KEGG   COMPOUND: C17570
Entry
C17570                      Compound                               
Name
2-Methyl-6-solanyl-1,4-benzoquinol;
2-Methyl-6-nonaprenyl-benzene-1,4-diol;
2-Methyl-6-all-trans-nonaprenylbenzene-1,4-diol;
2-Methyl-6-solanesylbenzene-1,4-diol;
MSBQ
Formula
C52H80O2
Exact mass
736.6158
Mol weight
737.1904
Structure
Reaction
R08782 R10709
Pathway
map00130  Ubiquinone and other terpenoid-quinone biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01240  Biosynthesis of cofactors
Module
M00933  Plastoquinone biosynthesis, homogentisate + solanesyl-PP => plastoquinol
Enzyme
2.1.1.295       2.5.1.117
Other DBs
PubChem: 96023915
ChEBI: 81191
LinkDB
KCF data

ATOM        54
            1   C8x C    21.7000  -20.6500
            2   C8y C    21.7000  -22.0500
            3   C8y C    22.9124  -22.7500
            4   C8y C    24.1249  -22.0500
            5   C8x C    24.1249  -20.6500
            6   C8y C    22.9124  -19.9500
            7   O1a O    22.9124  -18.5502
            8   O1a O    22.9124  -24.1498
            9   C1a C    20.4876  -22.7500
            10  C1b C    25.3624  -22.7500
            11  C2b C    26.5749  -22.0500
            12  C2c C    27.7873  -22.7500
            13  C1b C    28.9997  -22.0500
            14  C1b C    30.2122  -22.7500
            15  C2b C    31.4246  -22.0500
            16  C2c C    32.6370  -22.7500
            17  C1a C    33.8495  -22.0500
            18  C1a C    27.7873  -24.1500
            19  C1a C    32.6370  -24.1499
            20  C1b C    25.3624  -22.7500
            21  C2b C    26.5749  -22.0500
            22  C2c C    27.7873  -22.7500
            23  C1b C    28.9997  -22.0500
            24  C1a C    27.7873  -24.1500
            25  C1b C    25.3624  -22.7500
            26  C2b C    26.5749  -22.0500
            27  C2c C    27.7873  -22.7500
            28  C1b C    28.9997  -22.0500
            29  C1a C    27.7873  -24.1500
            30  C1b C    25.3624  -22.7500
            31  C2b C    26.5749  -22.0500
            32  C2c C    27.7873  -22.7500
            33  C1b C    28.9997  -22.0500
            34  C1a C    27.7873  -24.1500
            35  C1b C    25.3624  -22.7500
            36  C2b C    26.5749  -22.0500
            37  C2c C    27.7873  -22.7500
            38  C1b C    28.9997  -22.0500
            39  C1a C    27.7873  -24.1500
            40  C1b C    25.3624  -22.7500
            41  C2b C    26.5749  -22.0500
            42  C2c C    27.7873  -22.7500
            43  C1b C    28.9997  -22.0500
            44  C1a C    27.7873  -24.1500
            45  C1b C    25.3624  -22.7500
            46  C2b C    26.5749  -22.0500
            47  C2c C    27.7873  -22.7500
            48  C1b C    28.9997  -22.0500
            49  C1a C    27.7873  -24.1500
            50  C1b C    25.3624  -22.7500
            51  C2b C    26.5749  -22.0500
            52  C2c C    27.7873  -22.7500
            53  C1b C    28.9997  -22.0500
            54  C1a C    27.7873  -24.1500
BOND        54
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     6   7 1
            8     3   8 1
            9     2   9 1
            10   14  15 1
            11   15  16 2
            12   16  17 1
            13   16  19 1
            14    4  10 1
            15   10  11 1
            16   11  12 2
            17   12  13 1
            18   12  18 1
            19   13  20 1
            20   20  21 1
            21   21  22 2
            22   22  23 1
            23   22  24 1
            24   23  25 1
            25   25  26 1
            26   26  27 2
            27   27  28 1
            28   27  29 1
            29   28  30 1
            30   30  31 1
            31   31  32 2
            32   32  33 1
            33   32  34 1
            34   33  35 1
            35   35  36 1
            36   36  37 2
            37   37  38 1
            38   37  39 1
            39   38  40 1
            40   40  41 1
            41   41  42 2
            42   42  43 1
            43   42  44 1
            44   43  45 1
            45   45  46 1
            46   46  47 2
            47   47  48 1
            48   47  49 1
            49   48  50 1
            50   50  51 1
            51   51  52 2
            52   52  53 1
            53   52  54 1
            54   53  14 1
BRACKET     1    24.9900  -23.7300   24.9900  -21.2800
            1    29.2600  -21.4900   29.2600  -23.9400
            1  8
 ORIGINAL  1   10  11  12  13  18
 REPEAT    1   20  21  22  23  24  25  26  27  28  29  30  31  32  33  34  35
            1   36  37  38  39  40  41  42  43  44  45  46  47  48  49  50  51
            1   52  53  54

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