KEGG   DRUG: Pixantrone dimaleate
Entry
D09654                      Drug                                   

Name
Pixantrone dimaleate (USAN);
Pixuvri (TN)
Formula
C17H19N5O2. (C4H4O4)2
Exact mass
557.1758
Mol weight
557.5094
Structure
Class
Antineoplastic
 DG01682  Anthracycline antineoplastic
 DG01727  Anthraquinone antineoplastic
Other
 DG01529  Topoisomerase inhibitor
  DG01527  Topoisomerase II inhibitor
Remark
ATC code: L01DB11
Chemical structure group: DG00704
Efficacy
Antineoplastic, Topoisomerase II inhibitor
Comment
anthraquinone derivative
Treatment of Non-Hodgkin's Lymphoma (NHL)
Target
TOP2 [HSA:7153 7155] [KO:K03164]
Interaction
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
     L01DB11 Pixantrone
      D09654  Pixantrone dimaleate (USAN)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Isomerases (EC5)
   DNA topoisomerase
    TOP2
     D09654  Pixantrone dimaleate (USAN)
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D09654
Other DBs
CAS: 144675-97-8
PubChem: 124490394
ChEMBL: CHEMBL2103844
LigandBox: D09654
LinkDB
KCF data

ATOM        40
            1   N5x N    16.1893  -25.1785
            2   C8x C    16.1893  -26.5695
            3   C8x C    17.3717  -27.2650
            4   C8y C    18.6236  -26.5695
            5   C8y C    18.6236  -25.1785
            6   C8x C    17.3717  -24.4830
            7   C5x C    19.8060  -27.2650
            8   C8y C    20.9884  -26.5695
            9   C8y C    20.9884  -25.1785
            10  C5x C    19.8060  -24.4830
            11  C8y C    22.2403  -27.2650
            12  C8x C    23.4227  -26.5695
            13  C8x C    23.4227  -25.1785
            14  C8y C    22.2403  -24.4830
            15  O5x O    19.8060  -23.0920
            16  O5x O    19.8060  -28.6561
            17  N1b N    22.2403  -23.0920
            18  C1b C    23.4227  -22.3964
            19  N1b N    22.2403  -28.6561
            20  C1b C    23.4227  -29.4211
            21  C1b C    24.6746  -28.7256
            22  N1a N    25.8570  -29.3516
            23  C1b C    24.6746  -23.0920
            24  N1a N    25.8570  -22.3964
            25  C2b C    30.5959  -24.6916
            26  C2b C    28.9266  -24.6916
            27  C6a C    28.2311  -25.8963
            28  O6a O    28.9266  -27.1010
            29  O6a O    30.5959  -27.1010
            30  C6a C    31.2914  -25.8963
            31  O6a O    26.8403  -25.8963
            32  O6a O    32.6822  -25.8963
            33  C2b C    30.5959  -24.6916
            34  C2b C    28.9266  -24.6916
            35  C6a C    28.2311  -25.8963
            36  O6a O    28.9266  -27.1010
            37  O6a O    26.8403  -25.8963
            38  C6a C    31.2914  -25.8963
            39  O6a O    30.5959  -27.1010
            40  O6a O    32.6822  -25.8963
BOND        40
            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    8  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16    9  14 2
            17   10  15 2
            18    7  16 2
            19   14  17 1
            20   17  18 1
            21   11  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 1
            25   18  23 1
            26   23  24 1
            27   25  26 2
            28   26  27 1
            29   27  28 2
            30   29  30 1
            31   25  30 1
            32   27  31 1
            33   30  32 2
            34   33  34 2
            35   34  35 1
            36   35  36 2
            37   39  38 1
            38   33  38 1
            39   35  37 1
            40   38  40 2
BRACKET     1    25.6900  -27.7900   25.6900  -23.9400
            1    33.4600  -23.9400   33.4600  -27.7900
            1  2
 ORIGINAL  1   25  26  27  28  31  30  29  32
 REPEAT    1   33  34  35  36  37  38  39  40

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