KEGG   COMPOUND: C10209Help
Entry
C10209                      Compound                               

Name
Afzelechin-(4alpha->8)-afzelechin
Formula
C30H26O10
Exact mass
546.1526
Mol weight
546.5214
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Flavonoids
  Complex flavonoids
   Proanthocyanidins
    C10209  Afzelechin-(4alpha->8)-afzelechin
BRITE hierarchy
Other DBs
CAS: 101339-37-1
PubChem: 12395
ChEBI: 2508 75630
LIPIDMAPS: LMPK12030003
KNApSAcK: C00002906
3DMET: B03637
NIKKAJI: J2.620.219A
LinkDB All DBs
KCF data Show

ATOM        40
            1   C1y C    23.5614  -16.7929
            2   C8y C    22.3521  -16.0919
            3   C1y C    24.7881  -16.1036
            4   C8y C    22.3579  -14.6839
            5   C8y C    21.1429  -16.7929
            6   C1y C    24.7940  -14.6956
            7   O1a O    25.9916  -16.8163
            8   O2x O    23.5788  -13.9948
            9   C8x C    21.1486  -13.9888
            10  C8x C    19.9277  -16.0919
            11  O1a O    19.9289  -17.4759
            12  C8y C    26.0090  -14.0005
            13  C8y C    19.9277  -14.6839
            14  C8x C    27.2183  -14.7073
            15  C8x C    26.0090  -12.5985
            16  O1a O    18.7069  -13.9888
            17  C8x C    28.4392  -14.0180
            18  C8x C    27.2299  -11.9034
            19  C8y C    28.4449  -12.6102
            20  O1a O    29.6659  -11.9092
            21  C8y C    23.5614  -18.1890
            22  C8y C    24.7647  -18.8843
            23  C8y C    22.3521  -18.8783
            24  C8y C    24.7530  -20.2744
            25  O2x O    25.9682  -18.2066
            26  C8x C    22.3462  -20.2687
            27  C1x C    25.9448  -20.9871
            28  C8y C    23.5497  -20.9754
            29  C1y C    27.1657  -18.9075
            30  C1y C    27.1540  -20.2978
            31  O1a O    23.5497  -22.3775
            32  C8y C    28.3924  -18.2183
            33  O1a O    28.3691  -21.0105
            34  C8x C    29.6017  -18.9251
            35  C8x C    28.3982  -16.8103
            36  C8x C    30.8226  -18.2358
            37  C8x C    29.6251  -16.1153
            38  C8y C    30.8343  -16.8337
            39  O1a O    32.0552  -16.1327
            40  O1a O    21.1453  -18.3136
BOND        45
            1     6   8 1
            2    10  13 1
            3    18  19 1
            4     1  21 1 #Down
            5     1   2 1
            6     1   3 1
            7     2   4 2
            8     2   5 1
            9     3   6 1
            10    3   7 1 #Up
            11    4   8 1
            12    4   9 1
            13    5  10 2
            14    5  11 1
            15    6  12 1 #Down
            16    9  13 2
            17   12  14 2
            18   12  15 1
            19   13  16 1
            20   14  17 1
            21   15  18 2
            22   17  19 2
            23   19  20 1
            24   21  22 1
            25   21  23 2
            26   22  24 2
            27   22  25 1
            28   23  26 1
            29   24  27 1
            30   24  28 1
            31   25  29 1
            32   27  30 1
            33   28  31 1
            34   29  32 1 #Down
            35   30  33 1 #Up
            36   32  34 2
            37   32  35 1
            38   34  36 1
            39   35  37 2
            40   36  38 2
            41   38  39 1
            42   26  28 2
            43   29  30 1
            44   37  38 1
            45   23  40 1

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