KEGG   COMPOUND: C00827Help
Entry
C00827                      Compound                               

Name
Lactoyl-CoA
Formula
C24H40N7O18P3S
Exact mass
839.1363
Mol weight
839.5968
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Propanoate metabolism
Styrene degradation
Metabolic pathways
Microbial metabolism in diverse environments
Enzyme
2.8.3.1         4.2.1.54
Other DBs
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        53
            1   C1c C    29.1424  -31.4300
            2   C5a C    30.3549  -30.7300
            3   S2a S    31.5673  -31.4300
            4   C1b C    32.7797  -30.7300
            5   C1b C    33.9922  -31.4300
            6   N1b N    35.2046  -30.7300
            7   C5a C    36.4170  -31.4300
            8   C1b C    37.6295  -30.7300
            9   C1b C    38.8419  -31.4300
            10  N1b N    40.0544  -30.7300
            11  C5a C    41.2668  -31.4300
            12  C1c C    42.4792  -30.7300
            13  C1d C    43.6917  -31.4300
            14  C1b C    44.9041  -30.7300
            15  O2b O    46.1165  -31.4300
            16  O5a O    30.3549  -29.3302
            17  O5a O    36.4170  -32.8299
            18  O5a O    41.2668  -32.8296
            19  O1a O    42.4792  -29.3300
            20  C1a C    43.6917  -30.0300
            21  C1a C    43.6917  -32.8300
            22  P1b P    47.5165  -31.4300
            23  O1c O    48.9165  -31.4300
            24  O1c O    47.5165  -32.8300
            25  C1y C    41.0200  -26.4600
            26  C1y C    42.4200  -26.4600
            27  C1y C    42.8526  -25.1285
            28  O2x O    41.7200  -24.3056
            29  C1y C    40.5874  -25.1285
            30  C1b C    44.1722  -24.6997
            31  O1a O    40.1971  -27.5926
            32  O2b O    43.2429  -27.5926
            33  P1b P    44.6429  -27.5926
            34  O1c O    44.6429  -26.1926
            35  O1c O    46.0429  -27.5926
            36  O1c O    44.6429  -28.9926
            37  C8y C    36.4700  -23.3100
            38  C8y C    36.4700  -24.7100
            39  N4y N    38.8949  -24.7100
            40  C8x C    38.8949  -23.3100
            41  N5x N    37.6824  -22.6100
            42  C8y C    35.2576  -22.6100
            43  N5x N    34.0451  -23.3100
            44  C8x C    34.0451  -24.7100
            45  N5x N    35.2576  -25.4100
            46  N1a N    35.2576  -21.2102
            47  O2b O    46.1545  -25.1320
            48  P1b P    47.5545  -25.1320
            49  O1c O    47.5545  -23.7320
            50  O1c O    48.9545  -25.1320
            51  O2c O    47.5545  -28.3520
            52  C1a C    27.9133  -30.7202
            53  O1a O    29.1423  -32.8298
BOND        55
            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    1  53 1

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