KEGG   COMPOUND: C21147
Entry
C21147                      Compound                               
Name
Asperlicin C
Formula
C25H18N4O2
Exact mass
406.143
Mol weight
406.436
Structure
Reaction
Enzyme
Other DBs
CAS: 93413-06-0
PubChem: 313046627
KCF data

ATOM        31
            1   C8y C    14.2085  -15.9154
            2   N4y N    15.3978  -15.3254
            3   C8y C    16.7222  -15.9364
            4   C1y C    17.0227  -17.2884
            5   C8y C    13.8898  -17.2824
            6   N1x N    16.1530  -18.3819
            7   C5x C    14.7569  -18.3753
            8   C8x C    13.1904  -14.9621
            9   C8x C    11.8558  -15.3670
            10  C8x C    11.5372  -16.7341
            11  C8x C    12.5552  -17.6874
            12  N5x N    17.8781  -15.1559
            13  C8y C    17.8501  -13.7646
            14  C8y C    16.5256  -13.1536
            15  C8y C    15.3698  -13.9341
            16  C8x C    19.0059  -13.1940
            17  C8x C    19.0479  -11.5928
            18  C8x C    17.7935  -10.9118
            19  C8x C    16.4977  -11.7624
            20  O5x O    14.1132  -13.3222
            21  O5x O    14.1474  -19.6291
            22  C1b C    18.2601  -17.9533
            23  C8y C    19.4681  -17.2560
            24  C8x C    20.6945  -17.9643
            25  N4x N    21.7473  -17.0168
            26  C8y C    21.1713  -15.7228
            27  C8y C    19.7628  -15.8706
            28  C8x C    21.7388  -14.4487
            29  C8x C    20.9192  -13.3203
            30  C8x C    19.5105  -13.4681
            31  C8x C    18.9431  -14.7422
BOND        36
            1     3   4 1
            2     1   5 2
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 1
            8     1   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 2
            12    5  11 1
            13    3  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17    2  15 1
            18   13  16 1
            19   16  17 2
            20   17  18 1
            21   18  19 2
            22   14  19 1
            23   15  20 2
            24    7  21 2
            25    4  22 1 #Down
            26   22  23 1
            27   23  24 2
            28   24  25 1
            29   25  26 1
            30   26  27 2
            31   23  27 1
            32   26  28 1
            33   28  29 2
            34   29  30 1
            35   30  31 2
            36   27  31 1

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