KEGG   COMPOUND: C20918
Entry
C20918                      Compound                               
Name
Tabtoxinine-beta-lactam
Formula
C7H12N2O4
Exact mass
188.0797
Mol weight
188.1812
Structure
Reaction
Pathway
map00261  Monobactam biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
2.3.1.-         3.4.-.-         6.3.2.-
Other DBs
PubChem: 254741381
KCF data

ATOM        13
            1   O6a O    16.7415  -15.3435
            2   C6a C    17.9549  -16.0441
            3   C1c C    19.1687  -15.3435
            4   C1b C    20.3821  -16.0441
            5   C1b C    21.5956  -15.3435
            6   C1z C    22.8091  -16.0441
            7   O6a O    17.9549  -17.4451
            8   N1a N    19.1687  -13.9425
            9   C5x C    22.8091  -17.4449
            10  N1x N    24.2101  -17.4449
            11  C1x C    24.2101  -16.0441
            12  O5x O    21.8337  -18.4209
            13  O1a O    22.8091  -14.6441
BOND        13
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     6   5 1 #Down
            6     2   7 2
            7     3   8 1 #Up
            8     6   9 1
            9     9  10 1
            10   10  11 1
            11    6  11 1
            12    9  12 2
            13    6  13 1 #Up

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