KEGG   COMPOUND: C06217
Entry
C06217                      Compound                               
Name
Cellohexaose
Formula
C36H62O31
Exact mass
990.3275
Mol weight
990.8589
Structure
Remark
Same as: G01967
Reaction
Enzyme
Other DBs
PubChem: 8463
ChEBI: 143194 49533
PDB-CCD: CE6[PDBj]
3DMET: B01996
LinkDB
KCF data

ATOM        67
            1   C1y C    28.0731  -20.5990
            2   C1y C    28.7582  -19.3719
            3   O2a O    26.4940  -20.5419
            4   C1y C    28.7866  -21.7978
            5   O2x O    30.1566  -19.4229
            6   C1b C    28.0447  -18.1732
            7   C1y C    25.1049  -20.5800
            8   C1y C    30.1851  -21.7787
            9   O1a O    28.0922  -23.0059
            10  C1y C    30.8701  -20.5610
            11  O1a O    26.6463  -18.1922
            12  O2x O    24.3914  -19.3813
            13  C1y C    24.4201  -21.8678
            14  O1a O    30.8891  -22.9678
            15  O2a O    32.2589  -20.5229
            16  C1y C    22.9929  -19.4003
            17  C1y C    23.0310  -21.8168
            18  O1a O    25.1239  -22.9868
            19  C1y C    33.6480  -20.5135
            20  C1y C    22.3176  -20.6181
            21  C1b C    22.2795  -18.1922
            22  O1a O    22.3366  -23.0249
            23  C1y C    34.3330  -19.2957
            24  C1y C    34.3615  -21.7120
            25  O2a O    20.9191  -20.6275
            26  O1a O    20.8907  -18.2112
            27  O2x O    35.7315  -19.3467
            28  C1b C    33.6196  -18.0970
            29  C1y C    35.7599  -21.6929
            30  O1a O    33.6670  -22.9204
            31  C1y C    19.5303  -20.6561
            32  C1y C    36.4450  -20.4754
            33  O1a O    32.2211  -18.1064
            34  O1a O    36.4640  -22.8823
            35  O2x O    18.8166  -19.4574
            36  C1y C    18.8452  -21.9439
            37  O2a O    37.8338  -20.4467
            38  C1y C    17.4181  -19.4764
            39  C1y C    17.4562  -21.8930
            40  O1a O    19.5490  -23.0724
            41  C1y C    39.2323  -20.4467
            42  C1y C    16.7427  -20.6942
            43  C1b C    16.7046  -18.2777
            44  O1a O    16.7617  -23.1104
            45  C1y C    39.9173  -19.2290
            46  C1y C    39.9460  -21.6455
            47  O2a O    15.1539  -20.6465
            48  O1a O    15.3158  -18.2874
            49  O2x O    41.3158  -19.2799
            50  C1b C    39.2038  -18.0305
            51  C1y C    41.3445  -21.6264
            52  O1a O    39.2513  -22.8632
            53  C1y C    13.7650  -20.6846
            54  C1y C    42.0292  -20.4087
            55  O1a O    37.8054  -18.0399
            56  O1a O    42.0482  -22.8252
            57  O2x O    13.0516  -19.5464
            58  C1y C    13.0897  -21.9023
            59  O1a O    43.4183  -20.3803
            60  C1y C    11.6531  -19.4955
            61  C1y C    11.6912  -21.9214
            62  O1a O    13.7935  -23.0914
            63  C1y C    10.9778  -20.7226
            64  C1b C    10.9397  -18.2968
            65  O1a O    10.9965  -23.1295
            66  O1a O     9.5793  -20.7323
            67  O1a O     9.5506  -18.3158
BOND        72
            1     1   2 1
            2     1   3 1 #Down
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Up
            6     7   3 1 #Up
            7     4   8 1
            8     4   9 1 #Up
            9     5  10 1
            10    6  11 1
            11    7  12 1
            12    7  13 1
            13    8  14 1 #Down
            14   10  15 1 #Up
            15   12  16 1
            16   13  17 1
            17   13  18 1 #Down
            18   19  15 1 #Down
            19   16  20 1
            20   16  21 1 #Up
            21   17  22 1 #Up
            22   19  23 1
            23   19  24 1
            24   20  25 1 #Down
            25   21  26 1
            26   23  27 1
            27   23  28 1 #Up
            28   24  29 1
            29   24  30 1 #Up
            30   31  25 1 #Up
            31   27  32 1
            32   28  33 1
            33   29  34 1 #Down
            34   31  35 1
            35   31  36 1
            36   32  37 1 #Up
            37   35  38 1
            38   36  39 1
            39   36  40 1 #Down
            40   41  37 1 #Down
            41   38  42 1
            42   38  43 1 #Up
            43   39  44 1 #Up
            44   41  45 1
            45   41  46 1
            46   42  47 1 #Down
            47   43  48 1
            48   45  49 1
            49   45  50 1 #Up
            50   46  51 1
            51   46  52 1 #Up
            52   53  47 1 #Up
            53   49  54 1
            54   50  55 1
            55   51  56 1 #Down
            56   53  57 1
            57   53  58 1
            58   54  59 1 #Up
            59   57  60 1
            60   58  61 1
            61   58  62 1 #Down
            62   60  63 1
            63   60  64 1 #Up
            64   61  65 1 #Up
            65   63  66 1 #Down
            66   64  67 1
            67    8  10 1
            68   17  20 1
            69   29  32 1
            70   39  42 1
            71   51  54 1
            72   61  63 1

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