KEGG   COMPOUND: C18303
Entry
C18303                      Compound                               
Name
3,5-Dichloro-2-methylmuconate
Formula
C7H6Cl2O4
Exact mass
223.9643
Mol weight
225.0261
Structure
Reaction
R09214 R09215 R09221
Pathway
map00623  Toluene degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.13.11.-       5.5.1.7
Other DBs
PubChem: 103061485
ChEBI: 81654
LinkDB
KCF data

ATOM        13
            1   C2c C    24.7100  -21.1400
            2   C6a C    24.0100  -19.9500
            3   O6a O    24.7100  -18.7600
            4   X   Cl   26.1100  -18.7600
            5   C2c C    26.8100  -19.9500
            6   C2b C    26.1100  -21.1400
            7   X   Cl   24.0100  -22.4000
            8   O6a O    22.6800  -19.9500
            9   C2c C    28.2100  -19.9500
            10  C1a C    28.9100  -18.7600
            11  C6a C    28.9100  -21.1400
            12  O6a O    30.3100  -21.1400
            13  O6a O    28.1400  -22.3300
BOND        12
            1     1   2 1
            2     2   3 2
            3     4   5 1
            4     5   6 1
            5     1   6 2
            6     1   7 1
            7     2   8 1
            8     5   9 2
            9     9  10 1
            10    9  11 1
            11   11  12 1
            12   11  13 2

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