KEGG   COMPOUND: C22127
Entry
C22127                      Compound                               

Name
Ginsenoside C-K
Formula
C36H62O8
Exact mass
622.4445
Mol weight
622.8727
Structure
Reaction
Enzyme
2.4.1.363       2.4.1.364
Other DBs
CAS: 39262-14-1
PubChem: 405226319
ChEMBL: CHEMBL3355096
KCF data

ATOM        44
            1   C1x C    16.4132  -18.2729
            2   C1y C    16.4132  -19.6599
            3   C1z C    17.5230  -20.2842
            4   C1z C    18.7714  -19.6599
            5   C1y C    18.7714  -18.2729
            6   C1y C    17.5230  -17.5792
            7   C1z C    15.2341  -20.2842
            8   C1y C    15.2341  -21.6714
            9   C1x C    16.3440  -22.2957
            10  C1x C    17.5230  -21.6714
            11  C1x C    14.0550  -19.5906
            12  C1x C    12.8759  -20.2842
            13  C1y C    12.8759  -21.6018
            14  C1z C    14.0550  -22.2957
            15  O1a O    17.5230  -16.2629
            16  C1a C    18.6369  -21.4010
            17  C1a C    15.2341  -18.9663
            18  O1a O    11.6277  -22.5039
            19  C1a C    19.9537  -20.4908
            20  C1a C    14.6099  -23.6828
            21  C1a C    13.5002  -23.6828
            22  C1x C    21.1812  -19.6599
            23  C1x C    21.1812  -18.2729
            24  C1y C    19.9762  -17.5773
            25  C1b C    21.1294  -15.8451
            26  C1b C    22.2392  -16.5389
            27  C1d C    19.9504  -16.5389
            28  C2b C    23.4183  -15.8451
            29  C2c C    24.5280  -16.5389
            30  C1a C    25.7073  -15.8451
            31  O2a O    18.5631  -14.6661
            32  C1a C    19.9504  -15.2210
            33  C1a C    24.5280  -17.8567
            34  C1y C    17.3841  -10.7820
            35  C1y C    17.3841  -12.1692
            36  C1y C    18.5631  -12.8628
            37  O2x O    19.7422  -12.1692
            38  C1y C    19.7422  -10.7820
            39  C1y C    18.5631  -10.1579
            40  O1a O    18.5631   -8.7706
            41  O1a O    16.2049  -12.8628
            42  O1a O    16.2049  -10.1579
            43  C1b C    20.9213  -10.1579
            44  O1a O    20.9213   -8.7706
BOND        48
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     2   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    3  10 1
            12    7  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16    8  14 1
            17    6  15 1 #Up
            18    3  16 1 #Up
            19    7  17 1 #Up
            20   13  18 1 #Up
            21    4  19 1 #Down
            22   14  20 1
            23   14  21 1
            24    4  22 1
            25   22  23 1
            26   23  24 1
            27    5  24 1
            28   25  26 1
            29   25  27 1
            30   26  28 1
            31   28  29 2
            32   29  30 1
            33   27  31 1 #Up
            34   27  32 1 #Down
            35   29  33 1
            36   34  35 1
            37   35  36 1
            38   36  37 1
            39   37  38 1
            40   38  39 1
            41   34  39 1
            42   39  40 1 #Down
            43   35  41 1 #Down
            44   34  42 1 #Up
            45   38  43 1 #Up
            46   43  44 1
            47   36  31 1 #Up
            48   24  27 1

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