KEGG   COMPOUND: C08572Help
Entry
C08572                      Compound                               

Name
Uvaricin
Formula
C39H68O7
Exact mass
648.4965
Mol weight
648.953
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Fatty acids related compounds
  Fatty acids
   Others
    C08572  Uvaricin
BRITE hierarchy
Other DBs
CAS: 82064-83-3
PubChem: 10765
ChEBI: 9916
ChEMBL: CHEMBL504329
KNApSAcK: C00001330
NIKKAJI: J168.827H
LinkDB All DBs
KCF data Show

ATOM        46
            1   C1y C    23.7454  -20.4023
            2   C1y C    25.1498  -20.3432
            3   O2x O    22.6195  -19.5883
            4   C1x C    23.3106  -21.7395
            5   O2x O    26.2754  -19.5183
            6   C1x C    25.5843  -21.6695
            7   C1y C    21.4827  -20.4023
            8   C1x C    21.9171  -21.7395
            9   C1y C    27.4125  -20.3432
            10  C1x C    26.9778  -21.6695
            11  C1c C    20.2789  -19.7112
            12  C1c C    28.6163  -19.6522
            13  C1b C    19.0748  -20.4023
            14  O7a O    20.2789  -18.3177
            15  C1b C    29.8310  -20.3432
            16  O1a O    28.6163  -18.2590
            17  C1b C    17.8601  -19.7112
            18  C1b C    31.0348  -19.6522
            19  C1b C    16.6564  -20.4023
            20  C1b C    32.2388  -20.3432
            21  C1b C    15.4526  -19.7112
            22  C1b C    33.4426  -19.6522
            23  C1b C    14.2485  -20.4023
            24  C1b C    34.6463  -20.3432
            25  C1b C    13.0448  -19.7112
            26  C1b C    35.8501  -19.6522
            27  C1b C    11.8300  -20.4023
            28  C1b C    37.0652  -20.3432
            29  C1b C    10.6263  -19.7112
            30  C1b C    38.2689  -19.6522
            31  C1b C     9.4222  -20.4023
            32  C1b C    39.4836  -20.3432
            33  C1a C     8.2075  -19.7112
            34  C1b C    40.6874  -19.6522
            35  C1b C    41.8915  -20.3432
            36  C1b C    43.0952  -19.6522
            37  C2y C    44.2990  -20.3432
            38  C7x C    44.7337  -21.6695
            39  C2x C    45.4358  -19.5183
            40  O7x O    46.1269  -21.6695
            41  O6a O    43.9198  -22.7953
            42  C1y C    46.5617  -20.3432
            43  C1a C    47.8879  -19.9198
            44  C7a C    19.0876  -17.6400
            45  C1a C    17.8751  -18.3400
            46  O6a O    19.0831  -16.2403
BOND        48
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     6  10 1
            10    7  11 1
            11    9  12 1
            12   11  13 1
            13   11  14 1 #Down
            14   12  15 1
            15   12  16 1 #Down
            16   13  17 1
            17   15  18 1
            18   17  19 1
            19   18  20 1
            20   19  21 1
            21   20  22 1
            22   21  23 1
            23   22  24 1
            24   23  25 1
            25   24  26 1
            26   25  27 1
            27   26  28 1
            28   27  29 1
            29   28  30 1
            30   29  31 1
            31   30  32 1
            32   31  33 1
            33   32  34 1
            34   34  35 1
            35   35  36 1
            36   36  37 1
            37   37  38 1
            38   37  39 2
            39   38  40 1
            40   38  41 2
            41   39  42 1
            42   42  43 1 #Down
            43    7   8 1
            44    9  10 1
            45   40  42 1
            46   14  44 1
            47   44  45 1
            48   44  46 2

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