KEGG   COMPOUND: C11443
Entry
C11443                      Compound                               
Name
Aromatized deshydroxy-C-1027 chromophore
Formula
C43H44ClN3O12
Exact mass
829.2614
Mol weight
830.2754
Structure
Other DBs
PubChem: 13615
ChEBI: 2841
NIKKAJI: J1.797.517J
LinkDB
KCF data

ATOM        59
            1   C1z C    23.7018  -20.5462
            2   C1a C    23.7052  -22.2175
            3   C1a C    19.7266  -20.4181
            4   N1c N    20.9246  -21.1068
            5   C1y C    22.0899  -20.3496
            6   C1y C    22.8107  -21.5933
            7   C1y C    24.4883  -20.9761
            8   C1y C    25.9047  -21.4036
            9   O2x O    24.7288  -20.0410
            10  C1a C    22.8881  -19.3401
            11  O1a O    22.8449  -22.9706
            12  O1a O    25.1787  -22.1713
            13  O2a O    27.0026  -20.5798
            14  C1z C    28.2256  -19.5893
            15  C8x C    31.4726  -20.9523
            16  C8x C    32.6381  -20.2777
            17  C8y C    32.6381  -18.9286
            18  C8x C    31.4726  -18.2540
            19  C8y C    30.3070  -20.2777
            20  C8y C    30.3110  -18.9257
            21  C2y C    29.0347  -18.4996
            22  C2x C    28.2366  -17.3899
            23  C2x C    26.9365  -17.8178
            24  C2x C    26.9306  -19.1777
            25  C8y C    30.2842  -23.4678
            26  C8y C    30.2842  -24.7818
            27  C8x C    31.4217  -25.4424
            28  C8y C    32.5452  -24.7818
            29  C8x C    32.5452  -23.4678
            30  C8x C    31.4217  -22.8074
            31  O2x O    28.9882  -22.6170
            32  X   Cl   29.1498  -25.4429
            33  C1y C    33.6874  -25.4414
            34  C1x C    34.9617  -24.5059
            35  C1y C    33.7869  -18.2610
            36  C1x C    34.9284  -19.0622
            37  O7a O    33.7869  -17.0103
            38  C8y C    29.2020  -13.0051
            39  C8y C    29.2020  -14.3400
            40  N4x N    30.3537  -15.0006
            41  O2x O    30.3537  -12.3376
            42  C8y C    31.5052  -13.0051
            43  C8y C    31.4993  -14.3400
            44  C8y C    32.6379  -15.0058
            45  C8x C    33.7967  -14.3503
            46  C8y C    33.8028  -13.0153
            47  C8x C    32.6498  -12.3428
            48  C2a C    28.0398  -12.3369
            49  O5x O    28.0398  -15.0013
            50  O2a O    34.9541  -12.3460
            51  C1a C    36.1069  -13.0186
            52  C7a C    32.6320  -16.3337
            53  O6a O    31.4806  -16.9961
            54  C1y C    29.0209  -20.6879
            55  O7x O    34.9269  -20.3690
            56  C7x C    34.9573  -23.1953
            57  N1a N    33.7237  -26.7765
            58  O6a O    36.2637  -23.1912
            59  C1a C    20.9586  -22.4836
BOND        66
            1     6   7 1
            2     3   4 1
            3     7   8 1
            4     1   9 1
            5     8   9 1
            6     1   2 1
            7     1  10 1
            8     5   4 1
            9     1   5 1
            10    6  11 1
            11    7  12 1
            12    8  13 1
            13    5   6 1
            14   14  13 1 #Down
            15   25  26 2
            16   26  27 1
            17   27  28 2
            18   28  29 1
            19   29  30 2
            20   30  25 1
            21   25  31 1
            22   26  32 1
            23   28  33 1
            24   33  34 1
            25   34  56 1
            26   17  35 1
            27   19  15 1
            28   35  36 1
            29   15  16 2
            30   35  37 1 #Up
            31   16  17 1
            32   17  18 2
            33   18  20 1
            34   38  39 1
            35   39  40 1
            36   40  43 1
            37   42  41 1
            38   41  38 1
            39   19  20 2
            40   20  21 1
            41   14  54 1
            42   54  19 1
            43   42  43 2
            44   43  44 1
            45   44  45 2
            46   45  46 1
            47   46  47 2
            48   47  42 1
            49   38  48 2
            50   39  49 2
            51   46  50 1
            52   14  21 1
            53   50  51 1
            54   21  22 2
            55   44  52 1
            56   22  23 1
            57   52  53 2
            58   52  37 1
            59   23  24 2
            60   24  14 1
            61   36  55 1
            62   55  56 1
            63   54  31 1 #Up
            64   33  57 1 #Down
            65   56  58 2
            66    4  59 1

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