KEGG   COMPOUND: C20409Help
Entry
C20409                      Compound                               

Name
6,8-Dimethyl-6,7-didehydroergoline
Formula
C16H19N2
Exact mass
239.1548
Mol weight
239.3355
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00901  Indole alkaloid biosynthesis
map01130  Biosynthesis of antibiotics
Enzyme
Other DBs
PubChem: 163312146
KCF data Show

ATOM        18
            1   C8y C    18.6145  -18.5338
            2   C8x C    18.6186  -19.8942
            3   N4x N    16.2798  -19.9014
            4   C8y C    16.2756  -18.5409
            5   C8y C    17.4502  -17.8534
            6   C1y C    19.7794  -16.4981
            7   N2y N    20.9488  -15.8144 #+
            8   C1a C    22.1191  -16.4842
            9   C1y C    18.6028  -15.8265
            10  C1x C    18.5992  -14.4746
            11  C1y C    19.7695  -13.7976
            12  C1a C    19.7695  -12.4510
            13  C2x C    20.9399  -14.4675
            14  C8x C    15.0919  -17.8621
            15  C8x C    15.0919  -16.5085
            16  C8x C    16.2685  -15.8316
            17  C8y C    17.4319  -16.5085
            18  C1x C    19.7853  -17.8517
BOND        21
            1     2   3 1
            2    10  11 1
            3     1   2 2
            4    11  12 1
            5    11  13 1
            6     6   7 1
            7     3   4 1
            8     7   8 1
            9    14  15 2
            10   15  16 1
            11   16  17 2
            12    4  14 1
            13    4   5 2
            14    5   1 1
            15    5  17 1
            16   17   9 1
            17    9   6 1
            18    6  18 1
            19   18   1 1
            20    9  10 1
            21    7  13 2

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