KEGG   COMPOUND: C09829
Entry
C09829                      Compound                               
Name
Piperaduncin B
Formula
C29H30O8
Exact mass
506.1941
Mol weight
506.5437
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1212 Chalcones and dihydrochalcones
    C09829  Piperaduncin B
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Dihydrochalcones
    C09829  Piperaduncin B
Other DBs
CAS: 155023-55-5
PubChem: 12017
ChEBI: 8234
LIPIDMAPS: LMPK12120468
KNApSAcK: C00000994
3DMET: B03308
NIKKAJI: J2.771.227D
LinkDB
KCF data

ATOM        37
            1   C8y C    28.1558  -16.6857
            2   C1y C    28.4593  -15.3141
            3   C8y C    29.3700  -17.3979
            4   C8y C    26.9359  -17.3921
            5   C1y C    29.8602  -15.1740
            6   C8y C    29.3700  -18.7928
            7   O2x O    30.4206  -16.4640
            8   C8x C    26.9359  -18.7928
            9   O2a O    25.7218  -16.6857
            10  C1d C    30.5666  -13.9716
            11  C8y C    28.1558  -19.4933
            12  C5a C    30.5782  -19.4933
            13  C1a C    24.5078  -17.3804
            14  C1a C    31.9615  -13.9833
            15  C1a C    29.8778  -12.7575
            16  O1a O    31.3254  -12.7400
            17  O1a O    28.1558  -20.8884
            18  O5a O    30.5782  -20.8884
            19  C8y C    27.2497  -14.6086
            20  C8x C    26.0429  -15.3141
            21  C8y C    27.2512  -13.2186
            22  C8y C    24.8288  -14.6137
            23  C8x C    26.0429  -12.5181
            24  O1a O    28.4593  -12.5181
            25  C8x C    24.8288  -13.2186
            26  C7a C    23.6205  -15.3141
            27  O7a O    22.4122  -14.6137
            28  O6a O    23.6205  -16.4991
            29  C1a C    21.2040  -15.3141
            30  C1b C    31.8146  -18.7815
            31  C1b C    32.9910  -19.4625
            32  C8y C    34.1894  -18.7723
            33  C8x C    35.3737  -19.4578
            34  C8x C    36.5869  -18.7592
            35  C8x C    36.5885  -17.3592
            36  C8x C    35.4042  -16.6736
            37  C8x C    34.1910  -17.3723
BOND        40
            1     6  12 1
            2     9  13 1
            3    10  14 1
            4    10  15 1
            5    10  16 1
            6    11  17 1
            7    12  18 2
            8     5   7 1
            9     8  11 2
            10    2  19 1 #Down
            11    1   2 1
            12    1   3 1
            13    1   4 2
            14    2   5 1
            15    3   6 2
            16    3   7 1
            17    4   8 1
            18    4   9 1
            19    5  10 1 #Up
            20    6  11 1
            21   19  20 1
            22   19  21 2
            23   20  22 2
            24   21  23 1
            25   21  24 1
            26   22  25 1
            27   22  26 1
            28   26  27 1
            29   26  28 2
            30   27  29 1
            31   23  25 2
            32   12  30 1
            33   30  31 1
            34   31  32 1
            35   32  33 2
            36   33  34 1
            37   34  35 2
            38   35  36 1
            39   36  37 2
            40   32  37 1

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