KEGG   COMPOUND: C06515Help
Entry
C06515                      Compound                               

Name
Magnoline
Formula
C36H40N2O6
Exact mass
596.2886
Mol weight
596.7126
Structure
Mol fileKCF fileDB searchJmolKegDraw
Other DBs
CAS: 
6859-66-1
PubChem: 
ChEBI: 
KNApSAcK: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        44
            1   C8y C    22.0727  -22.4485
            2   C1y C    23.2812  -21.7492
            3   C8y C    22.0665  -23.8473
            4   C8x C    20.8579  -21.7429
            5   C1b C    23.2873  -20.3442
            6   N1y N    24.4958  -22.4546
            7   C8x C    20.8579  -24.5527
            8   C1x C    23.2690  -24.5589
            9   C8y C    19.6431  -22.4485
            10  C8y C    24.5021  -19.6571
            11  C1x C    24.4652  -23.8473
            12  C1a C    25.7106  -21.7737
            13  C8y C    19.6431  -23.8473
            14  O1a O    18.4285  -21.7429
            15  C8x C    25.7106  -20.3627
            16  C8x C    24.5081  -18.2523
            17  O2a O    18.4285  -24.5527
            18  C8y C    26.9314  -19.6633
            19  C8x C    25.7229  -17.5528
            20  C1a C    17.2200  -23.8595
            21  O2a O    28.1340  -20.3687
            22  C8y C    26.9375  -18.2644
            23  C8y C    29.3425  -19.6756
            24  O1a O    28.1460  -17.5713
            25  C8x C    29.3486  -18.2767
            26  C8x C    30.5571  -20.3872
            27  C8x C    30.5694  -17.5773
            28  C8x C    31.7719  -19.6877
            29  C8y C    31.7779  -18.2829
            30  C1b C    32.9927  -17.5958
            31  C1y C    32.9988  -16.1908
            32  C8y C    34.2073  -15.4915
            33  N1y N    31.7902  -15.4854
            34  C8y C    34.2135  -14.0927
            35  C8x C    35.4221  -16.1971
            36  C1x C    31.8148  -14.0927
            37  C1a C    30.5694  -16.1663
            38  C8x C    35.4221  -13.3873
            39  C1x C    33.0110  -13.3811
            40  C8y C    36.6369  -15.4915
            41  C8y C    36.6369  -14.0927
            42  O1a O    37.8515  -16.1971
            43  O2a O    37.8515  -13.3873
            44  C1a C    39.0600  -14.0805
BOND        49
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    6  11 1
            11    6  12 1
            12    7  13 1
            13    9  14 1
            14   10  15 2
            15   10  16 1
            16   13  17 1
            17   15  18 1
            18   16  19 2
            19   17  20 1
            20   18  21 1
            21   18  22 2
            22   21  23 1
            23   22  24 1
            24   23  25 2
            25   23  26 1
            26   25  27 1
            27   26  28 2
            28   27  29 2
            29   29  30 1
            30   30  31 1
            31   31  32 1
            32   31  33 1
            33   32  34 1
            34   32  35 2
            35   33  36 1
            36   33  37 1
            37   34  38 2
            38   34  39 1
            39   35  40 1
            40   38  41 1
            41   40  42 1
            42   41  43 1
            43   43  44 1
            44    8  11 1
            45    9  13 2
            46   19  22 1
            47   28  29 1
            48   36  39 1
            49   40  41 2

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