KEGG   COMPOUND: C14118Help
Entry
C14118                      Compound                               

Name
Naphthyl-2-hydroxymethyl-succinyl CoA
Formula
C36H48N7O20P3S
Exact mass
1023.1888
Mol weight
1023.7875
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00626  Naphthalene degradation
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Enzyme
1.1.-.-         4.2.1.-
Other DBs
PubChem: 854354
ChEBI: 34882
NIKKAJI: J2.788.027D
KCF data Show

ATOM        67
            1   C8y C    26.4292   -7.3042
            2   C8x C    26.4292   -8.1333
            3   C8x C    27.1495   -8.5500
            4   C8x C    27.1495   -6.8917
            5   C8y C    27.8657   -7.3042
            6   C8y C    27.8622   -8.1333
            7   C8x C    28.5790   -8.5530
            8   C8x C    29.2994   -8.1394
            9   C8x C    29.3030   -7.3103
            10  C8x C    28.5861   -6.8947
            11  C1c C    25.7107   -6.8913
            12  C1c C    24.9971   -7.3052
            13  C5a C    24.2818   -6.8942
            14  C1b C    24.9987   -8.1302
            15  C6a C    24.2851   -8.5441
            16  O5a O    23.5682   -7.3081
            17  O6a O    23.5698   -8.1331
            18  O6a O    24.2867   -9.3691
            19  S2a S    24.2750   -6.0667
            20  N4y N    20.2374   -1.3866
            21  C1y C    19.9270   -2.6901
            22  C8y C    18.9270   -1.3866
            23  C8x C    20.2408   -0.6315
            24  O2x O    19.3064   -2.2418
            25  C1y C    19.6995   -3.3970
            26  C8y C    18.9270   -0.6315
            27  N5x N    18.2684   -1.7728
            28  N5x N    19.5857   -0.2487
            29  C1y C    18.6960   -2.6797
            30  C1y C    18.9339   -3.3970
            31  O1a O    20.1408   -4.0004
            32  C8y C    18.2684   -0.2556
            33  C8x C    17.6201   -1.3866
            34  C1b C    17.9960   -2.4590
            35  O2b O    18.5512   -3.9349
            36  N5x N    17.6201   -0.6315
            37  N1a N    18.2684    0.4956
            38  O2b O    16.9684   -2.9453
            39  P1b P    17.7546   -3.9280
            40  P1b P    15.7719   -2.9590
            41  O1c O    17.8098   -3.2142
            42  O1c O    17.0202   -3.9453
            43  O1c O    17.7477   -4.6832
            44  O2c O    15.7719   -4.5453
            45  O1c O    15.7788   -2.2004
            46  O1c O    15.0201   -2.9453
            47  P1b P    15.7753   -6.0763
            48  O2b O    16.5581   -6.0591
            49  O1c O    15.7650   -6.9625
            50  O1c O    15.0236   -6.0625
            51  C1b C    17.2029   -5.6866
            52  C1d C    17.8546   -6.0591
            53  C1c C    18.5029   -5.6866
            54  C1a C    17.8443   -6.7280
            55  C1a C    17.8374   -5.2866
            56  C5a C    19.1546   -6.0591
            57  O1a O    18.5029   -4.9349
            58  N1b N    19.8029   -5.6866
            59  O5a O    19.1546   -6.8108
            60  C1b C    20.4512   -6.0591
            61  C1b C    21.1029   -5.6866
            62  C5a C    21.7512   -6.0591
            63  N1b N    22.3995   -5.6866
            64  O5a O    21.7512   -6.8108
            65  C1b C    23.0512   -6.0591
            66  C1b C    23.6995   -5.6832
            67  O1a O    25.7091   -6.0663
BOND        71
            1    11  12 1
            2     2   3 1
            3    12  13 1
            4     3   6 2
            5    12  14 1
            6     5   4 2
            7    14  15 1
            8     4   1 1
            9    13  16 2
            10    5   6 1
            11   15  17 2
            12    6   7 1
            13   15  18 1
            14    7   8 2
            15   13  19 1
            16    8   9 1
            17    9  10 2
            18   10   5 1
            19    1  11 1
            20   21  20 1 #Up
            21   20  22 1
            22   20  23 1
            23   21  24 1
            24   21  25 1
            25   22  26 2
            26   22  27 1
            27   23  28 2
            28   24  29 1
            29   25  30 1
            30   25  31 1 #Down
            31   26  32 1
            32   27  33 2
            33   29  34 1 #Up
            34   30  35 1 #Down
            35   32  36 2
            36   32  37 1
            37   34  38 1
            38   35  39 1
            39   38  40 1
            40   39  41 1
            41   39  42 1
            42   39  43 2
            43   40  44 1
            44   40  45 1
            45   40  46 2
            46   44  47 1
            47   47  48 1
            48   47  49 1
            49   47  50 2
            50   48  51 1
            51   51  52 1
            52   52  53 1
            53   52  54 1
            54   52  55 1
            55   53  56 1
            56   53  57 1
            57   56  58 1
            58   56  59 2
            59   58  60 1
            60   60  61 1
            61   61  62 1
            62   62  63 1
            63   62  64 2
            64   63  65 1
            65   65  66 1
            66   66  19 1
            67   26  28 1
            68   29  30 1
            69   33  36 1
            70    1   2 2
            71   11  67 1

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