KEGG   COMPOUND: C05815Help
Entry
C05815                      Compound                               

Name
2-Octaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinone
Formula
C48H72O4
Exact mass
712.5431
Mol weight
713.0829
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Ubiquinone and other terpenoid-quinone biosynthesis
Biosynthesis of secondary metabolites
Enzyme
1.14.13.-       2.1.1.64
Other DBs
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        52
            1   C1b C    13.8910  -18.8773
            2   C2b C    15.1081  -18.1715
            3   C2c C    16.3255  -18.8773
            4   C1a C    17.5426  -18.1715
            5   C1a C    16.3255  -20.2818
            6   C1b C     9.0291  -18.8773
            7   C2b C    10.2463  -18.1715
            8   C2c C    11.4565  -18.8773
            9   C1b C    12.6736  -18.1715
            10  C1a C    11.4565  -20.2818
            11  C2y C     7.7676  -18.1590
            12  C5x C     6.5994  -18.8423
            13  C2y C     7.7676  -16.7980
            14  C2y C     5.4137  -18.1590
            15  O5x O     6.5994  -20.2032
            16  C5x C     6.5994  -16.1147
            17  C1a C     8.9824  -16.0971
            18  C2y C     5.4137  -16.7980
            19  O2a O     4.1975  -18.8539
            20  O5x O     6.6053  -14.7187
            21  O1a O     4.1975  -16.0971
            22  C1a C     2.9885  -18.1530
            23  C1b C     9.0291  -18.8773
            24  C2b C    10.2463  -18.1715
            25  C2c C    11.4565  -18.8773
            26  C1b C    12.6736  -18.1715
            27  C1a C    11.4565  -20.2818
            28  C1b C     9.0291  -18.8773
            29  C2b C    10.2463  -18.1715
            30  C2c C    11.4565  -18.8773
            31  C1b C    12.6736  -18.1715
            32  C1a C    11.4565  -20.2818
            33  C1b C     9.0291  -18.8773
            34  C2b C    10.2463  -18.1715
            35  C2c C    11.4565  -18.8773
            36  C1b C    12.6736  -18.1715
            37  C1a C    11.4565  -20.2818
            38  C1b C     9.0291  -18.8773
            39  C2b C    10.2463  -18.1715
            40  C2c C    11.4565  -18.8773
            41  C1b C    12.6736  -18.1715
            42  C1a C    11.4565  -20.2818
            43  C1b C     9.0291  -18.8773
            44  C2b C    10.2463  -18.1715
            45  C2c C    11.4565  -18.8773
            46  C1b C    12.6736  -18.1715
            47  C1a C    11.4565  -20.2818
            48  C1b C     9.0291  -18.8773
            49  C2b C    10.2463  -18.1715
            50  C2c C    11.4565  -18.8773
            51  C1b C    12.6736  -18.1715
            52  C1a C    11.4565  -20.2818
BOND        52
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     3   5 1
            5    11  12 1
            6    11  13 2
            7    12  14 1
            8    12  15 2
            9    13  16 1
            10   13  17 1
            11   14  18 2
            12   14  19 1
            13   16  20 2
            14   18  21 1
            15   19  22 1
            16   16  18 1
            17    6   7 1
            18    7   8 2
            19    8   9 1
            20    9   1 1
            21    8  10 1
            22   23  24 1
            23   24  25 2
            24   25  26 1
            25    6  26 1
            26   25  27 1
            27   28  29 1
            28   29  30 2
            29   30  31 1
            30   23  31 1
            31   30  32 1
            32   33  34 1
            33   34  35 2
            34   35  36 1
            35   28  36 1
            36   35  37 1
            37   38  39 1
            38   39  40 2
            39   40  41 1
            40   33  41 1
            41   40  42 1
            42   43  44 1
            43   44  45 2
            44   45  46 1
            45   38  46 1
            46   45  47 1
            47   48  49 1
            48   49  50 2
            49   50  51 1
            50   43  51 1
            51   50  52 1
            52   48  11 1
BRACKET     1     8.6100  -19.6000    8.6100  -17.8500
            1    12.8100  -17.8500   12.8100  -19.7400
            1  7
 ORIGINAL  1    6   7   8   9  10
 REPEAT    1   23  24  25  26  27  28  29  30  31  32  33  34  35  36  37  38
            1   39  40  41  42  43  44  45  46  47  48  49  50  51  52

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