KEGG   DRUG: Canfosfamide hydrochloride
Entry
D03351                      Drug                                   
Name
Canfosfamide hydrochloride (USAN);
Telcyta (TN)
Formula
C26H40Cl4N5O10PS. HCl
Exact mass
821.0754
Mol weight
823.935
Structure
Class
Antineoplastic
 DG01677  Alkylating agent
  DG01678  Nitrogen mustard analog
   DG01720  Isophosphoramide mustard analog
Efficacy
Antineoplastic, Alkylating agent
Target
DNA
Interaction
Brite
Drug groups [BR:br08330]
 Antineoplastic
  DG01677  Alkylating agent
   DG01678  Nitrogen mustard analog
    DG01720  Isophosphoramide mustard analog
     D03351  Canfosfamide hydrochloride
Other DBs
CAS: 439943-59-6
PubChem: 47205829
LigandBox: D03351
LinkDB
KCF data

ATOM        48
            1   C1c C    17.9703  -13.8819
            2   C8y C    19.1667  -13.1909
            3   C6a C    16.7320  -13.1671
            4   O6a O    15.5311  -13.8607
            5   O6a O     8.3912  -18.3901
            6   C6a C     9.5886  -17.6987
            7   C1c C    10.7864  -18.3901
            8   C1b C    11.9838  -17.6987
            9   C1b C    13.1814  -18.3901
            10  C5a C    14.3790  -17.6987
            11  N1b N    15.5765  -18.3901
            12  C1c C    16.7740  -17.6987
            13  C1b C    17.9716  -18.3901
            14  S4a S    19.1691  -17.6987
            15  C1b C    20.3667  -18.3901
            16  C1b C    21.5642  -17.6987
            17  O2b O    22.7616  -18.3901
            18  O6a O     9.5886  -16.3160
            19  N1a N    10.7864  -19.7726
            20  O5a O    14.3790  -16.3161
            21  C5a C    16.7735  -15.9748
            22  O5a O    15.5433  -15.2650
            23  N1b N    17.9703  -15.2831
            24  C8x C    20.3475  -13.8722
            25  C8x C    21.5608  -13.1714
            26  C8x C    21.5605  -11.7701
            27  C8x C    20.3797  -11.0887
            28  C8x C    19.1664  -11.7896
            29  O6a O    16.7320  -11.7710
            30  P1a P    24.0011  -17.6750
            31  O3c O    20.1598  -16.7078
            32  O3c O    18.1782  -16.7078
            33  N1c N    25.2146  -16.9744
            34  N1c N    24.6845  -18.8602
            35  O3b O    23.2847  -16.4327
            36  C1b C    26.0697  -18.8608
            37  C1b C    23.9850  -20.0704
            38  C1b C    26.7640  -20.0643
            39  X   Cl   28.1713  -20.0650
            40  C1b C    22.5671  -20.0701
            41  X   Cl   21.8797  -21.2595
            42  C1b C    26.4306  -17.6765
            43  C1b C    27.6448  -16.9754
            44  C1b C    25.2144  -15.5544
            45  X   Cl   28.8244  -17.6565
            46  C1b C    26.4388  -14.8472
            47  X   Cl   26.4386  -13.4525
            48  X   Cl   10.3759  -13.5225
BOND        47
            1     1   2 1
            2     1   3 1
            3     3   4 1
            4     5   6 1
            5     6   7 1
            6     7   8 1
            7     8   9 1
            8     9  10 1
            9    10  11 1
            10   11  12 1
            11   12  13 1
            12   13  14 1
            13   14  15 1
            14   15  16 1
            15   16  17 1
            16    6  18 2
            17    7  19 1 #Down
            18   10  20 2
            19   12  21 1 #Down
            20   21  22 2
            21   21  23 1
            22    1  23 1 #Up
            23    2  24 2
            24   24  25 1
            25   25  26 2
            26   26  27 1
            27   27  28 2
            28    2  28 1
            29    3  29 2
            30   17  30 1
            31   14  31 2
            32   14  32 2
            33   30  33 1
            34   30  34 1
            35   30  35 2
            36   34  36 1
            37   34  37 1
            38   36  38 1
            39   38  39 1
            40   37  40 1
            41   40  41 1
            42   33  42 1
            43   42  43 1
            44   33  44 1
            45   43  45 1
            46   44  46 1
            47   46  47 1

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