Metabolite Structure Search

Draw a structure or enter SMILES to search metabolites

Loading structure editor...
Search mode:

Note: "Substructure" uses regex-based pattern matching (not true RDKit subgraph matching).

Limits for substructure search:

  • Max 50 characters
  • Max 20 atoms
  • Max 4 rings
  • Max 8 branches

Good for simple patterns like hydroxyl groups (O), methyl (C), phenyl (c1ccccc1). For larger molecules, use "Exact structure" search.

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