Main compound image
3-hydroxyguanfacine glucuronide
  • Other Name: (2S,3S,4S,5R)-6-[2,4-dichloro-3-[2-(diaminomethylideneamino)-2-oxoethyl]-5-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
  • InChIKey: AUDUMKPECIWTMB-ZAOAHOKWSA-N
  • InChI: InChI=1S/C15H17Cl2N3O9/c16-7-3(1-6(22)20-15(18)19)8(17)5(2-4(7)21)28-14-11(25)9(23)10(24)12(29-14)13(26)27/h2,9-12,14,21,23-25H,1H2,(H,26,27)(H4,18,19,20,22)/t9-,10-,11+,12-,14?/m0/s1
  • SMILES: C1=C(C(=C(C(=C1OC2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)Cl)CC(=O)N=C(N)N)Cl)O
  • Exact Mass: 453.03418
  • Molecular Formula: C15H17Cl2N3O9
  • Compound CID: pubchemlite154699491 pubchem154699491
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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