KEGG   COMPOUND: C14123Help
Entry
C14123                      Compound                               

Name
BMS-268770
Formula
C23H30N4O4S2
Exact mass
490.1708
Mol weight
490.6387
Structure
Mol fileKCF fileDB search
Brite
Target-based classification of compounds [BR:br08010]
 Enzymes
  Transferases
   cyclin-dependent kinase 2
    C14123  BMS-268770
BRITE hierarchy
Other DBs
PubChem: 7846938
ChEBI: 34550
NIKKAJI: J2.788.030D
KCF data Show

ATOM        33
            1   C8y C    27.2461  -19.9492
            2   S2x S    26.1235  -19.1104
            3   C8y C    24.9789  -19.9188
            4   C8x C    25.3939  -21.2572
            5   N5x N    26.7952  -21.2761
            6   S2a S    23.6579  -19.4699
            7   C1b C    22.6209  -20.3785
            8   C8y C    21.2933  -19.9271
            9   O2x O    20.8811  -18.5977
            10  C8y C    19.4895  -18.5790
            11  C8x C    19.0415  -19.8968
            12  N5x N    20.1563  -20.7300
            13  C1d C    18.6856  -17.4408
            14  C1a C    17.8829  -16.2508
            15  C1a C    17.5421  -18.2300
            16  C1a C    19.8486  -16.6383
            17  C1b C    28.4424  -19.2500
            18  C5a C    29.6549  -19.9500
            19  N1b N    30.8673  -19.2500
            20  C8y C    32.0797  -19.9500
            21  O5a O    29.6549  -21.3498
            22  C8x C    32.0797  -21.3499
            23  C8x C    33.2922  -22.0499
            24  C8y C    34.5046  -21.3499
            25  C8x C    34.5046  -19.9500
            26  C8x C    33.2922  -19.2500
            27  C1b C    35.7224  -22.0500
            28  N1b N    36.9349  -21.3500
            29  C1c C    38.1473  -22.0500
            30  C1b C    39.3597  -21.3500
            31  O1a O    40.5722  -22.0500
            32  C1b C    38.1473  -23.4500
            33  O1a O    39.3618  -24.1512
BOND        35
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     1   5 2
            6     3   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 2
            12   11  12 1
            13    8  12 2
            14   10  13 1
            15   13  14 1
            16   13  15 1
            17   13  16 1
            18    1  17 1
            19   17  18 1
            20   18  19 1
            21   19  20 1
            22   18  21 2
            23   20  22 2
            24   22  23 1
            25   23  24 2
            26   24  25 1
            27   25  26 2
            28   20  26 1
            29   24  27 1
            30   27  28 1
            31   28  29 1
            32   29  30 1
            33   30  31 1
            34   29  32 1
            35   32  33 1

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