KEGG   COMPOUND: C13425Help
Entry
C13425                      Compound                               

Name
3-Hexaprenyl-4-hydroxybenzoate;
3-Hexaprenyl-4-hydroxybenzoic acid
Formula
C37H54O3
Exact mass
546.4073
Mol weight
546.8229
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Ubiquinone and other terpenoid-quinone biosynthesis
Biosynthesis of secondary metabolites
Enzyme
Other DBs
PubChem: 
ChEBI: 
LIPIDMAPS: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        40
            1   C8x C    10.4300  -19.7400
            2   C8x C    10.4300  -21.1400
            3   C8y C    11.6424  -21.8400
            4   C8y C    12.8549  -21.1400
            5   C8x C    12.8549  -19.7400
            6   C8y C    11.6424  -19.0400
            7   C1b C    14.0924  -21.8400
            8   C2b C    15.3049  -21.1400
            9   C2c C    16.5173  -21.8400
            10  C1b C    17.7297  -21.1400
            11  C1b C    18.9422  -21.8400
            12  C2b C    20.1546  -21.1400
            13  C2c C    21.3670  -21.8400
            14  C1a C    22.5795  -21.1400
            15  C6a C    11.6424  -17.6402
            16  O6a O    10.4132  -16.9303
            17  O6a O    12.8380  -16.9498
            18  O1a O    11.6424  -23.2398
            19  C1a C    16.5173  -23.2400
            20  C1a C    21.3670  -23.2399
            21  C1b C    14.0924  -21.8400
            22  C2b C    15.3049  -21.1400
            23  C2c C    16.5173  -21.8400
            24  C1b C    17.7297  -21.1400
            25  C1a C    16.5173  -23.2400
            26  C1b C    14.0924  -21.8400
            27  C2b C    15.3049  -21.1400
            28  C2c C    16.5173  -21.8400
            29  C1b C    17.7297  -21.1400
            30  C1a C    16.5173  -23.2400
            31  C1b C    14.0924  -21.8400
            32  C2b C    15.3049  -21.1400
            33  C2c C    16.5173  -21.8400
            34  C1b C    17.7297  -21.1400
            35  C1a C    16.5173  -23.2400
            36  C1b C    14.0924  -21.8400
            37  C2b C    15.3049  -21.1400
            38  C2c C    16.5173  -21.8400
            39  C1b C    17.7297  -21.1400
            40  C1a C    16.5173  -23.2400
BOND        40
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7    11  12 1
            8    12  13 2
            9    13  14 1
            10    6  15 1
            11   15  16 1
            12   15  17 2
            13    3  18 1
            14   13  20 1
            15    4   7 1
            16    7   8 1
            17    8   9 2
            18    9  10 1
            19    9  19 1
            20   10  21 1
            21   21  22 1
            22   22  23 2
            23   23  24 1
            24   23  25 1
            25   24  26 1
            26   26  27 1
            27   27  28 2
            28   28  29 1
            29   28  30 1
            30   29  31 1
            31   31  32 1
            32   32  33 2
            33   33  34 1
            34   33  35 1
            35   34  36 1
            36   36  37 1
            37   37  38 2
            38   38  39 1
            39   38  40 1
            40   39  11 1
BRACKET     1    13.6500  -22.8200   13.6500  -20.8600
            1    18.2000  -20.7200   18.2000  -22.6800
            1  5
 ORIGINAL  1    7   8   9  10  19
 REPEAT    1   21  22  23  24  25  26  27  28  29  30  31  32  33  34  35  36
            1   37  38  39  40

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