KEGG   COMPOUND: C22421
Entry
C22421                      Compound                               
Name
4-(1-Methyl-2-pyrrolidinyl)-3-oxobutanoate;
4-(1-Methyl-2-pyrrolidinyl)-3-oxobutanoic acid
Formula
C9H15NO3
Exact mass
185.1052
Mol weight
185.22
Structure
Reaction
R06732 R08427 R12915 R13544 R13546
Pathway
map00960  Tropane, piperidine and pyridine alkaloid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.14.194     2.3.1.74
Other DBs
PubChem: 497619780
LinkDB
KCF data

ATOM        13
            1   C1x C    21.2122  -16.6657
            2   C1x C    21.6327  -17.9974
            3   C1x C    23.0345  -17.9974
            4   C1y C    23.4550  -16.6657
            5   N1y N    22.3336  -15.8247
            6   C1a C    22.3336  -14.4229
            7   C1b C    24.7425  -16.1158
            8   C5a C    25.9549  -16.8158
            9   C1b C    27.1673  -16.1158
            10  C6a C    28.3798  -16.8158
            11  O6a O    29.5922  -16.1158
            12  O5a O    25.9549  -18.2158
            13  O6a O    28.3798  -18.2158
BOND        13
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     5   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12    8  12 2
            13   10  13 2

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