COMPOUND: C20450
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Entry
C20450 Compound
Name
2,5-Furandicarboxylate;
Furan-2,5-dicarboxylate
Formula
C6H4O5
Exact mass
156.0059
Mol weight
156.093
Structure
Mol file
KCF file
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Reaction
R10213
R10857
R10858
Pathway
map00365
Furfural degradation
map01120
Microbial metabolism in diverse environments
Enzyme
1.1.3.47
Other DBs
CAS:
3238-40-2
PubChem:
163312187
PDB-CCD:
7FN
[
PDBj
]
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KCF data
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ATOM 11
1 C8x C 19.3668 -17.9280
2 C8y C 19.8028 -16.5968
3 O2x O 18.6666 -15.7702
4 C8y C 17.5303 -16.5968
5 C8x C 17.9661 -17.9280
6 C6a C 16.3179 -15.8906
7 O6a O 15.1082 -16.5909
8 C6a C 21.0080 -15.8906
9 O6a O 22.2177 -16.5909
10 O6a O 21.0044 -14.4986
11 O6a O 16.3197 -14.4900
BOND 11
1 4 5 2
2 5 1 1
3 4 6 1
4 1 2 2
5 6 7 1
6 2 3 1
7 2 8 1
8 3 4 1
9 8 9 1
10 8 10 2
11 6 11 2
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