KEGG   DRUG: Tasidotin hydrochloride
Entry
D06009                      Drug                                   

Name
Tasidotin hydrochloride (USAN)
Formula
C32H58N6O5. HCl
Exact mass
642.4235
Mol weight
643.3011
Structure
Efficacy
Antineoplastic, Tubulin depolymerization inhibitor
Comment
Treatment of patients with advanced, refractory neoplasms (microtubule stabilizing agent)
Target
  Pathway
hsa04540  Gap junction
Brite
Target-based classification of drugs [BR:br08310]
 Not elsewhere classified
  Cellular process
   Cytoskeleton
    TUBB
     D06009  Tasidotin hydrochloride (USAN)
Other DBs
CAS: 623174-20-9
PubChem: 47207667
ChEMBL: CHEMBL2107376
LigandBox: D06009
LinkDB
KCF data

ATOM        44
            1   C1x C    37.9048  -12.6117
            2   C1x C    36.5889  -13.0272
            3   N1y N    36.5789  -14.4041
            4   C1y C    37.8862  -14.8444
            5   C1x C    38.7066  -13.7348
            6   C5a C    35.1930  -15.1326
            7   C5a C    38.3064  -16.1750
            8   N1b N    39.6536  -16.4730
            9   O5a O    37.3747  -17.1926
            10  O5a O    33.9926  -14.4417
            11  C1y C    35.1946  -16.5021
            12  N1y N    34.0727  -17.3126
            13  C1x C    34.5064  -18.6294
            14  C1x C    35.8882  -18.6277
            15  C1x C    36.3137  -17.3131
            16  C5a C    32.9099  -16.6413
            17  C1c C    31.7303  -17.3226
            18  O5a O    32.9098  -15.2631
            19  N1c N    30.5606  -16.6473
            20  C1c C    31.7302  -18.9883
            21  C1a C    30.5563  -19.6663
            22  C1a C    32.9462  -19.6906
            23  C5a C    29.3862  -17.3256
            24  C1a C    30.5604  -15.2631
            25  C1c C    28.2138  -16.6489
            26  O5a O    29.3863  -18.7123
            27  N1b N    27.0408  -17.3264
            28  C5a C    25.8678  -16.6493
            29  C1c C    24.6951  -17.3266
            30  O5a O    25.8675  -15.2632
            31  N1c N    23.5219  -16.6494
            32  C1a C    22.3492  -17.3266
            33  C1a C    23.5216  -15.2632
            34  C1c C    28.2135  -14.6421
            35  C1a C    27.0379  -13.9633
            36  C1a C    29.4280  -13.9408
            37  C1c C    24.6952  -18.7124
            38  C1a C    25.9093  -19.4136
            39  C1a C    23.5193  -19.3914
            40  C1d C    40.8561  -15.7928
            41  C1a C    42.0686  -15.0928
            42  C1a C    41.5682  -17.0392
            43  C1a C    40.1793  -14.6080
            44  X   Cl   40.7115  -19.3048
BOND        44
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     3   6 1
            7     4   7 1 #Up
            8     7   8 1
            9     7   9 2
            10    6  10 2
            11   11   6 1 #Down
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   11  15 1
            17   12  16 1
            18   16  17 1
            19   16  18 2
            20   17  19 1
            21   17  20 1 #Down
            22   20  21 1
            23   20  22 1
            24   19  23 1
            25   19  24 1
            26   23  25 1
            27   23  26 2
            28   25  27 1
            29   27  28 1
            30   28  29 1
            31   28  30 2
            32   29  31 1
            33   31  32 1
            34   31  33 1
            35   25  34 1 #Up
            36   34  35 1
            37   34  36 1
            38   29  37 1 #Down
            39   37  38 1
            40   37  39 1
            41    8  40 1
            42   40  41 1
            43   40  42 1
            44   40  43 1

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