Main compound image
3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-propan-2-yl-7h-purin-3-ium-6-amine
  • Other Name: 6-Amino-3-(3-cyclopentyloxy-4-methoxy-benzyl)-8-isopropyl-3H-purine
  • InChIKey: OYJFXAVQPKHYLT-UHFFFAOYSA-N
  • InChI: InChI=1S/C21H27N5O2/c1-13(2)20-24-18-19(22)23-12-26(21(18)25-20)11-14-8-9-16(27-3)17(10-14)28-15-6-4-5-7-15/h8-10,12-13,15,22H,4-7,11H2,1-3H3,(H,24,25)
  • SMILES: CC(C)C1=NC2=C(N1)C(=N)N=CN2CC3=CC(=C(C=C3)OC)OC4CCCC4
  • Exact Mass: 381.21648
  • Molecular Formula: C21H27N5O2
  • Compound CID: pubchemlite135523714 pubchem135523714
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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