KEGG   COMPOUND: C06509
Entry
C06509                      Compound                               
Name
Adenosyl cobinamide phosphate;
Adenosylcobinamide phosphate
Formula
C58H85CoN16O14P
Exact mass
1319.5501
Mol weight
1320.30
Structure
Reaction
Pathway
map00860  Porphyrin metabolism
map01100  Metabolic pathways
map01240  Biosynthesis of cofactors
Module
M00122  Cobalamin biosynthesis, cobyrinate a,c-diamide => cobalamin
Enzyme
2.7.1.156       2.7.7.62        6.3.1.10
Other DBs
PubChem: 8740
ChEBI: 2481
LinkDB
KCF data

ATOM        90
            1   N1y N    23.0109  -17.3081
            2   N2x N    23.0109  -20.1215
            3   N2x N    25.8721  -17.3490
            4   N2x N    25.8448  -20.0806
            5   C1z C    21.7165  -17.5193
            6   C2y C    23.2357  -16.0274
            7   C1y C    21.7165  -19.9308
            8   C2y C    23.2290  -21.4158
            9   C2y C    25.5997  -16.0613
            10  C2y C    27.1868  -17.4715
            11  C2y C    25.6064  -21.3680
            12  C2y C    27.1528  -19.9103
            13  C1z C    21.1172  -16.3340
            14  C1a C    20.4291  -17.8599
            15  C1y C    22.0640  -15.4074
            16  C2y C    24.4280  -15.5710
            17  C1y C    21.1172  -21.1025
            18  C1z C    22.0640  -22.0221
            19  C2y C    24.4280  -21.8722
            20  C1z C    26.7372  -15.4005
            21  C1y C    27.7113  -16.2725
            22  C2x C    27.6773  -18.6910
            23  C1y C    26.7508  -21.9949
            24  C1z C    27.7182  -21.0956
            25  C1b C    19.8092  -16.3203
            26  C1a C    20.7697  -15.0532
            27  C1b C    22.0913  -14.0927
            28  C1a C    24.4210  -14.2425
            29  C1b C    19.8297  -21.3204
            30  C1b C    22.0504  -23.3299
            31  C1a C    23.7306  -24.1691
            32  C1a C    24.4210  -23.1938
            33  C1b C    26.7305  -14.0791
            34  C1a C    24.7633  -12.8969
            35  C1b C    29.0260  -16.2658
            36  C1b C    26.8871  -23.3096
            37  C1a C    28.6353  -20.1317
            38  C1a C    28.2018  -22.3355
            39  C5a C    19.1552  -15.1826
            40  C1b C    20.9605  -13.4319
            41  C5a C    19.3731  -22.5466
            42  C1b C    20.8991  -23.9908
            43  C5a C    27.8680  -13.4116
            44  C1b C    29.6732  -15.1214
            45  C1b C    28.0861  -23.8477
            46  N1a N    17.8542  -15.1759
            47  O5a O    19.8297  -14.0585
            48  C5a C    20.9741  -12.1172
            49  N1a N    18.0790  -22.7509
            50  O5a O    20.1975  -23.5480
            51  C5a C    20.9623  -25.3055
            52  N1a N    27.8612  -12.1036
            53  O5a O    29.0057  -14.0722
            54  C5a C    30.9879  -15.1145
            55  C5a C    28.2085  -25.1557
            56  N1a N    19.8433  -11.4564
            57  O5a O    22.1186  -11.4767
            58  N1b N    19.7615  -25.9663
            59  O5a O    22.0231  -25.9732
            60  N1a N    31.6420  -13.9770
            61  O5a O    31.6557  -16.2589
            62  N1a N    27.1392  -25.9118
            63  O5a O    29.4144  -25.7006
            64  C1b C    19.7615  -27.3219
            65  C1c C    18.5829  -28.0100
            66  O2b O    18.5829  -29.3656
            67  C1a C    17.4112  -27.3219
            68  P1b P    17.3773  -30.0673
            69  O1c O    18.2173  -31.2538
            70  O1c O    16.3747  -29.0856
            71  O1c O    16.0395  -30.9151
            72  Z   Co   24.4143  -18.6432 #+
            73  C1b C    29.0875  -18.6365
            74  C1y C    30.3749  -19.0656
            75  O2x O    31.4581  -18.2823
            76  C1y C    30.7973  -20.3463
            77  C1y C    32.5684  -19.1201
            78  C1y C    32.1529  -20.3463
            79  O1a O    30.3613  -21.6338
            80  N4y N    33.8288  -18.7113
            81  O1a O    32.7932  -21.4567
            82  C8y C    34.8711  -19.4334
            83  C8x C    34.2987  -17.3490
            84  C8y C    36.0767  -18.5480
            85  N5x N    34.9935  -20.8232
            86  N5x N    35.7089  -17.3557
            87  C8y C    37.3029  -19.0928
            88  C8x C    36.2948  -21.3953
            89  N5x N    37.4596  -20.5369
            90  N1a N    38.3792  -18.2823
BOND        97
            1     1   5 1
            2     1   6 1
            3     2   7 1
            4     2   8 2
            5     3   9 2
            6     3  10 1
            7     4  11 1
            8     4  12 2
            9     5  13 1
            10    5  14 1 #Down
            11    6  15 1
            12    6  16 2
            13    7  17 1
            14    8  18 1
            15    8  19 1
            16    9  20 1
            17   10  21 1
            18   10  22 2
            19   11  23 1
            20   12  24 1
            21   13  25 1 #Up
            22   13  26 1 #Down
            23   15  27 1 #Down
            24   16  28 1
            25   17  29 1 #Up
            26   18  30 1 #Down
            27   18  31 1 #Up
            28   19  32 1
            29   20  33 1 #Up
            30   20  34 1 #Down
            31   21  35 1 #Down
            32   23  36 1 #Down
            33   24  37 1
            34   24  38 1
            35   25  39 1
            36   27  40 1
            37   29  41 1
            38   30  42 1
            39   33  43 1
            40   35  44 1
            41   36  45 1
            42   39  46 1
            43   39  47 2
            44   40  48 1
            45   41  49 1
            46   41  50 2
            47   42  51 1
            48   43  52 1
            49   43  53 2
            50   44  54 1
            51   45  55 1
            52   48  56 1
            53   48  57 2
            54   51  58 1
            55   51  59 2
            56   54  60 1
            57   54  61 2
            58   55  62 1
            59   55  63 2
            60   58  64 1
            61   64  65 1
            62   65  66 1
            63   65  67 1 #Down
            64   66  68 1
            65   68  69 1
            66   68  70 1
            67   68  71 2
            68    5   7 1
            69    9  16 1
            70   11  19 2
            71   12  22 1
            72   13  15 1
            73   17  18 1
            74   20  21 1
            75   23  24 1
            76   72  73 1
            77   74  73 1 #Up
            78   74  75 1
            79   74  76 1
            80   75  77 1
            81   76  78 1
            82   76  79 1 #Down
            83   77  80 1 #Up
            84   78  81 1 #Down
            85   80  82 1
            86   80  83 1
            87   82  84 2
            88   82  85 1
            89   83  86 2
            90   84  87 1
            91   85  88 2
            92   87  89 2
            93   87  90 1
            94   77  78 1
            95   84  86 1
            96   88  89 1
            97    1  72 1

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