KEGG   COMPOUND: C08944
Entry
C08944                      Compound                               

Name
Ginsenoside Re
Formula
C48H82O18
Exact mass
946.5501
Mol weight
947.1539
Structure
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Triterpenoids (C30)
   Dammarenes
    C08944  Ginsenoside Re
Other DBs
CAS: 52286-59-6
PubChem: 11136
ChEBI: 77148
ChEMBL: CHEMBL510095
KNApSAcK: C00003518
3DMET: B02547
NIKKAJI: J38.851C
KCF data

ATOM        66
            1   C1y C    23.9869  -12.7760
            2   O2x O    25.1873  -12.0652
            3   C1y C    22.7808  -12.0711
            4   C1y C    25.1815  -10.6707
            5   C1y C    22.7750  -10.7026
            6   O1a O    21.5747  -12.7877
            7   C1y C    23.9752   -9.9936
            8   C1b C    26.3745   -9.9772
            9   O1a O    21.5630  -10.0280
            10  O1a O    23.9694   -8.6078
            11  C1y C    20.3930  -19.0324
            12  C1z C    21.5932  -19.7246
            13  C1z C    19.1939  -19.7187
            14  C1x C    20.3417  -17.6414
            15  C1z C    22.7935  -19.0500
            16  C1x C    21.5932  -21.1156
            17  C1a C    22.2757  -18.3275
            18  C1y C    19.1879  -21.1099
            19  C1x C    17.9937  -19.0266
            20  C1a C    19.1750  -18.3215
            21  C1y C    21.6180  -16.9610
            22  C1y C    22.8052  -17.6588
            23  C1x C    25.1986  -19.0092
            24  C1a C    22.7818  -20.4470
            25  C1y C    20.3813  -21.8135
            26  C1z C    17.9937  -21.8017
            27  C1x C    16.7698  -19.7187
            28  O1a O    21.6049  -15.7611
            29  C1y C    24.0231  -16.9785
            30  C1x C    25.2234  -17.6953
            31  O2a O    20.3696  -23.1931
            32  C1y C    16.7698  -21.1099
            33  C1a C    17.2769  -23.0080
            34  C1a C    18.5960  -23.0080
            35  C1d C    24.0114  -15.5815
            36  C1y C    20.3579  -24.5959
            37  O1a O    15.5696  -21.8017
            38  C1b C    25.2175  -14.9012
            39  C1y C    21.5815  -25.2762
            40  O2x O    19.1633  -25.3067
            41  C1b C    26.4236  -15.5873
            42  O2a O    22.7759  -24.5725
            43  C1y C    21.5932  -26.6674
            44  C1y C    19.1750  -26.6978
            45  C2b C    27.6227  -14.9069
            46  C1y C    23.9996  -25.2528
            47  C1y C    20.3930  -27.3841
            48  O1a O    22.6710  -27.4235
            49  C1b C    17.9820  -27.4017
            50  C2c C    28.8288  -15.5932
            51  C1y C    25.2175  -24.5842
            52  O2x O    23.9750  -26.6311
            53  O1a O    20.4175  -28.7753
            54  C1a C    30.0234  -14.9129
            55  C1a C    28.8229  -16.9844
            56  C1y C    26.3932  -25.3008
            57  O1a O    25.2409  -23.1872
            58  C1y C    25.1635  -27.3477
            59  C1y C    26.3757  -26.6734
            60  O1a O    27.6110  -24.6264
            61  C1a C    25.1274  -28.7447
            62  O1a O    27.5630  -27.3958
            63  O2a O    23.9986  -14.1757
            64  C1a C    22.7898  -14.6656
            65  O1a O    27.5888  -10.6734
            66  O1a O    16.7633  -26.7132
BOND        72
            1     3   6 1 #Down
            2     4   7 1
            3     4   8 1 #Up
            4     5   9 1 #Up
            5     7  10 1 #Down
            6     5   7 1
            7    11  12 1
            8    11  13 1
            9    11  14 1
            10   12  15 1
            11   12  16 1
            12   12  17 1 #Up
            13   13  18 1
            14   13  19 1
            15   13  20 1 #Up
            16   14  21 1
            17   15  22 1
            18   15  23 1
            19   15  24 1 #Down
            20   16  25 1
            21   18  26 1
            22   19  27 1
            23   21  28 1 #Up
            24   22  29 1
            25   23  30 1
            26   25  31 1 #Down
            27   26  32 1
            28   26  33 1
            29   26  34 1
            30   29  35 1
            31   36  31 1 #Up
            32   32  37 1 #Up
            33   35  38 1
            34   36  39 1
            35   36  40 1
            36   38  41 1
            37   39  42 1 #Down
            38   39  43 1
            39   40  44 1
            40   41  45 1
            41   46  42 1 #Up
            42   43  47 1
            43   43  48 1 #Up
            44   44  49 1 #Up
            45   45  50 2
            46   46  51 1
            47   46  52 1
            48   47  53 1 #Down
            49   50  54 1
            50   50  55 1
            51   51  56 1
            52   51  57 1 #Down
            53   52  58 1
            54   56  59 1
            55   56  60 1 #Down
            56   58  61 1 #Down
            57   59  62 1 #Up
            58   18  25 1
            59   21  22 1
            60   27  32 1
            61   29  30 1
            62   44  47 1
            63   58  59 1
            64    1   2 1
            65   35  63 1 #Up
            66    1  63 1 #Up
            67    1   3 1
            68   35  64 1 #Down
            69    2   4 1
            70    3   5 1
            71    8  65 1
            72   49  66 1

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