KEGG   COMPOUND: C20778
Entry
C20778                      Compound                               
Name
Ginsenoside Rg3;
(20S)-Ginsenoside Rg3
Formula
C42H72O13
Exact mass
784.4973
Mol weight
785.0133
Structure
Reaction
Pathway
map00999  Biosynthesis of various plant secondary metabolites
map01110  Biosynthesis of secondary metabolites
Enzyme
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0106 C30 isoprenoids (triterpenes)
    PR010608 Dammarane triterpenoids
     C20778  Ginsenoside Rg3
Dietary phytochemicals [br08012.html]
 Other phytochemicals
  C20778
Other DBs
PubChem: 254741245
LIPIDMAPS: LMPR0106080010
KCF data

ATOM        55
            1   C1y C    13.1688  -25.3595
            2   C1y C    14.3531  -26.0561
            3   C1y C    15.5373  -25.3595
            4   C1y C    15.5373  -24.0358
            5   C1y C    14.4227  -23.3391
            6   O2x O    13.1688  -24.0358
            7   C1y C    10.9394  -21.1097
            8   C1y C    12.1237  -21.7368
            9   C1y C    13.2384  -21.1097
            10  C1y C    13.2384  -19.7164
            11  O2x O    12.1237  -19.0197
            12  C1y C    10.9394  -19.7164
            13  C1x C    19.4393  -14.4221
            14  C1y C    19.4393  -15.8153
            15  C1z C    20.5540  -16.4423
            16  C1z C    21.8080  -15.8153
            17  C1y C    21.8080  -14.4221
            18  C1y C    20.5540  -13.7253
            19  C1z C    18.2549  -16.4423
            20  C1y C    18.2549  -17.8357
            21  C1x C    19.3697  -18.4627
            22  C1x C    20.5540  -17.8357
            23  C1x C    17.0706  -15.7456
            24  C1x C    15.8862  -16.4423
            25  C1y C    15.8862  -17.7658
            26  C1z C    17.0706  -18.4627
            27  O1a O    20.5540  -12.4031
            28  C1a C    21.6729  -17.5641
            29  C1a C    18.2549  -15.1186
            30  O2a O    14.6325  -18.6719
            31  C1a C    22.9955  -16.6498
            32  C1a C    17.6280  -19.8560
            33  C1a C    16.5134  -19.8560
            34  C1b C     9.7550  -19.0197
            35  O1a O    12.1237  -23.1300
            36  O1a O     9.7550  -21.7368
            37  O2a O    14.3531  -21.8065
            38  C1b C    11.9844  -26.0561
            39  O1a O    16.7217  -26.0561
            40  O1a O    14.3531  -27.4495
            41  O1a O    16.7217  -23.3391
            42  O1a O     8.5403  -19.7079
            43  O1a O    11.9958  -27.4837
            44  C1x C    24.2285  -15.8153
            45  C1x C    24.2285  -14.4221
            46  C1y C    23.0182  -13.7234
            47  C1b C    24.1765  -11.9835
            48  C1b C    25.2912  -12.6804
            49  C1d C    22.9922  -12.6804
            50  C2b C    26.4755  -11.9835
            51  C2c C    27.5902  -12.6804
            52  C1a C    28.7747  -11.9835
            53  C1a C    22.9922  -11.3566
            54  C1a C    27.5902  -14.0040
            55  O1a O    22.0023  -11.6904
BOND        60
            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     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12    7  12 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 1
            17   17  18 1
            18   13  18 1
            19   14  19 1
            20   19  20 1
            21   20  21 1
            22   21  22 1
            23   15  22 1
            24   19  23 1
            25   23  24 1
            26   24  25 1
            27   25  26 1
            28   20  26 1
            29   18  27 1 #Up
            30   15  28 1 #Up
            31   19  29 1 #Up
            32   25  30 1 #Up
            33   16  31 1 #Down
            34   26  32 1
            35   26  33 1
            36   10  30 1 #Up
            37   12  34 1 #Up
            38    8  35 1 #Up
            39    7  36 1 #Down
            40    9  37 1 #Down
            41    5  37 1 #Up
            42    1  38 1 #Up
            43    3  39 1 #Up
            44    2  40 1 #Down
            45    4  41 1 #Down
            46   34  42 1
            47   38  43 1
            48   16  44 1
            49   44  45 1
            50   45  46 1
            51   17  46 1
            52   47  48 1
            53   47  49 1
            54   48  50 1
            55   50  51 2
            56   51  52 1
            57   49  53 1 #Down
            58   51  54 1
            59   46  49 1
            60   49  55 1 #Up

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