KEGG   COMPOUND: C23036
Entry
C23036                      Compound                               
Name
Ecgonone;
(1R,2R,5S)-8-Methyl-3-oxo-8-azabicyclo[3.2.1]octane-2-carboxylate
Formula
C9H13NO3
Exact mass
183.0895
Mol weight
183.20
Structure
Reaction
R13495 R13502 R13543 R13546
Pathway
map00960  Tropane, piperidine and pyridine alkaloid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.14.194     2.1.1.403
Other DBs
PubChem: 513131687
LinkDB
KCF data

ATOM        13
            1   C1x C    18.9700  -16.8700
            2   C1y C    17.7100  -15.9600
            3   C1y C    17.6400  -16.8700
            4   N1y N    16.8700  -15.0500
            5   C1x C    16.7300  -16.5200
            6   C1x C    16.1700  -17.5700
            7   C1y C    18.9700  -15.9600
            8   C5x C    19.9500  -17.3600
            9   O5x O    21.0000  -18.2700
            10  C1a C    16.8700  -13.6500
            11  C6a C    19.6700  -14.7000
            12  O6a O    21.0700  -14.7000
            13  O6a O    18.9700  -13.5100
BOND        14
            1     7   8 1
            2     1   3 1
            3     2   4 1
            4     2   5 1
            5     3   6 1
            6     3   4 1
            7     8   1 1
            8     8   9 2
            9     7   2 1
            10    4  10 1
            11    5   6 1
            12   11  12 2
            13   11  13 1
            14    7  11 1 #Up

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