COMPOUND: C20717
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Entry
C20717 Compound
Name
4-Hydroxy-2,5-dimethylfuran-3(2H)-one;
Dimethylhydroxy furanone
Formula
C6H8O3
Exact mass
128.0473
Mol weight
128.1259
Structure
Mol file
KCF file
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Reaction
R10593
Enzyme
1.3.1.105
Other DBs
CAS:
3658-77-3
PubChem:
254741186
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KCF data
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ATOM 9
1 C2y C 17.9200 -16.7300
2 C2y C 17.5000 -15.4000
3 O2x O 18.6200 -14.5600
4 C1y C 19.8100 -15.4000
5 C5x C 19.3200 -16.7300
6 O1a O 17.1500 -17.8500
7 C1a C 16.1700 -14.9800
8 C1a C 21.0700 -14.9100
9 O5x O 20.2300 -17.8500
BOND 9
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 1 6 1
7 2 7 1
8 4 8 1
9 5 9 2
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