KEGG   COMPOUND: C20447Help
Entry
C20447                      Compound                               

Name
2-Oxoglutaryl-CoA;
2-Oxoglutaroyl-CoA
Formula
C26H40N7O20P3S
Exact mass
895.1262
Mol weight
895.617
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00365  Furfural degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
3.1.1.-
Other DBs
PubChem: 163312184
KCF data Show

ATOM        57
            1   S2a S    15.1173  -20.7900
            2   C1b C    16.3297  -20.0900
            3   C1b C    17.5422  -20.7900
            4   N1b N    18.7546  -20.0900
            5   C5a C    19.9670  -20.7900
            6   C1b C    21.1795  -20.0900
            7   C1b C    22.3919  -20.7900
            8   N1b N    23.6044  -20.0900
            9   C5a C    24.8168  -20.7900
            10  C1c C    26.0292  -20.0900
            11  C1d C    27.2417  -20.7900
            12  C1b C    28.4541  -20.0900
            13  O2b O    29.6665  -20.7900
            14  O5a O    19.9670  -22.1899
            15  O5a O    24.8168  -22.1896
            16  O1a O    26.0292  -18.6900
            17  C1a C    27.2417  -19.3900
            18  C1a C    27.2417  -22.1900
            19  P1b P    31.0665  -20.7900
            20  O1c O    32.4665  -20.7900
            21  O1c O    31.0665  -22.1900
            22  C1y C    24.5700  -15.8200
            23  C1y C    25.9700  -15.8200
            24  C1y C    26.4026  -14.4885
            25  O2x O    25.2700  -13.6656
            26  C1y C    24.1374  -14.4885
            27  C1b C    27.7222  -14.0597
            28  O1a O    23.7471  -16.9526
            29  O2b O    26.7929  -16.9526
            30  P1b P    28.1929  -16.9526
            31  O1c O    28.1929  -15.5526
            32  O1c O    29.5929  -16.9526
            33  O1c O    28.1929  -18.3526
            34  C8y C    20.0200  -12.6700
            35  C8y C    20.0200  -14.0700
            36  N4y N    22.4449  -14.0700
            37  C8x C    22.4449  -12.6700
            38  N5x N    21.2324  -11.9700
            39  C8y C    18.8076  -11.9700
            40  N5x N    17.5951  -12.6700
            41  C8x C    17.5951  -14.0700
            42  N5x N    18.8076  -14.7700
            43  N1a N    18.8076  -10.5702
            44  O2b O    29.7045  -14.4920
            45  P1b P    31.1045  -14.4920
            46  O1c O    31.1045  -13.0920
            47  O1c O    32.5045  -14.4920
            48  O2c O    31.1045  -17.7120
            49  C5a C    13.9069  -20.0912
            50  C5a C    12.7124  -20.7810
            51  O5a O    13.9068  -18.6902
            52  C1b C    11.5246  -20.0952
            53  C1b C    10.3336  -20.7831
            54  O5a O    12.7124  -22.1897
            55  C6a C     9.1440  -20.0963
            56  O6a O     7.9539  -20.7836
            57  O6a O     9.1437  -18.6902
BOND        59
            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 2
            57   53  55 1
            58   55  56 1
            59   55  57 2

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