5-(3-(3-amino-4-fluoro-1-(1-oxidopyridin-4-yl)-1h-isoindol-1-yl)phenyl)pyrimidine 1-oxide
- Other Name: 7-Fluoro-3-(1-oxidopyridin-1-ium-4-yl)-3-[3-(1-oxidopyrimidin-1-ium-5-yl)phenyl]isoindol-1-amine
- InChIKey: VQOUHVIJJPPFHV-UHFFFAOYSA-N
- InChI: InChI=1S/C23H16FN5O2/c24-20-6-2-5-19-21(20)22(25)27-23(19,17-7-9-28(30)10-8-17)18-4-1-3-15(11-18)16-12-26-14-29(31)13-16/h1-14H,(H2,25,27)
- SMILES: C1=CC(=CC(=C1)C2(C3=C(C(=CC=C3)F)C(=N2)N)C4=CC=[N+](C=C4)[O-])C5=CN=C[N+](=C5)[O-]
- Exact Mass: 413.12880
- Molecular Formula: C23H16FN5O2
-
Compound CID:
118753439
118753439
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.