KEGG   COMPOUND: C05773Help
Entry
C05773                      Compound                               

Name
Cobyrinate;
Cobyrinic acid;
Cob(II)yrinate;
Cob(II)yrinic acid
Formula
C45H59CoN4O14
Exact mass
938.336
Mol weight
938.9016
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Porphyrin and chlorophyll metabolism
Metabolic pathways
Enzyme
5.4.99.60       6.3.5.11
Other DBs
PubChem: 
ChEBI: 
3DMET: 
KCF data Show

ATOM        64
            1   C2y C    36.2090  -20.2417
            2   C1y C    35.0271  -19.6118
            3   C2y C    37.4314  -19.7858
            4   N1y N    35.9955  -21.5533
            5   C1z C    34.0586  -20.5522
            6   C1b C    35.0442  -18.2776
            7   C2y C    38.6188  -20.2869
            8   C1z C    34.6726  -21.7622
            9   C1b C    32.6301  -19.7826
            10  C1a C    32.9778  -17.5191
            11  C1b C    33.8893  -17.6016
            12  C1z C    39.7667  -19.6063
            13  N2x N    38.9000  -21.5929
            14  C1y C    34.6783  -24.2100
            15  C6a C    31.2617  -20.2604
            16  C6a C    33.9062  -16.2721
            17  C1y C    40.7691  -20.4958
            18  C1b C    39.7611  -18.2552
            19  C1a C    41.0410  -18.9538
            20  C2y C    40.2285  -21.7170
            21  O6a O    31.3324  -21.4903
            22  O6a O    30.0348  -19.4410
            23  O6a O    33.2415  -15.0713
            24  O6a O    35.0723  -15.6149
            25  C1b C    42.1033  -20.4902
            26  C6a C    40.9215  -17.5847
            27  C2x C    40.7297  -22.9553
            28  C1y C    34.0586  -25.4160
            29  N2x N    35.9899  -24.4080
            30  C1b C    42.7625  -19.3241
            31  O6a O    40.9215  -16.2561
            32  O6a O    42.0807  -18.2495
            33  C2y C    40.1946  -24.1879
            34  C1z C    35.0216  -26.3392
            35  C1b C    32.7470  -25.6293
            36  C2y C    36.2034  -25.7310
            37  C6a C    44.1023  -19.3128
            38  C1z C    40.7748  -25.4105
            39  N2x N    38.8716  -24.3742
            40  C1b C    35.0103  -27.6792
            41  C6a C    32.2798  -26.8732
            42  C2y C    37.4314  -26.1868
            43  O6a O    44.7605  -18.1536
            44  O6a O    44.7773  -20.4732
            45  C1y C    39.8006  -26.3168
            46  C1a C    42.1251  -25.4447
            47  C2y C    38.6300  -25.6858
            48  C1b C    33.8397  -28.3485
            49  O6a O    30.9682  -27.0990
            50  O6a O    33.1239  -27.9039
            51  C1b C    39.8076  -27.5497
            52  C6a C    33.8342  -29.6940
            53  C1b C    41.1516  -28.2030
            54  O6a O    32.6794  -30.3531
            55  O6a O    34.9820  -30.3644
            56  C6a C    41.1053  -29.6053
            57  O6a O    40.2731  -30.4319
            58  O6a O    42.5369  -30.2186
            59  Z   Co   37.3521  -23.0463 #+
            60  C1a C    36.2479  -28.1999
            61  C1a C    33.5191  -22.4461
            62  C1a C    37.4587  -27.5369
            63  C1a C    37.4600  -18.4358
            64  C1a C    41.4374  -26.5725
BOND        68
            1     5   9 1 #Up
            2     5  10 1 #Down
            3     6  11 1
            4     7  12 1
            5     7  13 2
            6     8  14 1
            7     9  15 1
            8    11  16 1
            9    12  17 1
            10   12  18 1 #Up
            11   12  19 1 #Down
            12   13  20 1
            13   15  21 1
            14   15  22 2
            15   16  23 1
            16   16  24 2
            17   17  25 1 #Down
            18   18  26 1
            19   20  27 2
            20   14  28 1
            21   14  29 1
            22   25  30 1
            23   26  31 1
            24   26  32 2
            25   27  33 1
            26   28  34 1
            27   28  35 1 #Up
            28   29  36 2
            29   30  37 1
            30   33  38 1
            31   33  39 2
            32   34  40 1 #Down
            33   35  41 1
            34   36  42 1
            35   37  43 1
            36   37  44 2
            37   38  45 1
            38   38  46 1
            39   39  47 1
            40   40  48 1
            41   41  49 1
            42   41  50 2
            43   45  51 1 #Down
            44   48  52 1
            45   51  53 1
            46   52  54 1
            47   52  55 2
            48   53  56 1
            49   56  57 1
            50   56  58 2
            51    5   8 1
            52   17  20 1
            53   34  36 1
            54   42  47 2
            55   45  47 1
            56    1   2 1
            57    1   3 2
            58   34  60 1 #Up
            59    1   4 1
            60    2   5 1
            61    4  59 1
            62    8  61 1 #Down
            63    2   6 1 #Down
            64   42  62 1
            65    3   7 1
            66    3  63 1
            67    4   8 1
            68   38  64 1

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