Main compound image
(2s,3s,4s,5r)-3,4,5-trihydroxy-6-(6-methoxy-4-oxo-3-phenylchromen-7-yl)oxyoxane-2-carboxylic acid
  • Other Name: (2S,3S,4S,5R)-3,4,5-trihydroxy-6-(6-methoxy-4-oxo-3-phenylchromen-7-yl)oxyoxane-2-carboxylic acid
  • InChIKey: OCPRWOGVEWQIOO-QAKXDBDYSA-N
  • InChI: InChI=1S/C22H20O10/c1-29-14-7-11-13(30-9-12(16(11)23)10-5-3-2-4-6-10)8-15(14)31-22-19(26)17(24)18(25)20(32-22)21(27)28/h2-9,17-20,22,24-26H,1H3,(H,27,28)/t17-,18-,19+,20-,22?/m0/s1
  • SMILES: COC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=CC=C3)OC4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O
  • Exact Mass: 444.10565
  • Molecular Formula: C22H20O10
  • Compound CID: pubchemlite154699836 pubchem154699836
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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