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  3. EAWAG-BBD - 2025-04-29 19:23
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  5. bt0425-3892

Saccharin > Catechol

Image Representation

SMIRKS Representation

O=[#6]-1-[#7]([H])S(=O)(=O)[c:2]2[c:14]([H])[c:13]([H])[c:12]([H])[c:11]([H])[c:1]-12>>[#8]([H])-[c:1]1[c:11]([H])[c:12]([H])[c:13]([H])[c:14]([H])[c:2]1-[#8]([H])

Reactant SMARTS

O=[#6]-1-[#7]([H])S(=O)(=O)[c:2]2[c:14]([H])[c:13]([H])[c:12]([H])[c:11]([H])[c:1]-12

Reactant Filter SMARTS

None

Reactant SMARTS

[#8]([H])-[c:1]1[c:11]([H])[c:12]([H])[c:13]([H])[c:14]([H])[c:2]1-[#8]([H])

Product Filter SMARTS

None

Included in Composite Rules

Scenarios

Reactions

Pathways