KEGG   COMPOUND: C00527Help
Entry
C00527                      Compound                               

Name
Glutaryl-CoA
Formula
C26H42N7O19P3S
Exact mass
881.1469
Mol weight
881.6335
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Fatty acid degradation
Lysine degradation
Benzoate degradation
Tryptophan metabolism
Metabolic pathways
Microbial metabolism in diverse environments
Biosynthesis of antibiotics
Module
M00032  
Lysine degradation, lysine => saccharopine => acetoacetyl-CoA
Enzyme
1.2.4.2         1.3.8.6         1.3.99.32       1.8.1.4         
2.3.1.16        2.3.1.61        6.2.1.6
Other DBs
CAS: 
3131-84-8
PubChem: 
ChEBI: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        56
            1   C1b C    30.6824  -30.0300
            2   C5a C    31.8949  -29.3300
            3   S2a S    33.1073  -30.0300
            4   C1b C    34.3197  -29.3300
            5   C1b C    35.5322  -30.0300
            6   N1b N    36.7446  -29.3300
            7   C5a C    37.9570  -30.0300
            8   C1b C    39.1695  -29.3300
            9   C1b C    40.3819  -30.0300
            10  N1b N    41.5944  -29.3300
            11  C5a C    42.8068  -30.0300
            12  C1c C    44.0192  -29.3300
            13  C1d C    45.2317  -30.0300
            14  C1b C    46.4441  -29.3300
            15  O2b O    47.6565  -30.0300
            16  O5a O    31.8949  -27.9302
            17  O5a O    37.9570  -31.4299
            18  O5a O    42.8068  -31.4296
            19  O1a O    44.0192  -27.9300
            20  C1a C    45.2317  -28.6300
            21  C1a C    45.2317  -31.4300
            22  P1b P    49.0565  -30.0300
            23  O1c O    50.4565  -30.0300
            24  O1c O    49.0565  -31.4300
            25  C1y C    42.5600  -25.0600
            26  C1y C    43.9600  -25.0600
            27  C1y C    44.3926  -23.7285
            28  O2x O    43.2600  -22.9056
            29  C1y C    42.1274  -23.7285
            30  C1b C    45.7122  -23.2997
            31  O1a O    41.7371  -26.1926
            32  O2b O    44.7829  -26.1926
            33  P1b P    46.1829  -26.1926
            34  O1c O    46.1829  -24.7926
            35  O1c O    47.5829  -26.1926
            36  O1c O    46.1829  -27.5926
            37  C8y C    38.0100  -21.9100
            38  C8y C    38.0100  -23.3100
            39  N4y N    40.4349  -23.3100
            40  C8x C    40.4349  -21.9100
            41  N5x N    39.2224  -21.2100
            42  C8y C    36.7976  -21.2100
            43  N5x N    35.5851  -21.9100
            44  C8x C    35.5851  -23.3100
            45  N5x N    36.7976  -24.0100
            46  N1a N    36.7976  -19.8102
            47  O2b O    47.6945  -23.7320
            48  P1b P    49.0945  -23.7320
            49  O1c O    49.0945  -22.3320
            50  O1c O    50.4945  -23.7320
            51  O2c O    49.0945  -26.9520
            52  C1b C    29.4533  -29.3202
            53  C1b C    28.2492  -30.0153
            54  C6a C    27.0663  -29.3322
            55  O6a O    25.8726  -30.0214
            56  O6a O    27.0663  -27.9302
BOND        58
            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   53  54 1
            57   54  55 1
            58   54  56 2

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