KEGG   COMPOUND: C06715Help
Entry
C06715                      Compound                               

Name
3-Oxopimeloyl-CoA;
3-Ketopimelyl-CoA
Formula
C28H44N7O20P3S
Exact mass
923.1575
Mol weight
923.6701
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
map00362  Benzoate degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.1.1.35        1.1.1.259       2.3.1.16
Other DBs
PubChem: 8939
ChEBI: 15492
LIPIDMAPS: LMFA07050251
NIKKAJI: J2.763.627F
KCF data Show

ATOM        59
            1   C1b C    16.0300  -22.1900
            2   C5a C    17.2900  -21.4900
            3   S2a S    18.4800  -22.1900
            4   C1b C    19.4600  -21.4900
            5   C1b C    20.7200  -22.1900
            6   N1b N    21.9100  -21.4900
            7   C5a C    23.1000  -22.1900
            8   C1b C    24.3600  -21.4900
            9   C1b C    25.5500  -22.1900
            10  N1b N    26.7400  -21.4900
            11  C5a C    28.0000  -22.1900
            12  C1c C    29.1900  -21.4900
            13  C1d C    30.3800  -22.1900
            14  C1b C    31.5700  -21.4900
            15  O2b O    32.8300  -22.1900
            16  O5a O    17.2900  -20.0900
            17  O5a O    23.1000  -23.5900
            18  O5a O    28.0000  -23.5900
            19  O1a O    29.1900  -20.0900
            20  C1a C    30.3800  -20.7900
            21  C1a C    30.3800  -23.5900
            22  P1b P    34.2300  -22.1900
            23  O1c O    35.6300  -22.1900
            24  O1c O    34.2300  -23.5900
            25  C1y C    27.7200  -17.2200
            26  C1y C    29.1200  -17.2200
            27  C1y C    29.5400  -15.8900
            28  O2x O    28.4200  -15.0500
            29  C1y C    27.3000  -15.8900
            30  C1b C    30.8700  -15.4700
            31  O1a O    26.8800  -18.3400
            32  O2b O    29.9600  -18.3400
            33  P1b P    31.3600  -18.3400
            34  O1c O    31.3600  -16.9400
            35  O1c O    32.7600  -18.3400
            36  O1c O    31.3600  -19.7400
            37  C8y C    23.1700  -14.0700
            38  C8y C    23.1700  -15.4700
            39  N4y N    25.6200  -15.4700
            40  C8x C    25.6200  -14.0700
            41  N5x N    24.3600  -13.3700
            42  C8y C    21.9800  -13.3700
            43  N5x N    20.7200  -14.0700
            44  C8x C    20.7200  -15.4700
            45  N5x N    21.9800  -16.1700
            46  N1a N    21.9800  -11.9700
            47  O2b O    32.8300  -15.8900
            48  P1b P    34.2300  -15.8900
            49  O1c O    34.2300  -14.4900
            50  O1c O    35.6300  -15.8900
            51  O2c O    34.2300  -19.1100
            52  C5a C    14.8400  -21.5600
            53  C1b C    13.6500  -22.1900
            54  O5a O    14.8400  -20.2300
            55  C1b C    12.5300  -21.5600
            56  C1b C    11.3400  -22.1900
            57  C6a C    10.2200  -21.5600
            58  O6a O    10.2200  -20.2300
            59  O6a O     9.1000  -22.1900
BOND        61
            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   14  15 1
            15    2  16 2
            16    7  17 2
            17   11  18 2
            18   12  19 1 #Down
            19   13  20 1
            20   13  21 1
            21   15  22 1
            22   22  23 2
            23   22  24 1
            24   25  26 1
            25   26  27 1
            26   27  28 1
            27   28  29 1
            28   25  29 1
            29   27  30 1 #Down
            30   25  31 1 #Up
            31   26  32 1 #Up
            32   32  33 1
            33   33  34 1
            34   33  35 1
            35   33  36 2
            36   37  38 2
            37   38  39 1
            38   39  40 1
            39   40  41 2
            40   37  41 1
            41   37  42 1
            42   42  43 2
            43   43  44 1
            44   44  45 2
            45   38  45 1
            46   42  46 1
            47   29  39 1 #Down
            48   30  47 1
            49   47  48 1
            50   48  49 1
            51   48  50 2
            52   48  51 1
            53   22  51 1
            54    1  52 1
            55   52  53 1
            56   52  54 2
            57   53  55 1
            58   55  56 1
            59   56  57 1
            60   57  58 1
            61   57  59 2

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