KEGG   COMPOUND: C21142
Entry
C21142                      Compound                               
Name
3,4-Dihydroxy-2-methy-4-[(2E,6E)-farnesyl]-3,4-dihydroquinoline 1-oxide
Formula
C25H35NO3
Exact mass
397.2617
Mol weight
397.55
Structure
Reaction
R11147 R11148
Enzyme
1.1.1.394
Other DBs
PubChem: 313046622
LinkDB
KCF data

ATOM        29
            1   C8x C    10.3716  -16.4555
            2   C8x C    10.3716  -17.8135
            3   C8x C    11.5259  -18.4926
            4   C8x C    11.5259  -15.7765
            5   C8y C    12.6802  -16.4555
            6   C8y C    12.6802  -17.8135
            7   N2y N    13.9025  -18.4926 #+
            8   C2y C    15.0568  -17.8135
            9   C1y C    15.0568  -16.4555
            10  C1z C    13.9025  -15.7765
            11  C1a C    16.2112  -18.4926
            12  O1a O    16.2112  -15.7765
            13  O3a O    13.9025  -19.8506 #-
            14  C1b C    13.9025  -13.1962
            15  C2b C    15.1247  -12.5172
            16  C2c C    16.2791  -13.1962
            17  C1b C    17.4334  -12.5172
            18  C1b C    18.6556  -13.1962
            19  C2b C    19.8100  -12.5172
            20  C2c C    20.9644  -13.1962
            21  C1b C    22.1187  -12.4493
            22  C1b C    23.3410  -13.1283
            23  C2b C    24.4953  -12.4493
            24  C2c C    25.6497  -13.1283
            25  C1a C    26.8719  -12.4493
            26  C1a C    16.2791  -14.5542
            27  C1a C    20.9644  -14.5542
            28  C1a C    25.6497  -14.4863
            29  O1a O    12.9126  -14.7866
BOND        30
            1     3   6 2
            2     5   4 2
            3     4   1 1
            4     5   6 1
            5     6   7 1
            6     7   8 2
            7     8   9 1
            8     9  10 1
            9    10   5 1
            10    8  11 1
            11    1   2 2
            12    2   3 1
            13    9  12 1
            14    7  13 1
            15   15  16 2
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 2
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   23  24 2
            24   24  25 1
            25   16  26 1
            26   14  15 1
            27   20  27 1
            28   24  28 1
            29   10  14 1
            30   10  29 1

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