KEGG   COMPOUND: C03221Help
Entry
C03221                      Compound                               

Name
2-trans-Dodecenoyl-CoA;
(2E)-Dodec-2-enoyl-CoA;
(2E)-Dodecenoyl-CoA
Formula
C33H56N7O17P3S
Exact mass
947.2666
Mol weight
947.8207
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.-        4.2.1.17        4.2.1.74        
5.3.3.8
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA07 Fatty esters
   FA0705 Fatty acyl CoAs
    C03221  (2E)-Dodecenoyl-CoA
BRITE hierarchy
Other DBs
PubChem: 
ChEBI: 
LIPIDMAPS: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        61
            1   C2b C    17.9200  -21.0700
            2   C5a C    19.1800  -20.3700
            3   S2a S    20.3700  -21.0700
            4   C1b C    21.5600  -20.3700
            5   C1b C    22.8200  -21.0700
            6   N1b N    24.0100  -20.3700
            7   C5a C    25.2000  -21.0700
            8   C1b C    26.4600  -20.3700
            9   C1b C    27.6500  -21.0700
            10  N1b N    28.8400  -20.3700
            11  C5a C    30.1000  -21.0700
            12  C1c C    31.2900  -20.3700
            13  C1d C    32.4800  -21.0700
            14  C1b C    33.6700  -20.3700
            15  O2b O    34.9300  -21.0700
            16  O5a O    19.1800  -18.9700
            17  O5a O    25.2000  -22.4700
            18  O5a O    30.1000  -22.4700
            19  O1a O    31.2900  -18.9700
            20  C1a C    32.4800  -19.6700
            21  C1a C    32.4800  -22.4700
            22  P1b P    36.3300  -21.0700
            23  O1c O    37.7300  -21.0700
            24  O1c O    36.3300  -22.4700
            25  C1y C    29.8200  -16.1000
            26  C1y C    31.2200  -16.1000
            27  C1y C    31.6400  -14.7700
            28  O2x O    30.5200  -13.9300
            29  C1y C    29.4000  -14.7700
            30  C1b C    32.9700  -14.3500
            31  O1a O    28.9800  -17.2200
            32  O2b O    32.0600  -17.2200
            33  P1b P    33.4600  -17.2200
            34  O1c O    33.4600  -15.8200
            35  O1c O    34.8600  -17.2200
            36  O1c O    33.4600  -18.6200
            37  C8y C    25.2700  -12.9500
            38  C8y C    25.2700  -14.3500
            39  N4y N    27.7200  -14.3500
            40  C8x C    27.7200  -12.9500
            41  N5x N    26.4600  -12.2500
            42  C8y C    24.0800  -12.2500
            43  N5x N    22.8200  -12.9500
            44  C8x C    22.8200  -14.3500
            45  N5x N    24.0800  -15.0500
            46  N1a N    24.0800  -10.8500
            47  O2b O    34.9300  -14.7700
            48  P1b P    36.3300  -14.7700
            49  O1c O    36.3300  -13.3700
            50  O1c O    37.7300  -14.7700
            51  O2c O    36.3300  -17.9900
            52  C2b C    16.7300  -20.3700
            53  C1b C    15.5400  -21.0700
            54  C1b C    14.3500  -20.3700
            55  C1b C    13.1600  -21.0700
            56  C1b C    11.9700  -20.3700
            57  C1b C    10.7100  -21.0700
            58  C1b C     9.5200  -20.3700
            59  C1b C     8.3300  -21.0700
            60  C1b C     7.1400  -20.3700
            61  C1a C     5.8800  -21.0700
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 2
            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

» Japanese version

DBGET integrated database retrieval system