KEGG   COMPOUND: C14120
Entry
C14120                      Compound                               

Name
2-Naphthoyl-CoA
Formula
C32H42N7O17P3S
Exact mass
921.1571
Mol weight
921.6989
Structure
Reaction
Pathway
map00626  Naphthalene degradation
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Enzyme
2.3.1.-         2.8.3.-
Other DBs
PubChem: 854356
ChEBI: 34300
PDB-CCD: J5H[PDBj]
NIKKAJI: J2.788.029K
LinkDB
KCF data

ATOM        60
            1   S2a S    15.1200  -20.5800
            2   C1b C    16.3100  -19.8800
            3   C1b C    17.5700  -20.5800
            4   N1b N    18.7600  -19.8800
            5   C5a C    19.9500  -20.5800
            6   C1b C    21.2100  -19.8800
            7   C1b C    22.4000  -20.5800
            8   N1b N    23.5900  -19.8800
            9   C5a C    24.8500  -20.5800
            10  C1c C    26.0400  -19.8800
            11  C1d C    27.2300  -20.5800
            12  C1b C    28.4200  -19.8800
            13  O2b O    29.6800  -20.5800
            14  O5a O    19.9500  -21.9800
            15  O5a O    24.8500  -21.9800
            16  O1a O    26.0400  -18.4800
            17  C1a C    27.2300  -19.1800
            18  C1a C    27.2300  -21.9800
            19  P1b P    31.0800  -20.5800
            20  O1c O    32.4800  -20.5800
            21  O1c O    31.0800  -21.9800
            22  C1y C    24.5700  -15.6100
            23  C1y C    25.9700  -15.6100
            24  C1y C    26.3900  -14.2800
            25  O2x O    25.2700  -13.4400
            26  C1y C    24.1500  -14.2800
            27  C1b C    27.7200  -13.8600
            28  O1a O    23.7300  -16.7300
            29  O2b O    26.8100  -16.7300
            30  P1b P    28.2100  -16.7300
            31  O1c O    28.2100  -15.3300
            32  O1c O    29.6100  -16.7300
            33  O1c O    28.2100  -18.1300
            34  C8y C    20.0200  -12.4600
            35  C8y C    20.0200  -13.8600
            36  N4y N    22.4700  -13.8600
            37  C8x C    22.4700  -12.4600
            38  N5x N    21.2100  -11.7600
            39  C8y C    18.8300  -11.7600
            40  N5x N    17.5700  -12.4600
            41  C8x C    17.5700  -13.8600
            42  N5x N    18.8300  -14.5600
            43  N1a N    18.8300  -10.3600
            44  O2b O    29.6800  -14.2800
            45  P1b P    31.0800  -14.2800
            46  O1c O    31.0800  -12.8800
            47  O1c O    32.4800  -14.2800
            48  O2c O    31.0800  -17.5000
            49  C8y C    12.6000  -20.5800
            50  C8x C    12.6000  -21.9800
            51  C8x C    11.4100  -22.6800
            52  C8x C    11.4100  -19.8800
            53  C8y C    10.2200  -20.5800
            54  C8y C    10.2200  -21.9800
            55  C8x C     8.9600  -22.6800
            56  C8x C     7.7700  -21.9800
            57  C8x C     7.7700  -20.5800
            58  C8x C     8.9600  -19.8800
            59  C5a C    13.8600  -19.8800
            60  O5a O    13.8600  -18.4800
BOND        64
            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   58  53 1
            52   49  59 1
            53   49  50 1
            54   50  51 2
            55   51  54 1
            56   53  52 1
            57   52  49 2
            58   53  54 2
            59   54  55 1
            60   55  56 2
            61   56  57 1
            62   57  58 2
            63   59  60 2
            64    1  59 1

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