KEGG   COMPOUND: C03188
Entry
C03188                      Compound                               

Name
omega-Carboxyacyl-CoA
Formula
C23H36N7O19P3S(CH2)n
Structure
Comment
Generic compound in reaction hierarchy
Reaction
Enzyme
Other DBs
PubChem: 6067
ChEBI: 37555
KCF data

ATOM        54
            1   C5a C    16.1000  -19.0400
            2   S2a S    17.2900  -19.7400
            3   C1b C    18.4800  -19.0400
            4   C1b C    19.7400  -19.7400
            5   N1b N    20.9300  -19.0400
            6   C5a C    22.1200  -19.7400
            7   C1b C    23.3800  -19.0400
            8   C1b C    24.5700  -19.7400
            9   N1b N    25.7600  -19.0400
            10  C5a C    27.0200  -19.7400
            11  C1c C    28.2100  -19.0400
            12  C1d C    29.4000  -19.7400
            13  C1b C    30.5900  -19.0400
            14  O2b O    31.8500  -19.7400
            15  O5a O    16.1000  -17.6400
            16  O5a O    22.1200  -21.1400
            17  O5a O    27.0200  -21.1400
            18  O1a O    28.2100  -17.6400
            19  C1a C    29.4000  -18.3400
            20  C1a C    29.4000  -21.1400
            21  P1b P    33.2500  -19.7400
            22  O1c O    34.6500  -19.7400
            23  O1c O    33.2500  -21.1400
            24  C1y C    26.7400  -14.7700
            25  C1y C    28.1400  -14.7700
            26  C1y C    28.5600  -13.4400
            27  O2x O    27.4400  -12.6000
            28  C1y C    26.3200  -13.4400
            29  C1b C    29.8900  -13.0200
            30  O1a O    25.9000  -15.8900
            31  O2b O    28.9800  -15.8900
            32  P1b P    30.3800  -15.8900
            33  O1c O    30.3800  -14.4900
            34  O1c O    31.7800  -15.8900
            35  O1c O    30.3800  -17.2900
            36  C8y C    22.1900  -11.6200
            37  C8y C    22.1900  -13.0200
            38  N4y N    24.6400  -13.0200
            39  C8x C    24.6400  -11.6200
            40  N5x N    23.3800  -10.9200
            41  C8y C    21.0000  -10.9200
            42  N5x N    19.7400  -11.6200
            43  C8x C    19.7400  -13.0200
            44  N5x N    21.0000  -13.7200
            45  N1a N    21.0000   -9.5200
            46  O2b O    31.8500  -13.4400
            47  P1b P    33.2500  -13.4400
            48  O1c O    33.2500  -12.0400
            49  O1c O    34.6500  -13.4400
            50  O2c O    33.2500  -16.6600
            51  C1b C    14.4900  -19.7400
            52  C6a C    12.9500  -19.0400
            53  O6a O    11.7600  -19.7400
            54  O6a O    12.9500  -17.6400
BOND        56
            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   13  14 1
            14    1  15 2
            15    6  16 2
            16   10  17 2
            17   11  18 1 #Down
            18   12  19 1
            19   12  20 1
            20   14  21 1
            21   21  22 2
            22   21  23 1
            23   24  25 1
            24   25  26 1
            25   26  27 1
            26   27  28 1
            27   24  28 1
            28   26  29 1 #Down
            29   24  30 1 #Up
            30   25  31 1 #Up
            31   31  32 1
            32   32  33 1
            33   32  34 1
            34   32  35 2
            35   36  37 2
            36   37  38 1
            37   38  39 1
            38   39  40 2
            39   36  40 1
            40   36  41 1
            41   41  42 2
            42   42  43 1
            43   43  44 2
            44   37  44 1
            45   41  45 1
            46   28  38 1 #Down
            47   29  46 1
            48   46  47 1
            49   47  48 1
            50   47  49 2
            51   47  50 1
            52   21  50 1
            53    1  51 1
            54   51  52 1
            55   52  53 1
            56   52  54 2
BRACKET     1    14.1400  -20.6500   14.1400  -18.4800
            1    14.9800  -18.4800   14.9800  -20.6500
            1  n
 ORIGINAL  1   51
 REPEAT    1

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