KEGG   COMPOUND: C14119
Entry
C14119                      Compound                               

Name
Naphthyl-2-oxomethyl-succinyl-CoA
Formula
C36H46N7O20P3S
Exact mass
1021.1731
Mol weight
1021.7716
Structure
Reaction
Pathway
map00626  Naphthalene degradation
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Enzyme
1.1.-.-         2.3.1.-
Other DBs
PubChem: 854355
ChEBI: 34886
NIKKAJI: J2.788.028B
LinkDB
KCF data

ATOM        67
            1   S2a S    31.4973  -24.5700
            2   C1b C    32.7097  -23.8700
            3   C1b C    33.9222  -24.5700
            4   N1b N    35.1346  -23.8700
            5   C5a C    36.3470  -24.5700
            6   C1b C    37.5595  -23.8700
            7   C1b C    38.7719  -24.5700
            8   N1b N    39.9844  -23.8700
            9   C5a C    41.1968  -24.5700
            10  C1c C    42.4092  -23.8700
            11  C1d C    43.6217  -24.5700
            12  C1b C    44.8341  -23.8700
            13  O2b O    46.0465  -24.5700
            14  O5a O    36.3470  -25.9699
            15  O5a O    41.1968  -25.9696
            16  O1a O    42.4092  -22.4700
            17  C1a C    43.6217  -23.1700
            18  C1a C    43.6217  -25.9700
            19  P1b P    47.4465  -24.5700
            20  O1c O    48.8465  -24.5700
            21  O1c O    47.4465  -25.9700
            22  C1y C    40.9500  -19.6000
            23  C1y C    42.3500  -19.6000
            24  C1y C    42.7826  -18.2685
            25  O2x O    41.6500  -17.4456
            26  C1y C    40.5174  -18.2685
            27  C1b C    44.1022  -17.8397
            28  O1a O    40.1271  -20.7326
            29  O2b O    43.1729  -20.7326
            30  P1b P    44.5729  -20.7326
            31  O1c O    44.5729  -19.3326
            32  O1c O    45.9729  -20.7326
            33  O1c O    44.5729  -22.1326
            34  C8y C    36.4000  -16.4500
            35  C8y C    36.4000  -17.8500
            36  N4y N    38.8249  -17.8500
            37  C8x C    38.8249  -16.4500
            38  N5x N    37.6124  -15.7500
            39  C8y C    35.1876  -15.7500
            40  N5x N    33.9751  -16.4500
            41  C8x C    33.9751  -17.8500
            42  N5x N    35.1876  -18.5500
            43  N1a N    35.1876  -14.3502
            44  O2b O    46.0845  -18.2720
            45  P1b P    47.4845  -18.2720
            46  O1c O    47.4845  -16.8720
            47  O1c O    48.8845  -18.2720
            48  O2c O    47.4845  -21.4920
            49  C5a C    30.2869  -23.8712
            50  C1c C    29.0924  -24.5610
            51  O5a O    30.2868  -22.4702
            52  C5a C    27.9046  -23.8752
            53  C8y C    26.7136  -24.5631
            54  C1b C    29.0923  -25.9697
            55  O5a O    27.9044  -22.4702
            56  C8x C    25.5239  -23.8764
            57  C8y C    24.3115  -24.5765
            58  C8y C    24.3116  -25.9765
            59  C8x C    25.5013  -26.6632
            60  C8x C    26.7137  -25.9631
            61  C8x C    23.0990  -23.8765
            62  C8x C    21.8867  -24.5766
            63  C8x C    21.8868  -25.9766
            64  C8x C    23.0993  -26.6765
            65  C6a C    30.3255  -26.6819
            66  O6a O    31.5314  -25.9858
            67  O6a O    30.3252  -28.0699
BOND        71
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12   12  13 1
            13    5  14 2
            14    9  15 2
            15   10  16 1 #Down
            16   11  17 1
            17   11  18 1
            18   13  19 1
            19   19  20 2
            20   19  21 1
            21   22  23 1
            22   23  24 1
            23   24  25 1
            24   25  26 1
            25   22  26 1
            26   24  27 1 #Down
            27   22  28 1 #Up
            28   23  29 1 #Up
            29   29  30 1
            30   30  31 1
            31   30  32 1
            32   30  33 2
            33   34  35 2
            34   35  36 1
            35   36  37 1
            36   37  38 2
            37   34  38 1
            38   34  39 1
            39   39  40 2
            40   40  41 1
            41   41  42 2
            42   35  42 1
            43   39  43 1
            44   26  36 1 #Down
            45   27  44 1
            46   44  45 1
            47   45  46 1
            48   45  47 2
            49   45  48 1
            50   19  48 1
            51    1  49 1
            52   49  50 1
            53   49  51 2
            54   50  52 1
            55   52  53 1
            56   50  54 1
            57   52  55 2
            58   53  56 2
            59   56  57 1
            60   57  58 2
            61   58  59 1
            62   59  60 2
            63   53  60 1
            64   57  61 1
            65   61  62 2
            66   62  63 1
            67   63  64 2
            68   58  64 1
            69   54  65 1
            70   65  66 1
            71   65  67 2

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