KEGG   COMPOUND: C18318
Entry
C18318                      Compound                               
Name
cis,cis-2,4-Dihydroxy-5-methyl-6-oxo-2,4-hexadienoate
Formula
C7H8O5
Exact mass
172.0372
Mol weight
172.1354
Structure
Reaction
Pathway
map00633  Nitrotoluene degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.13.11.-       3.7.1.-
Other DBs
PubChem: 103061500
ChEBI: 81669
KCF data

ATOM        12
            1   O1a O    24.3600  -18.5500
            2   C2c C    24.3600  -19.9500
            3   C2b C    25.5500  -20.6500
            4   C2c C    26.8100  -19.9500
            5   C6a C    26.8100  -18.5500
            6   O6a O    25.5500  -17.8500
            7   C2c C    23.1700  -20.6500
            8   C1a C    21.9800  -19.9500
            9   C4a C    23.1700  -22.0500
            10  O4a O    21.9800  -22.7500
            11  O6a O    28.0000  -17.8500
            12  O1a O    28.0000  -20.6500
BOND        11
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     2   7 2
            7     7   8 1
            8     7   9 1
            9     9  10 2
            10    5  11 1
            11    4  12 1

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