KEGG   COMPOUND: C04522Help
Entry
C04522                      Compound                               

Name
2-Chloro-2,5-dihydro-5-oxofuran-2-acetate;
5-Chloro-2,5-dihydro-2-oxofuran-5-acetate;
2-Chloro-5-oxo-2,5-dihydrofuran-2-acetate;
(2R)-2-Chloro-2,5-dihydro-5-oxofuran-2-acetate;
(+)-4-Chloromuconolactone
Formula
C6H5ClO4
Exact mass
175.9876
Mol weight
176.5545
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00361  Chlorocyclohexane and chlorobenzene degradation
map01120  Microbial metabolism in diverse environments
Enzyme
Other DBs
PubChem: 7134
ChEBI: 17337
3DMET: B00726
NIKKAJI: J316.368G
LinkDB All DBs
KCF data Show

ATOM        11
            1   C7x C    16.3875  -15.9151
            2   C2x C    16.8321  -17.2324
            3   C2x C    18.2223  -17.2166
            4   C1z C    18.6370  -15.8896
            5   O7x O    17.5030  -15.0852
            6   O6a O    15.0712  -15.5036
            7   C1b C    19.8337  -15.2004
            8   C6a C    21.0378  -15.8955
            9   O6a O    22.2418  -15.2004
            10  O6a O    21.0378  -17.2857
            11  X   Cl   19.8982  -16.7336
BOND        11
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    8  10 2
            11    4  11 1 #Down

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