KEGG   COMPOUND: C21168Help
Entry
C21168                      Compound                               

Name
4-Hydroxyisophthalate;
4-Hydroxy-1,3-benzenedicarboxylate
Formula
C8H6O5
Exact mass
182.0215
Mol weight
182.1302
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Toluene degradation
Microbial metabolism in diverse environments
Enzyme
1.14.13.-
Other DBs
CAS: 
636-46-4
PubChem: 
KCF data Show

ATOM        13
            1   C8x C    16.7996  -17.2195
            2   C8x C    16.7996  -15.8196
            3   C8y C    17.9895  -15.1196
            4   C8x C    19.1795  -15.8196
            5   C8y C    19.1795  -17.2195
            6   C8y C    17.9895  -17.9196
            7   O1a O    17.9895  -19.3195
            8   C6a C    20.4394  -17.9895
            9   C6a C    17.9895  -13.7196
            10  O6a O    19.2019  -13.0197
            11  O6a O    16.7760  -13.0190
            12  O6a O    21.6692  -17.3199
            13  O6a O    20.4744  -19.3895
BOND        13
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     6   7 1
            8     5   8 1
            9     3   9 1
            10    9  10 2
            11    9  11 1
            12    8  12 2
            13    8  13 1

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