KEGG   COMPOUND: C18242
Entry
C18242                      Compound                               
Name
2,3,5-Trichlorodienelactone
Formula
C6HCl3O4
Exact mass
241.894
Mol weight
243.4287
Structure
Reaction
R09135 R09136
Pathway
map00361  Chlorocyclohexane and chlorobenzene degradation
map01120  Microbial metabolism in diverse environments
Enzyme
3.1.1.45        5.5.1.7
Other DBs
PubChem: 103061424
LinkDB
KCF data

ATOM        13
            1   O7x O    25.7903  -18.2763
            2   C2y C    26.9756  -19.1131
            3   C2y C    26.5572  -20.4378
            4   C2y C    25.0930  -20.4378
            5   C7x C    24.6746  -19.1131
            6   X   Cl   24.3260  -21.5535
            7   O6a O    23.3499  -18.6947
            8   C2c C    28.3004  -18.6947
            9   C6a C    28.5793  -17.3002
            10  X   Cl   29.3463  -19.6011
            11  O6a O    27.5334  -16.3938
            12  O6a O    29.9041  -16.8818
            13  X   Cl   27.3760  -21.5555
BOND        13
            1     4   6 1
            2     5   7 2
            3     1   2 1
            4     2   8 2
            5     3   4 2
            6     8   9 1
            7     4   5 1
            8     8  10 1
            9     5   1 1
            10    9  11 1
            11    2   3 1
            12    9  12 2
            13    3  13 1

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