KEGG   COMPOUND: C18345
Entry
C18345                      Compound                               
Name
4-Carboxy-2-hydroxy-6-methoxy-6-oxohexa-2,4-dienoate
Formula
C8H8O7
Exact mass
216.027
Mol weight
216.1449
Structure
Reaction
R09272 R09273 R09274
Pathway
map00627  Aminobenzoate degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.13.11.8       1.13.11.-
Other DBs
PubChem: 124489019
ChEBI: 81691
LinkDB
KCF data

ATOM        15
            1   C2c C    26.0180  -18.1998
            2   C2b C    26.0180  -19.5998
            3   C2b C    27.2254  -17.5057
            4   C6a C    24.8104  -17.5057
            5   C2c C    27.2254  -20.2939
            6   C7a C    28.4328  -18.1998
            7   O6a O    24.8104  -16.1113
            8   O6a O    23.5970  -18.1998
            9   C6a C    28.4328  -19.5998
            10  O1a O    27.2254  -21.8334
            11  O7a O    29.6404  -17.5057
            12  O6a O    29.6404  -20.2939
            13  O6a O    28.4212  -20.9185
            14  O6a O    28.4328  -16.7998
            15  C1a C    30.8261  -18.1936
BOND        14
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 1
            7     4   8 2
            8     5   9 1
            9     5  10 1
            10    6  11 1
            11    9  12 1
            12    9  13 2
            13    6  14 2
            14   11  15 1

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