2x O    25.3055  -16.2577
            39  C1x C    26.5192  -16.9584
            40  O1a O    28.9465  -12.7532
            41  C1a C    24.0716  -14.1427
            42  O1a O    31.3911  -14.1444
BOND        48
            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    1  11 1
            13   11  12 1
            14   12  13 1
            15    2  13 1
            16    8  14 1
            17   14  15 1
            18   15  16 1
            19    9  16 1
            20   14  17 2
            21    7  18 1 #Down
            22   18  19 2
            23   19  20 1
            24   20  21 2
            25   21  22 1
            26   22  23 2
            27   18  23 1
            28   20  24 1
            29   22  25 1
            30   25  26 1
            31   24  27 1
            32   21  28 1
            33   10  29 1 #Up
            34   30  29 1 #Down
            35   30  31 1
            36   31  32 1
            37   32  33 1
            38   33  34 1
            39   34  35 1
            40   30  35 1
            41   33  36 1
            42   36  37 1
            43   37  38 1
            44   38  39 1
            45   34  39 1
            46   32  40 1 #Down
            47   37  41 1 #Up
            48   31  42 1 #Up

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