KEGG   COMPOUND: C10721
Entry
C10721                      Compound                               
Name
Rottlerin
Formula
C30H28O8
Exact mass
516.1784
Mol weight
516.5385
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1212 Chalcones and dihydrochalcones
    C10721  Rottlerin
Phytochemical compounds [BR:br08003]
 Polyketides
  Others
   Phloroglucinols
    C10721  Rottlerin
Other DBs
CAS: 82-08-6
PubChem: 12904
ChEBI: 8899
LIPIDMAPS: LMPK12120428
KNApSAcK: C00002708
3DMET: B04090
NIKKAJI: J9.828K
LinkDB
KCF data

ATOM        38
            1   C8y C    32.9907  -21.6295
            2   C8x C    32.9978  -20.2630
            3   C8x C    34.1882  -19.5787
            4   C8x C    35.3715  -20.2681
            5   C8x C    35.3644  -21.6417
            6   C8x C    34.1742  -22.3190
            7   C8y C    28.2713  -21.6295
            8   C8y C    27.0816  -22.3129
            9   C8y C    25.8990  -21.6295
            10  C8y C    25.8990  -20.2630
            11  O1a O    24.7117  -19.5734
            12  C8y C    28.2713  -20.2630
            13  C8y C    27.0782  -19.5785
            14  C2x C    27.0699  -18.2096
            15  C2x C    28.2545  -17.5178
            16  C1z C    29.4406  -18.1952
            17  O2x O    29.4489  -19.5641
            18  O1a O    27.0799  -23.6794
            19  C5a C    29.4476  -22.3129
            20  C2b C    30.6310  -21.6295
            21  C2b C    31.8146  -22.3129
            22  O5a O    29.4476  -23.6794
            23  C1a C    30.6381  -18.8683
            24  C1a C    30.6381  -17.5087
            25  C1b C    24.1151  -22.5524
            26  C8y C    22.3048  -20.2840
            27  C8y C    22.3048  -21.6578
            28  C8y C    21.1153  -22.3409
            29  C8y C    19.9396  -21.6578
            30  C8y C    19.9396  -20.2840
            31  C8y C    21.1153  -19.6008
            32  C1a C    21.1134  -18.2341
            33  O1a O    21.1134  -23.7076
            34  O1a O    18.7525  -19.6018
            35  C5a C    18.7525  -22.3401
            36  O5a O    18.7513  -23.7068
            37  C1a C    17.5660  -21.6559
            38  O1a O    23.4841  -19.6003
BOND        41
            1     7   8 1
            2     7  19 1
            3     8   9 2
            4    19  20 1
            5     9  10 1
            6    20  21 2
            7    21   1 1
            8    10  13 2
            9    19  22 2
            10    4   5 2
            11   16  23 1
            12   10  11 1
            13   16  24 1
            14    5   6 1
            15   25   9 1
            16    6   1 2
            17    1   2 1
            18    2   3 2
            19    3   4 1
            20   12  13 1
            21   26  27 2
            22   27  28 1
            23   28  29 2
            24   29  30 1
            25   30  31 2
            26   31  26 1
            27   13  14 1
            28   31  32 1
            29   14  15 2
            30   28  33 1
            31   15  16 1
            32   30  34 1
            33   16  17 1
            34   29  35 1
            35   17  12 1
            36   35  36 2
            37   12   7 2
            38   35  37 1
            39    8  18 1
            40   26  38 1
            41   25  27 1

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