KEGG   COMPOUND: C23039
Entry
C23039                      Compound                               
Name
Methyl nicotinate;
Nicitinic acid methyl ester
Formula
C7H7NO2
Exact mass
137.0477
Mol weight
137.14
Structure
Reaction
R13500
Pathway
map00960  Tropane, piperidine and pyridine alkaloid biosynthesis
Enzyme
2.1.1.401
Other DBs
CAS: 93-60-7
PubChem: 513131690
LinkDB
KCF data

ATOM        10
            1   C8y C    18.0552  -15.9459
            2   C8x C    16.7908  -15.2435
            3   C8x C    18.0552  -17.2806
            4   C7a C    19.2494  -15.2435
            5   C8x C    15.5967  -15.9459
            6   N5x N    16.7908  -18.0533
            7   O7a O    20.4436  -15.9459
            8   O6a O    19.2494  -13.8386
            9   C8x C    15.5967  -17.3508
            10  C1a C    21.6377  -15.2435
BOND        10
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 1
            7     4   8 2
            8     5   9 1
            9     6   9 2
            10    7  10 1

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