KEGG   COMPOUND: C17520
Entry
C17520                      Compound                               
Name
11-o-Galloylbergenin
Formula
C21H20O13
Exact mass
480.0904
Mol weight
480.3757
Structure
Other DBs
PubChem: 96023865
ChEBI: 81153
NIKKAJI: J532.061E
KCF data

ATOM        34
            1   C8y C    25.2000  -22.8900
            2   C8y C    25.2000  -24.2900
            3   C7x C    26.3900  -24.9900
            4   O7x O    27.5800  -24.2900
            5   C1y C    27.5800  -22.8900
            6   C1y C    26.3900  -22.1900
            7   C8y C    23.9400  -22.1900
            8   C8y C    22.7500  -22.8900
            9   C8y C    22.7500  -24.2900
            10  C8x C    23.9400  -24.9900
            11  C1y C    28.8400  -22.1900
            12  C1y C    28.8400  -20.8600
            13  C1y C    27.5800  -20.1600
            14  O2x O    26.3900  -20.8600
            15  C1b C    27.5800  -18.7600
            16  O7a O    28.8400  -17.9900
            17  O1a O    30.0300  -22.8900
            18  O1a O    30.0300  -20.1600
            19  O6a O    26.3900  -26.3900
            20  O1a O    23.9400  -20.8600
            21  O2a O    21.5600  -22.1900
            22  O1a O    21.5600  -25.0600
            23  C1a C    20.3000  -22.8900
            24  C7a C    28.8051  -16.5904
            25  O6a O    27.6026  -15.9352
            26  C8y C    30.0251  -15.8446
            27  C8x C    31.2480  -16.5102
            28  C8y C    32.4425  -15.7799
            29  C8y C    32.4072  -14.3803
            30  C8y C    31.1842  -13.7148
            31  C8x C    30.0598  -14.4451
            32  O1a O    33.6171  -13.6409
            33  O1a O    33.6347  -16.4284
            34  O1a O    31.1300  -12.3201
BOND        37
            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     1   7 2
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    2  10 2
            12    5  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16    6  14 1
            17   13  15 1
            18   15  16 1
            19   11  17 1
            20   12  18 1
            21    3  19 2
            22    7  20 1
            23    8  21 1
            24    9  22 1
            25   21  23 1
            26   16  24 1
            27   24  25 2
            28   24  26 1
            29   26  27 2
            30   27  28 1
            31   28  29 2
            32   29  30 1
            33   30  31 2
            34   26  31 1
            35   29  32 1
            36   28  33 1
            37   30  34 1

» Japanese version

  All links  
Chemical substance (3)   
   PubChem (1)   
   ChEBI (1)   
   NIKKAJI (1)   
All databases (3)   

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