Main compound image
cis-4-[2-(3-hydroxy)-thionaphthenyl]-2-oxo-3-butenoate
  • Other Name: cis-4-(3-Hydroxy-1-benzothiophen-2-yl)-2-oxobut-3-enoate
  • InChIKey: CSURGFUIIZATMZ-WAYWQWQTSA-M
  • InChI: InChI=1S/C12H8O4S/c13-8(12(15)16)5-6-10-11(14)7-3-1-2-4-9(7)17-10/h1-6,14H,(H,15,16)/p-1/b6-5-
  • SMILES: C1=CC=C2C(=C1)C(=C(S2)/C=C\C(=O)C(=O)O)[O-]
  • Exact Mass: 247.00650
  • Molecular Formula: C12H7O4S-
  • Compound CID: pubchemlite54675859 pubchem54675859
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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