KEGG   COMPOUND: C12345Help
Entry
C12345                      Compound                               

Name
1,3-Dimethyl-6,8-isoquinolinediol
Formula
C11H11NO2
Exact mass
189.079
Mol weight
189.2105
Structure
Mol fileKCF fileDB searchJmolKegDraw
Other DBs
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KCF data Show

ATOM        14
            1   C8y C    25.5969  -18.1624
            2   C8x C    25.5969  -19.5629
            3   C8y C    26.8127  -20.2631
            4   C8x C    26.8127  -17.4622
            5   C8y C    28.0214  -18.1624
            6   C8y C    28.0154  -19.5629
            7   C8y C    29.2253  -20.2682
            8   N5x N    30.4411  -19.5732
            9   C8y C    30.4472  -18.1728
            10  C8x C    29.2373  -17.4672
            11  O1a O    24.3845  -17.4615
            12  O1a O    26.8161  -21.6636
            13  C1a C    29.2893  -21.6687
            14  C1a C    31.6630  -17.4776
BOND        15
            1     5   4 2
            2     4   1 1
            3     5   6 1
            4     6   7 1
            5     7   8 2
            6     8   9 1
            7     9  10 2
            8    10   5 1
            9     1  11 1
            10    1   2 2
            11    3  12 1
            12    2   3 1
            13    7  13 1
            14    3   6 2
            15    9  14 1

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