KEGG   DRUG: MaytansineHelp
Entry
D04864                      Drug                                   

Name
Maytansine (USAN)
Formula
C34H46ClN3O10
Exact mass
691.2872
Mol weight
692.1961
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Source
Maytenus [TAX:123430]
Remark
Same as: 
Efficacy
Antineoplastic, Tubulin polymerization inhibitor
Comment
maytansinoid
Target
  Pathway
Gap junction
Brite
Target-based classification of drugs [BR:br08310]
 Others
  Other
   tubulin beta
    Maytansine
     D04864  Maytansine (USAN)
BRITE hierarchy
Other DBs
CAS: 
35846-53-8
PubChem: 
ChEBI: 
ChEMBL: 
PDB-CCD: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        48
            1   C1z C    23.2539  -19.8145
            2   C1y C    21.8496  -19.8203
            3   C1y C    23.9532  -21.0265
            4   O2x O    22.5606  -21.0324
            5   C1a C    23.9415  -18.5967
            6   C1y C    20.9461  -18.6083
            7   C1x C    25.3457  -21.0265
            8   O7a O    23.2598  -22.2270
            9   C1y C    20.9638  -17.0817
            10  C1a C    19.7519  -18.5967
            11  C5x C    26.0393  -19.8145
            12  C7a C    23.9591  -23.4389
            13  C1x C    22.1000  -16.4173
            14  O7x O    19.6995  -16.4699
            15  N1y N    27.4378  -19.8145
            16  O5x O    25.3283  -18.5967
            17  C1c C    25.3517  -23.4389
            18  O6a O    23.2539  -24.6510
            19  C1z C    22.1234  -15.0713
            20  C7x C    19.6995  -15.0713
            21  C8y C    28.1254  -18.6083
            22  C1a C    28.1254  -21.0208
            23  N1c N    26.0567  -24.6510
            24  C1a C    26.0509  -22.2210
            25  C1y C    23.3413  -14.3721
            26  N1x N    20.9174  -14.3663
            27  O1a O    22.1119  -13.3871
            28  O6a O    18.4874  -14.3663
            29  C8x C    28.1544  -17.2215
            30  C8y C    29.3256  -19.3250
            31  C5a C    27.4494  -24.6510
            32  C1a C    25.3457  -25.8630
            33  C2x C    24.5534  -15.0771
            34  O2a O    23.3296  -12.9619
            35  C8y C    29.3723  -16.5339
            36  C8y C    30.6135  -18.6491
            37  X   Cl   29.3140  -20.7235
            38  C1a C    28.1487  -25.8630
            39  O5a O    28.1370  -23.4332
            40  C2x C    25.7712  -14.3895
            41  C1a C    24.5417  -12.2569
            42  C8x C    30.5668  -17.2565
            43  C1x C    29.3899  -15.1354
            44  O2a O    31.7497  -19.3426
            45  C2x C    26.9775  -15.1004
            46  C2y C    28.1894  -14.4245
            47  C1a C    32.9617  -18.6433
            48  C1a C    28.1837  -13.0202
BOND        51
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 1
            6     3   7 1
            7     3   8 1 #Down
            8     6   9 1
            9     6  10 1 #Down
            10    7  11 1
            11    8  12 1
            12    9  13 1
            13    9  14 1
            14   11  15 1
            15   11  16 2
            16   12  17 1
            17   12  18 2
            18   13  19 1
            19   14  20 1
            20   15  21 1
            21   15  22 1
            22   17  23 1
            23   17  24 1 #Down
            24   19  25 1
            25   19  26 1
            26   19  27 1 #Down
            27   20  28 2
            28   21  29 2
            29   21  30 1
            30   23  31 1
            31   23  32 1
            32   25  33 1
            33   25  34 1 #Down
            34   29  35 1
            35   30  36 2
            36   30  37 1
            37   31  38 1
            38   31  39 2
            39   33  40 2
            40   34  41 1
            41   35  42 2
            42   35  43 1
            43   36  44 1
            44   40  45 1
            45   43  46 1
            46   44  47 1
            47   46  48 1
            48    2   4 1
            49   20  26 1
            50   36  42 1
            51   45  46 2

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