Main compound image
4-[2-hydroxy-3,3-dimethyl-1-(1h-1,2,4-triazol-1-yl)butoxyl)-benzoic acid
  • Other Name: 4-[2-hydroxy-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butoxyl)-benzoic acid
  • InChIKey: BOEKJKNSKOAINE-UHFFFAOYSA-N
  • InChI: InChI=1S/C15H19N3O4/c1-15(2,3)12(19)13(18-9-16-8-17-18)22-11-6-4-10(5-7-11)14(20)21/h4-9,12-13,19H,1-3H3,(H,20,21)
  • SMILES: CC(C)(C)C(C(N1C=NC=N1)OC2=CC=C(C=C2)C(=O)O)O
  • Exact Mass: 305.13756
  • Molecular Formula: C15H19N3O4
  • Compound CID: pubchemlite139594383 pubchem139594383
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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