Main compound image
pefloxacin o-glucuronide
  • Other Name: (2S,3S,4S,5R)-6-[1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
  • InChIKey: QDEVJYIKQHAKNT-KTQJQPAOSA-N
  • InChI: InChI=1S/C23H28FN3O9/c1-3-26-10-12(22(34)36-23-19(31)17(29)18(30)20(35-23)21(32)33)16(28)11-8-13(24)15(9-14(11)26)27-6-4-25(2)5-7-27/h8-10,17-20,23,29-31H,3-7H2,1-2H3,(H,32,33)/t17-,18-,19+,20-,23?/m0/s1
  • SMILES: CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)OC4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O
  • Exact Mass: 509.18096
  • Molecular Formula: C23H28FN3O9
  • Compound CID: pubchemlite154699896 pubchem154699896
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.

Neighbours
All in View
Loading...