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itaconate(2−)
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CHEBI:17240
Tanimoto Score: 1.0
Formula: C5H4O4
Mass: 128.083
Charge: -2
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itaconic acid
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CHEBI:30838
Tanimoto Score: 1.0
Formula: C5H6O4
Mass: 130.099
Charge: 0
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aconitate(3−)
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CHEBI:22210
Tanimoto Score: 0.83
Formula: C6H3O6
Mass: 171.08442
Charge: -3
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aconitic acid
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CHEBI:22211
Tanimoto Score: 0.83
Formula: C6H6O6
Mass: 174.10824
Charge: 0
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2-ethylacrylate
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CHEBI:84979
Tanimoto Score: 0.83
Formula: C5H7O2
Mass: 99.10840
Charge: -1
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cis-aconitate(3−)
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CHEBI:16383
Tanimoto Score: 0.83
Formula: C6H3O6
Mass: 171.08442
Charge: -3
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cis-aconitic acid
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CHEBI:32805
Tanimoto Score: 0.83
Formula: C6H6O6
Mass: 174.10824
Charge: 0
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