KEGG   COMPOUND: C21143
Entry
C21143                      Compound                               

Name
2'-N-Hydroxyrifampicin;
2'-N-Hydroxy-4-oxorifampicin
Formula
C43H58N4O13
Exact mass
838.4
Mol weight
838.9396
Structure
Reaction
Enzyme
Other DBs
PubChem: 313046623
KCF data

ATOM        60
            1   C1c C    14.9818  -12.6812
            2   C1c C    14.9818  -14.0983
            3   O1a O    17.3437  -14.0309
            4   C1c C    17.3437  -12.6812
            5   C1c C    16.1290  -12.0064
            6   C2b C    19.6381  -12.6812
            7   C1c C    18.4909  -12.0064
            8   C5a C    20.8527  -14.7732
            9   C2c C    22.0000  -14.0983
            10  C2b C    22.0000  -12.6812
            11  C2b C    20.8527  -12.0064
            12  C1a C    18.4909  -10.6567
            13  C1a C    16.1290  -10.6567
            14  O1a O    13.8346  -12.0064
            15  C1a C    23.1472  -14.7732
            16  O5a O    19.7055  -14.0983
            17  N1b N    20.8527  -16.3928
            18  C1c C    13.8346  -14.7732
            19  O7a O    12.6874  -14.0983
            20  C1c C    13.8346  -16.3928
            21  C2y C    19.7055  -17.0676
            22  C2y C    19.7055  -18.4173
            23  C2y C    18.4909  -16.3928
            24  C8y C    17.3437  -17.0676
            25  C8y C    17.3437  -18.4173
            26  C5x C    18.4909  -19.0921
            27  C8y C    16.1964  -16.3928
            28  C8y C    14.9818  -17.0676
            29  C8y C    14.9818  -18.4173
            30  C8y C    16.1964  -19.0921
            31  O1a O    18.4909  -15.0431
            32  O1a O    16.1964  -15.0431
            33  C1a C    13.8346  -13.0187
            34  C7a C    11.4726  -13.4235
            35  C1a C    10.3254  -14.0983
            36  O6a O    11.4726  -12.0738
            37  C1c C    12.6874  -17.0676
            38  O2a O    11.5401  -16.3928
            39  C2b C    12.6874  -18.4173
            40  C1a C    12.6874  -15.4480
            41  C1a C    10.3929  -17.0676
            42  C2b C    11.5401  -19.0921
            43  O2a O    11.5401  -20.4418
            44  O2x O    13.8346  -19.0921
            45  C1z C    13.8346  -20.4418
            46  C5x C    16.1964  -20.4418
            47  C1a C    13.8346  -21.7914
            48  C1a C    14.9818  -15.7179
            49  O5x O    18.4909  -20.4418
            50  O5x O    17.2762  -21.1166
            51  C2b C    20.8837  -19.1110
            52  N1c N    22.0790  -18.4342
            53  N1y N    23.2504  -19.1236
            54  C1x C    23.2386  -20.5108
            55  C1x C    24.4420  -21.2192
            56  N1y N    25.6573  -20.5314
            57  C1x C    25.6690  -19.1442
            58  C1x C    24.4657  -18.4357
            59  C1a C    26.8662  -21.2432
            60  O1b O    22.0790  -17.0342
BOND        64
            1     1   2 1
            2     4   3 1 #Down
            3     4   5 1
            4     1   5 1
            5     6   7 1
            6     4   7 1
            7     8   9 1
            8     9  10 2
            9    10  11 1
            10    6  11 2
            11    7  12 1 #Up
            12    5  13 1 #Down
            13    1  14 1 #Down
            14    9  15 1
            15    8  16 2
            16    8  17 1
            17    2  18 1
            18   18  19 1 #Up
            19   18  20 1
            20   17  21 1
            21   21  22 1
            22   21  23 2
            23   23  24 1
            24   24  25 1
            25   25  26 1
            26   24  27 2
            27   27  28 1
            28   28  29 2
            29   29  30 1
            30   25  30 2
            31   23  31 1
            32   27  32 1
            33    2  33 1 #Up
            34   19  34 1
            35   34  35 1
            36   34  36 2
            37   26  22 1
            38   20  37 1
            39   37  38 1 #Down
            40   37  39 1
            41   20  40 1 #Down
            42   38  41 1
            43   39  42 2
            44   42  43 1
            45   29  44 1
            46   44  45 1
            47   43  45 1
            48   30  46 1
            49   45  46 1
            50   45  47 1 #Down
            51   28  48 1
            52   26  49 2
            53   50  46 2
            54   22  51 2
            55   51  52 1
            56   52  53 1
            57   53  54 1
            58   54  55 1
            59   55  56 1
            60   56  57 1
            61   57  58 1
            62   53  58 1
            63   56  59 1
            64   52  60 1

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