Main compound image
dact+glca+o
  • Other Name: DACT+GlcA+O
  • InChIKey: RYTVOJCKSXKLCY-RQBVIIMYSA-N
  • InChI: InChI=1S/C9H12ClN5O7/c10-7-12-8(14-9(13-7)15-21)11-5-3(18)1(16)2(17)4(22-5)6(19)20/h1-5,16-18,21H,(H,19,20)(H2,11,12,13,14,15)/t1-,2+,3-,4+,5?/m0/s1
  • SMILES: [C@@H]1([C@H]([C@@H](OC([C@H]1O)NC2=NC(=NC(=N2)Cl)NO)C(=O)O)O)O
  • Exact Mass: 337.04253
  • Molecular Formula: C9H12ClN5O7
  • Compound CID: pubchemlite177546102 pubchem177546102
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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