KEGG   COMPOUND: C21217Help
Entry
C21217                      Compound                               

Name
Geranylgeranyl bacteriochlorophyllide a
Formula
C55H68MgN4O6
Exact mass
904.4989
Mol weight
905.4566
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00860  Porphyrin and chlorophyll metabolism
map01110  Biosynthesis of secondary metabolites
Enzyme
1.3.1.111       2.5.1.133
Other DBs
PubChem: 315431332
KCF data Show

ATOM        66
            1   C1b C    17.1959  -24.4088
            2   C2b C    18.3482  -23.7657
            3   C2c C    19.4934  -24.4443
            4   C1b C    20.6457  -23.7938
            5   C1b C    21.7837  -24.4725
            6   C2b C    22.9360  -23.8293
            7   C2c C    24.0812  -24.5008
            8   C1b C    25.2333  -23.8575
            9   C1b C    26.3715  -24.5361
            10  C2b C    27.5237  -23.8929
            11  C2c C    28.6689  -24.5644
            12  C1a C    28.7258  -25.8920
            13  C1a C    29.8271  -23.9155
            14  C1a C    24.0671  -25.8283
            15  C1a C    19.4793  -25.7718
            16  C1b C    16.0719  -23.7445
            17  C2c C    14.9267  -24.3807
            18  C2b C    13.8028  -23.7090
            19  C1b C    12.6576  -24.3452
            20  C1a C    14.9110  -25.6925
            21  O7a O    11.5301  -23.6786
            22  C7a C    11.5547  -22.3687
            23  O6a O    12.6927  -21.7325
            24  C1b C    10.4271  -21.6950
            25  C8y C    13.5037  -14.5802
            26  C8y C    12.2908  -15.0964
            27  N4y N    13.5985  -13.2547
            28  C8y C    14.7992  -15.0730
            29  C8y C    11.0486  -14.5976
            30  C1y C    12.8551  -16.3327
            31  C8y C    14.8887  -12.9457
            32  Z   Mg   12.2311  -11.8638
            33  C8y C    15.5899  -14.0626
            34  C5x C    14.1570  -16.3327
            35  C1y C     9.8720  -15.1925
            36  N5x N    10.8474  -13.2840
            37  C8x C    15.3641  -11.7561
            38  N4y N    10.7452  -10.4367
            39  C1a C    16.9212  -14.0626
            40  O5x O    15.1400  -17.2468
            41  C1y C     8.9330  -14.2405
            42  C8y C     9.5453  -13.0697
            43  C8y C    14.8701  -10.5678
            44  C8y C    10.9186   -9.1302
            45  C8y C     9.4318  -10.6686
            46  C1a C     7.6019  -14.2288
            47  C8x C     9.0163  -11.8989
            48  C1y C    15.4707   -9.3736
            49  N5x N    13.5693  -10.3724
            50  C8y C     9.7175   -8.5588
            51  C8x C    12.1128   -8.4756
            52  C8y C     8.8020   -9.5165
            53  C1y C    14.5258   -8.4581
            54  C8y C    13.3491   -9.0704
            55  C5a C     9.7058   -7.2217
            56  C1a C     7.4707   -9.5165
            57  C1a C    14.5141   -7.1211
            58  C1a C    10.8596   -6.5397
            59  O5a O     8.5401   -6.5670
            60  C1b C    16.7901   -9.1471
            61  C1a C    17.6451  -10.1749
            62  C1b C    10.4380  -16.3220
            63  C7a C    12.8415  -17.6862
            64  O7a O    11.6666  -18.3442
            65  C1a C    11.7229  -19.6977
            66  O6a O    14.0026  -18.3749
BOND        72
            1    21  22 1
            2     5   6 1
            3    22  23 2
            4    11  12 1
            5    22  24 1
            6     1   2 1
            7    11  13 1
            8     6   7 2
            9     7  14 1
            10    3   4 1
            11    3  15 1
            12    7   8 1
            13    1  16 1
            14   25  26 2
            15   25  27 1
            16   25  28 1
            17   26  29 1
            18   26  30 1
            19   27  31 1
            20   27  32 1
            21   28  33 2
            22   28  34 1
            23   29  35 1
            24   29  36 2
            25   31  37 2
            26   32  38 1
            27   33  39 1
            28   34  40 2
            29   35  41 1
            30   36  42 1
            31   37  43 1
            32   38  44 1
            33   38  45 1
            34   41  46 1 #Down
            35   42  47 2
            36   43  48 1
            37   43  49 2
            38   44  50 2
            39   44  51 1
            40   45  52 2
            41   48  53 1
            42   49  54 1
            43   50  55 1
            44   52  56 1
            45   53  57 1 #Down
            46   30  34 1
            47   31  33 1
            48   41  42 1
            49   45  47 1
            50   50  52 1
            51   51  54 2
            52   53  54 1
            53   16  17 1
            54   55  58 1
            55    8   9 1
            56   55  59 2
            57   17  18 2
            58   48  60 1 #Up
            59    4   5 1
            60   60  61 1
            61   18  19 1
            62   35  62 1 #Up
            63   62  24 1
            64    9  10 1
            65   30  63 1 #Down
            66   17  20 1
            67   63  64 1
            68    2   3 2
            69   64  65 1
            70   19  21 1
            71   63  66 2
            72   10  11 2

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