KEGG   COMPOUND: C09992
Entry
C09992                      Compound                               
Name
Wilfordine
Formula
C43H49NO19
Exact mass
883.2899
Mol weight
883.8445
Structure
Other DBs
CAS: 37239-51-3
PubChem: 12178
ChEBI: 10039
KNApSAcK: C00001987
3DMET: B05410
NIKKAJI: J37.210B
LinkDB
KCF data

ATOM        63
            1   C1z C    29.1429  -19.3052
            2   C1z C    29.1488  -17.9505
            3   C1y C    30.3106  -19.9826
            4   O2x O    29.2055  -20.5957
            5   C1z C    27.9812  -19.9768
            6   C1y C    30.3223  -17.2788
            7   C1y C    27.9812  -17.2728
            8   C1b C    28.8743  -16.6366
            9   C1y C    31.4911  -19.3109
            10  O7a O    31.0522  -23.0149
            11  C1z C    31.4760  -20.6132
            12  C1y C    26.8006  -19.3052
            13  C1a C    27.8295  -21.1856
            14  C1y C    31.4969  -17.9622
            15  O7a O    30.3106  -15.9298
            16  C1y C    26.8006  -17.9505
            17  O7a O    27.9695  -15.9241
            18  O7a O    29.4469  -15.4278
            19  C7a C    32.3954  -23.0149
            20  C1x C    32.0004  -21.5699
            21  C1a C    32.8249  -20.6132
            22  O7x O    25.6389  -19.9651
            23  O7a O    32.6470  -17.2728
            24  C7a C    31.4734  -15.2465
            25  O7a O    25.6447  -17.2728
            26  C7a C    26.7948  -15.2465
            27  C7a C    29.1076  -14.1272
            28  C1a C    33.0728  -24.1826
            29  O6a O    33.0669  -21.8415
            30  O7x O    29.6449  -22.6688
            31  C7x C    24.2841  -19.9592
            32  C7a C    33.8205  -17.9388
            33  C1a C    32.6412  -15.9124
            34  O6a O    31.4677  -13.8977
            35  C7a C    24.4771  -17.9445
            36  C1a C    25.6389  -15.9241
            37  O6a O    26.7889  -13.8977
            38  C1a C    29.7945  -12.9678
            39  O6a O    27.7927  -13.8444
            40  C7x C    28.3017  -22.6688
            41  C1z C    24.2783  -21.3781
            42  O6a O    22.9992  -19.3998
            43  O6a O    34.9892  -17.2554
            44  C1a C    33.8147  -19.2875
            45  C8y C    23.3024  -17.2671
            46  O6a O    24.4714  -19.0814
            47  C8y C    27.6302  -23.8318
            48  O6a O    27.0641  -21.9167
            49  C1x C    25.6272  -21.9381
            50  C8y C    26.2870  -23.8318
            51  C8x C    28.3077  -24.9994
            52  C1x C    25.6215  -22.8788
            53  N5x N    25.6215  -24.9994
            54  C8x C    27.6302  -26.1612
            55  C8x C    26.2870  -26.1612
            56  C8x C    23.3104  -15.9205
            57  C8x C    22.1427  -15.2432
            58  C8x C    20.9732  -15.9175
            59  C8x C    20.9713  -17.2689
            60  C8x C    22.1391  -17.9464
            61  C1a C    23.5651  -22.6915
            62  O1a O    22.8866  -21.3759
            63  O1a O    26.7675  -20.7956
BOND        68
            1     3   9 1
            2     3  10 1 #Up
            3    11   4 1
            4     5  12 1
            5     5  13 1 #Down
            6     6  14 1
            7     6  15 1 #Down
            8     7  16 1
            9     7  17 1 #Down
            10    8  18 1
            11   10  19 1
            12   11  20 1 #Down
            13   11  21 1 #Up
            14   12  22 1 #Up
            15   14  23 1 #Down
            16   15  24 1
            17   16  25 1 #Down
            18   17  26 1
            19   18  27 1
            20   19  28 1
            21   19  29 2
            22   20  30 1
            23   22  31 1
            24   23  32 1
            25   24  33 1
            26   24  34 2
            27   25  35 1
            28   26  36 1
            29   26  37 2
            30   27  38 1
            31   27  39 2
            32   30  40 1
            33   31  41 1
            34   31  42 2
            35   32  43 2
            36   32  44 1
            37   35  45 1
            38   35  46 2
            39   40  47 1
            40   40  48 2
            41   41  49 1
            42   47  50 2
            43   47  51 1
            44   49  52 1
            45   50  53 1
            46   51  54 2
            47   53  55 2
            48    9  11 1 #Up
            49    9  14 1
            50   12  16 1
            51   50  52 1
            52   54  55 1
            53    1   2 1
            54    1   3 1
            55    1   4 1 #Up
            56    1   5 1
            57   45  56 2
            58   56  57 1
            59   57  58 2
            60   58  59 1
            61   59  60 2
            62   60  45 1
            63    2   6 1
            64   41  61 1
            65    2   7 1
            66   41  62 1
            67    2   8 1 #Down
            68    5  63 1 #Up

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