KEGG   COMPOUND: C09634
Entry
C09634                      Compound                               
Name
Rugosinone;
1,3-Dioxolo[4,5-g]isoquinolin-5-yl(2-hydroxy-3,4-dimethoxyphenyl)methanone
Formula
C19H15NO6
Exact mass
353.0899
Mol weight
353.3255
Structure
Other DBs
CAS: 73609-04-8
PubChem: 11824
ChEBI: 8912
KNApSAcK: C00001913 C00024767
3DMET: B03148
NIKKAJI: J11.917B
LinkDB
KCF data

ATOM        26
            1   C8y C    26.6887  -18.1190
            2   C8y C    27.9009  -18.8241
            3   C8y C    26.6946  -16.7204
            4   C8x C    25.4824  -18.8183
            5   C5a C    27.9650  -20.2110
            6   N5x N    29.1129  -18.1307
            7   C8x C    25.4824  -16.0152
            8   C8x C    27.9126  -16.0212
            9   C8y C    24.2704  -18.1190
            10  C8y C    29.0955  -20.9161
            11  O5a O    26.6771  -20.9103
            12  C8x C    29.1187  -16.7321
            13  C8y C    24.2704  -16.7145
            14  O2x O    22.9301  -18.5501
            15  C8y C    30.3133  -20.2168
            16  C8x C    29.0896  -22.3206
            17  O2x O    22.9359  -16.2833
            18  C1x C    22.1085  -17.4081
            19  C8y C    31.5255  -20.9277
            20  O1a O    30.3016  -18.8124
            21  C8x C    30.3016  -23.0199
            22  C8y C    31.5196  -22.3322
            23  O2a O    32.7318  -20.2168
            24  O2a O    32.7258  -23.0199
            25  C1a C    33.9438  -20.9161
            26  C1a C    33.9380  -22.3322
BOND        29
            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     5  10 1
            10    5  11 2
            11    6  12 1
            12    7  13 2
            13    9  14 1
            14   10  15 1
            15   10  16 2
            16   13  17 1
            17   14  18 1
            18   15  19 2
            19   15  20 1
            20   16  21 1
            21   19  22 1
            22   19  23 1
            23   22  24 1
            24   23  25 1
            25   24  26 1
            26    8  12 2
            27    9  13 1
            28   17  18 1
            29   21  22 2

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