KEGG   COMPOUND: C06782Help
Entry
C06782                      Compound                               

Name
7-Hydroxylpradimicin A
Formula
C40H44N2O19
Exact mass
856.2538
Mol weight
856.7794
Structure
Mol fileKCF fileDB searchJmolKegDraw
Other DBs
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KCF data Show

ATOM        61
            1   C8y C    29.4379  -17.2504
            2   C8y C    28.2162  -17.9255
            3   C8y C    30.6337  -17.9640
            4   C8y C    29.4637  -15.8487
            5   C8y C    28.1905  -19.3272
            6   C8y C    27.0074  -17.2181
            7   C1y C    30.6909  -19.3658
            8   C8x C    31.8554  -17.2953
            9   C8y C    30.6852  -15.1735
            10  O1a O    28.2419  -15.1415
            11  C8y C    26.9882  -20.0216
            12  C1y C    29.3928  -20.0473
            13  C8y C    25.7922  -17.9062
            14  O1a O    27.0010  -15.8165
            15  O2a O    31.8297  -20.0602
            16  C8y C    31.8812  -15.8937
            17  C5a C    30.6788  -13.7654
            18  C8y C    25.7793  -19.3078
            19  O1a O    27.0453  -21.4169
            20  O1a O    29.3865  -21.4555
            21  C5x C    24.5770  -17.2052
            22  C1y C    33.0320  -20.7609
            23  C1a C    33.0900  -15.1799
            24  N1b N    31.8240  -13.0581
            25  O5a O    29.4571  -13.0646
            26  C5x C    24.5641  -20.0087
            27  C8y C    23.3553  -17.8933
            28  O5x O    24.5641  -15.7907
            29  C1y C    33.0257  -22.1628
            30  O2x O    34.2474  -20.0665
            31  C1c C    31.8812  -11.6628
            32  C8y C    23.3488  -19.3015
            33  O5x O    24.5513  -21.4104
            34  C8x C    22.1401  -17.1989
            35  C1y C    34.2345  -22.8635
            36  O1a O    31.8105  -22.8506
            37  C1y C    35.3860  -20.7738
            38  C6a C    33.0900  -10.9555
            39  C1a C    30.6723  -10.9621
            40  C8y C    22.1401  -20.0087
            41  C8y C    20.9184  -17.8933
            42  C1y C    35.4497  -22.1691
            43  O2a O    34.2217  -24.2588
            44  C1a C    36.6586  -20.0602
            45  O6a O    34.2989  -11.6564
            46  O6a O    33.0835   -9.5602
            47  C8x C    20.9184  -19.3015
            48  O1a O    22.1272  -21.4104
            49  O2a O    19.6967  -17.1989
            50  N1b N    36.6520  -22.8635
            51  C1y C    33.0065  -24.9468
            52  C1a C    18.4878  -17.8869
            53  C1a C    37.8545  -22.1628
            54  C1y C    33.0065  -26.3485
            55  O2x O    31.7911  -24.2525
            56  C1y C    31.7976  -27.0494
            57  O1a O    34.2151  -27.0429
            58  C1x C    30.5824  -24.9532
            59  C1y C    30.5824  -26.3548
            60  O1a O    31.7848  -28.4445
            61  O1a O    29.3607  -27.0365
BOND        67
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     4  10 1
            10    5  11 2
            11    5  12 1
            12    6  13 1
            13    6  14 1
            14    7  15 1 #Down
            15    8  16 2
            16    9  17 1
            17   11  18 1
            18   11  19 1
            19   12  20 1 #Up
            20   13  21 1
            21   22  15 1 #Down
            22   16  23 1
            23   17  24 1
            24   17  25 2
            25   18  26 1
            26   21  27 1
            27   21  28 2
            28   22  29 1
            29   22  30 1
            30   24  31 1
            31   26  32 1
            32   26  33 2
            33   27  34 1
            34   29  35 1
            35   29  36 1 #Up
            36   30  37 1
            37   31  38 1
            38   31  39 1
            39   32  40 1
            40   34  41 2
            41   35  42 1
            42   35  43 1 #Down
            43   37  44 1 #Down
            44   38  45 1
            45   38  46 2
            46   40  47 2
            47   40  48 1
            48   41  49 1
            49   42  50 1 #Down
            50   51  43 1 #Up
            51   49  52 1
            52   50  53 1
            53   51  54 1
            54   51  55 1
            55   54  56 1
            56   54  57 1 #Down
            57   55  58 1
            58   56  59 1
            59   56  60 1 #Up
            60   59  61 1 #Down
            61    7  12 1
            62    9  16 1
            63   13  18 2
            64   27  32 2
            65   37  42 1
            66   41  47 1
            67   58  59 1

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