KEGG   DRUG: D08224Help
Entry
D08224                      Drug                                   

Name
Mitoxantrone (INN);
Misostol (TN)
Formula
C22H28N4O6
Exact mass
444.2009
Mol weight
444.4809
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antineoplastic, antimetabolite
Remark
Same as: 
ATC code: 
Drug group: 
Comment
anthraquinone derivative
Target
topoisomerase II inhibitor [HSA:7153 7155] [KO:K03164]
Metabolism
Transporter: ABCG2 [HSA:9429], 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
   L01D CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
    L01DB Anthracyclines and related substances
     L01DB07 Mitoxantrone
      D08224  Mitoxantrone (INN)
USP drug classification [BR:br08302]
 Antineoplastics
  Antineoplastics, Other
   Mitoxantrone
    D08224  Mitoxantrone (INN)
 Central Nervous System Agents
  Multiple Sclerosis Agents
   Mitoxantrone
    D08224  Mitoxantrone (INN)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Isomerases
   topoisomerase II
    Mitoxantrone
     D08224  Mitoxantrone (INN)
Antineoplastics [BR:br08308]
 Natural products
  Antibiotics
   Mitoxantrone
    D08224  Mitoxantrone (INN)
BRITE hierarchy
Other DBs
CAS: 
65271-80-9
PubChem: 
DrugBank: 
PDB-CCD: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        32
            1   C8x C    19.0400  -21.4200
            2   C8x C    19.0400  -22.8200
            3   C8y C    20.2524  -23.5200
            4   C8y C    21.4649  -22.8200
            5   C8y C    21.4649  -21.4200
            6   C8y C    20.2524  -20.7200
            7   C5x C    22.6773  -23.5200
            8   C8y C    23.8897  -22.8200
            9   C8y C    23.8897  -21.4200
            10  C5x C    22.6773  -20.7200
            11  C8y C    25.1022  -23.5200
            12  C8x C    26.3146  -22.8200
            13  C8x C    26.3146  -21.4200
            14  C8y C    25.1022  -20.7200
            15  N1b N    25.1022  -24.9197
            16  N1b N    25.1022  -19.3203
            17  O5x O    22.6773  -19.3200
            18  O5x O    22.6773  -24.9200
            19  O1a O    20.2524  -24.9198
            20  O1a O    20.2524  -19.3202
            21  C1b C    26.3354  -18.6080
            22  C1b C    27.5415  -19.3041
            23  N1b N    28.7233  -18.6216
            24  C1b C    29.9176  -19.3110
            25  C1b C    31.1054  -18.6251
            26  O1a O    32.2966  -19.3128
            27  C1b C    26.3354  -25.6320
            28  C1b C    27.5415  -24.9359
            29  N1b N    28.7233  -25.6184
            30  C1b C    29.9176  -24.9290
            31  C1b C    31.1054  -25.6149
            32  O1a O    32.2966  -24.9272
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 2
            10    9  10 1
            11    5  10 1
            12    8  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16    9  14 1
            17   11  15 1
            18   14  16 1
            19   10  17 2
            20    7  18 2
            21    3  19 1
            22    6  20 1
            23   16  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   25  26 1
            29   15  27 1
            30   27  28 1
            31   28  29 1
            32   29  30 1
            33   30  31 1
            34   31  32 1

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