KEGG   COMPOUND: C16735
Entry
C16735                      Compound                               

Name
Corynantheal
Formula
C19H22N2O
Exact mass
294.1732
Mol weight
294.3908
Structure
Reaction
Pathway
map01063  Biosynthesis of alkaloids derived from shikimate pathway
Other DBs
PubChem: 96023259
ChEBI: 80695
NIKKAJI: J431.722J
LinkDB
KCF data

ATOM        22
            1   C8x C    22.4076  -18.5083
            2   C8x C    22.4076  -19.9040
            3   C8x C    23.6162  -20.6018
            4   C8y C    24.8251  -19.9040
            5   C8y C    24.8251  -18.5083
            6   C8x C    23.6162  -17.8103
            7   N4x N    26.1525  -20.3353
            8   C8y C    26.9729  -19.2062
            9   C8y C    26.1525  -18.0770
            10  C1y C    28.3610  -19.0603
            11  N1y N    28.9286  -17.7850
            12  C1x C    28.1083  -16.6559
            13  C1x C    26.7202  -16.8018
            14  C1x C    29.1768  -20.1833
            15  C1y C    30.5650  -20.0375
            16  C1b C    31.2629  -21.2462
            17  C1y C    31.2629  -18.8288
            18  C1x C    30.3204  -17.6388
            19  C2b C    32.6564  -18.8288
            20  C2a C    33.3532  -17.6219
            21  C4a C    32.6626  -21.2462
            22  O4a O    33.3624  -22.4583
BOND        25
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    8  10 1
            12   10  11 1
            13   11  12 1
            14   12  13 1
            15    9  13 1
            16   10  14 1
            17   14  15 1
            18   15  16 1
            19   15  17 1
            20   11  18 1
            21   18  17 1
            22   17  19 1 #Down
            23   19  20 2
            24   16  21 1
            25   21  22 2

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