5,7-di-oh-xde-742
- Other Name: 5,7-di-OH-XDE-742
- InChIKey: XAYNJCXEKUZVGD-UHFFFAOYSA-N
- InChI: InChI=1S/C12H9F3N6O5S/c1-26-9-8(5(2-3-16-9)12(13,14)15)27(24,25)20-10-18-11-17-6(22)4-7(23)21(11)19-10/h2-4,23H,1H3,(H2,17,18,19,20,22)
- SMILES: COC1=NC=CC(=C1S(=O)(=O)NC2=NN3C(=CC(=O)NC3=N2)O)C(F)(F)F
- Exact Mass: 406.03072
- Molecular Formula: C12H9F3N6O5S
-
Compound CID:
139597783
139597783
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.
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.