Main compound image
NA
  • InChIKey: KNYFUSHVMUWLKQ-CQPUUCJISA-N
  • InChI: InChI=1S/C14H16N4O9/c19-6-4-18(14(25)16-6)15-3-5-1-2-7(26-5)17-12-10(22)8(20)9(21)11(27-12)13(23)24/h1-3,8-12,17,20-22H,4H2,(H,23,24)(H,16,19,25)/b15-3-
  • SMILES: C1C(=O)NC(=O)N1/N=C\C2=CC=C(O2)NC3C(C(C(C(O3)C(=O)O)O)O)O
  • Exact Mass: 384.09173
  • Molecular Formula: C14H16N4O9
  • Compound CID: pubchemlite169501956 pubchem169501956
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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