Main compound image
NA
  • InChIKey: OEJXYQZBNKBSJY-WQRHYEAKSA-N
  • InChI: InChI=1S/C14H20F3NO5/c15-14(16,17)10-6-4-9(5-7-10)11(2-1-3-12(19)20)18-23-8-13(21)22/h9-10H,1-8H2,(H,19,20)(H,21,22)/b18-11-
  • SMILES: C1CC(CCC1/C(=N\OCC(=O)O)/CCCC(=O)O)C(F)(F)F
  • Exact Mass: 339.12936
  • Molecular Formula: C14H20F3NO5
  • Compound CID: pubchemlite169502002 pubchem169502002
Hidden Reactions Filter Some biological reactions link very small precursors (e.g. CO₂, acetate) to much larger products. These reactions are correct, but they can create unrealistic shortest paths and connect otherwise separate parts of the graph. To keep the overview readable, FAIR-TPs hides six such reactions where a <60 Da precursor leads to a >300 Da product in the visualisations.

You can have all these paths in the download output.
Hidden reaction pairs (precursor → product):
  • Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamidoacetamide
  • Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamido-n-methylacetamide
  • Carbon dioxide → Formylmethanofuran
  • Acrolein → Chembl3706542
  • Ethylene oxide → Acetyl-coa
  • Formaldehyde → S-hydroxymethylglutathione
Note: In the graph output, up to 100 compounds are displayed for faster visualization. For the full output, please use the export files.

Click on a node or edge to see details here.

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