KEGG   COMPOUND: C01832Help
Entry
C01832                      Compound                               

Name
Lauroyl-CoA;
Lauroyl coenzyme A;
Dodecanoyl-CoA
Formula
C33H58N7O17P3S
Exact mass
949.2823
Mol weight
949.8366
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Fatty acid elongation
Fatty acid degradation
Metabolic pathways
Fatty acid metabolism
Enzyme
1.3.1.8         1.3.1.38        1.3.3.6         1.3.8.7         
1.3.8.8         1.3.99.-        2.3.1.16        2.3.3.2         
2.3.3.4
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA07 Fatty esters
   FA0705 Fatty acyl CoAs
    C01832  Dodecanoyl-CoA
BRITE hierarchy
Other DBs
CAS: 
6244-92-4
PubChem: 
ChEBI: 
LIPIDMAPS: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        61
            1   C1b C    34.1124  -39.2700
            2   C5a C    35.3249  -38.5700
            3   S2a S    36.5373  -39.2700
            4   C1b C    37.7497  -38.5700
            5   C1b C    38.9622  -39.2700
            6   N1b N    40.1746  -38.5700
            7   C5a C    41.3870  -39.2700
            8   C1b C    42.5995  -38.5700
            9   C1b C    43.8119  -39.2700
            10  N1b N    45.0244  -38.5700
            11  C5a C    46.2368  -39.2700
            12  C1c C    47.4492  -38.5700
            13  C1d C    48.6617  -39.2700
            14  C1b C    49.8741  -38.5700
            15  O2b O    51.0865  -39.2700
            16  O5a O    35.3249  -37.1702
            17  O5a O    41.3870  -40.6699
            18  O5a O    46.2368  -40.6696
            19  O1a O    47.4492  -37.1700
            20  C1a C    48.6617  -37.8700
            21  C1a C    48.6617  -40.6700
            22  P1b P    52.4865  -39.2700
            23  O1c O    53.8865  -39.2700
            24  O1c O    52.4865  -40.6700
            25  C1y C    45.9900  -34.3000
            26  C1y C    47.3900  -34.3000
            27  C1y C    47.8226  -32.9685
            28  O2x O    46.6900  -32.1456
            29  C1y C    45.5574  -32.9685
            30  C1b C    49.1422  -32.5397
            31  O1a O    45.1671  -35.4326
            32  O2b O    48.2129  -35.4326
            33  P1b P    49.6129  -35.4326
            34  O1c O    49.6129  -34.0326
            35  O1c O    51.0129  -35.4326
            36  O1c O    49.6129  -36.8326
            37  C8y C    41.4400  -31.1500
            38  C8y C    41.4400  -32.5500
            39  N4y N    43.8649  -32.5500
            40  C8x C    43.8649  -31.1500
            41  N5x N    42.6524  -30.4500
            42  C8y C    40.2276  -30.4500
            43  N5x N    39.0151  -31.1500
            44  C8x C    39.0151  -32.5500
            45  N5x N    40.2276  -33.2500
            46  N1a N    40.2276  -29.0502
            47  O2b O    51.1245  -32.9720
            48  P1b P    52.5245  -32.9720
            49  O1c O    52.5245  -31.5720
            50  O1c O    53.9245  -32.9720
            51  O2c O    52.5245  -36.1920
            52  C1b C    32.8776  -38.5700
            53  C1b C    31.6651  -39.2700
            54  C1b C    30.4527  -38.5700
            55  C1b C    29.2403  -39.2700
            56  C1b C    28.0278  -38.5700
            57  C1b C    26.8154  -39.2700
            58  C1b C    25.6030  -38.5700
            59  C1b C    24.3905  -39.2700
            60  C1b C    23.1781  -38.5700
            61  C1a C    21.9596  -39.2735
BOND        63
            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   55  56 1
            59   56  57 1
            60   57  58 1
            61   58  59 1
            62   59  60 1
            63   60  61 1

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