KEGG   COMPOUND: C21512Help
Entry
C21512                      Compound                               

Name
15,17(3)-Seco-F430-17(3)-acid
Formula
C42H53N6NiO14
Exact mass
923.2973
Mol weight
924.5954
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00860  Porphyrin and chlorophyll metabolism
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01120  Microbial metabolism in diverse environments
Module
M00836  Coenzyme F430 biosynthesis, sirohydrochlorin => coenzyme F430
Enzyme
6.3.3.7         6.4.1.9
Other DBs
PubChem: 336445150
KCF data Show

ATOM        63
            1   C1y C    17.5556  -13.4480
            2   C1y C    16.3494  -12.8052
            3   C1x C    18.8032  -12.9827
            4   N2x N    17.3377  -14.7866
            5   C1z C    15.3609  -13.7649
            6   C1b C    16.3668  -11.4435
            7   C1z C    20.0150  -13.4941
            8   C2y C    15.9876  -14.9998
            9   C1b C    13.6039  -14.2394
            10  C1a C    14.8497  -12.4999
            11  C1b C    15.1883  -10.7535
            12  C1z C    21.1866  -12.7995
            13  N2x N    20.3020  -14.8271
            14  C1x C    15.3322  -16.2520
            15  C5a C    12.7641  -13.2652
            16  C6a C    15.2055   -9.3967
            17  C1y C    22.2097  -13.7073
            18  C1x C    21.1809  -11.4206
            19  C1a C    22.5369  -11.7353
            20  C2y C    21.6579  -14.9537
            21  C1y C    15.9876  -17.4984
            22  N1a N    11.0195  -13.2676
            23  O5a O    12.8344  -11.9416
            24  O6a O    13.9492   -8.5333
            25  O6a O    16.3955   -8.7259
            26  C1b C    23.5714  -13.7016
            27  C2x C    22.1694  -16.2174
            28  C1y C    15.3609  -18.7288
            29  N2x N    17.3320  -17.7001
            30  C1b C    24.2442  -12.5115
            31  C2y C    21.6233  -17.4754
            32  C1y C    16.3437  -19.6710
            33  C1b C    14.0224  -18.9465
            34  C2y C    17.5499  -19.0502
            35  C6a C    25.6115  -12.4999
            36  C1y C    22.2155  -18.7231
            37  N1y N    20.2731  -17.6655
            38  C1b C    16.3322  -21.0386
            39  C6a C    13.5456  -20.2160
            40  C2x C    18.8032  -19.5155
            41  O6a O    26.2832  -11.3168
            42  O6a O    26.3004  -13.6842
            43  C1y C    21.2212  -19.6481
            44  C1b C    23.5309  -18.3613
            45  C2y C    20.0265  -19.0041
            46  C1b C    15.1377  -21.7217
            47  O6a O    12.2070  -20.4465
            48  O6a O    14.4071  -21.2679
            49  C1b C    21.3537  -21.0040
            50  C6a C    24.4966  -19.3082
            51  C6a C    15.1320  -23.0949
            52  C1b C    22.6001  -21.5731
            53  O6a O    25.8121  -18.9523
            54  O6a O    24.1578  -20.6366
            55  O6a O    13.9534  -23.7676
            56  O6a O    16.3033  -23.7792
            57  C6a C    22.7269  -22.9348
            58  O6a O    21.6061  -23.7158
            59  O6a O    23.9792  -23.4911
            60  Z   Ni   18.6200  -16.2400 #+
            61  C5x C    20.1210  -10.8507
            62  N1x N    19.4427  -12.1418
            63  O5x O    20.1210   -9.4507
BOND        68
            1     1   2 1
            2     1   3 1 #Down
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1
            7     4   8 2
            8     5   9 1 #Up
            9     5  10 1 #Down
            10    6  11 1
            11    7  12 1
            12    7  13 1
            13    8  14 1
            14    9  15 1
            15   11  16 1
            16   12  17 1
            17   12  18 1 #Up
            18   12  19 1 #Down
            19   13  20 2
            20   21  14 1 #Up
            21   15  22 1
            22   15  23 2
            23   16  24 1
            24   16  25 2
            25   17  26 1 #Down
            26   20  27 1
            27   21  28 1
            28   21  29 1
            29   26  30 1
            30   27  31 2
            31   28  32 1
            32   28  33 1 #Down
            33   29  34 2
            34   30  35 1
            35   31  36 1
            36   31  37 1
            37   32  38 1 #Up
            38   33  39 1
            39   34  40 1
            40   35  41 1
            41   35  42 2
            42   36  43 1
            43   36  44 1 #Up
            44   37  45 1
            45   38  46 1
            46   39  47 1
            47   39  48 2
            48   43  49 1 #Down
            49   44  50 1
            50   46  51 1
            51   49  52 1
            52   50  53 1
            53   50  54 2
            54   51  55 1
            55   51  56 2
            56   52  57 1
            57   57  58 1
            58   57  59 2
            59    5   8 1
            60   17  20 1
            61   32  34 1
            62   40  45 2
            63   43  45 1
            64   37  60 1
            65   18  61 1
            66    7  62 1 #Up
            67   62  61 1
            68   61  63 2

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