Main compound image
oh-bh 479-8
  • Other Name: 2-[2-(Hydroxymethyl)-6-methyl-N-(pyrazol-1-ylmethyl)anilino]-2-oxoethanesulfonic acid
  • InChIKey: DUIYKMGMOAQLIN-UHFFFAOYSA-N
  • InChI: InChI=1S/C14H17N3O5S/c1-11-4-2-5-12(8-18)14(11)17(10-16-7-3-6-15-16)13(19)9-23(20,21)22/h2-7,18H,8-10H2,1H3,(H,20,21,22)
  • SMILES: CC1=C(C(=CC=C1)CO)N(CN2C=CC=N2)C(=O)CS(=O)(=O)O
  • Exact Mass: 339.08889
  • Molecular Formula: C14H17N3O5S
  • Compound CID: pubchemlite139594809 pubchem139594809
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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