KEGG   COMPOUND: C02371
Entry
C02371                      Compound                               
Name
4-Fluorobenzoate;
4-Fluorobenzoic acid
Formula
C7H5FO2
Exact mass
140.0274
Mol weight
140.1118
Structure
Reaction
R08110 R08117
Pathway
map00364  Fluorobenzoate degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Enzyme
1.14.12.10      6.2.1.33
Other DBs
CAS: 456-22-4
PubChem: 5413
ChEBI: 20364 27893
PDB-CCD: 1Y6[PDBj]
NIKKAJI: J43.545G
LinkDB
KCF data

ATOM        10
            1   C8y C    18.4100  -13.7162
            2   C6a C    18.4037  -12.3214
            3   C8x C    17.2008  -14.4072
            4   C8x C    19.6320  -14.4072
            5   O6a O    19.6129  -11.6302
            6   O6a O    17.1943  -11.6367
            7   C8x C    17.2008  -15.8148
            8   C8x C    19.6320  -15.8148
            9   C8y C    18.4100  -16.5251
            10  X   F    18.4037  -17.9199
BOND        10
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     4   8 2
            8     7   9 2
            9     9  10 1
            10    8   9 1

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