4-(3-(4-(2-(diethylamino)ethoxy)-3,5-diiodobenzoyl)benzofuran-2-yl)butanoic acid
- Other Name: 2-Benzofuranbutanoic acid, 3-(4-(2-(diethylamino)ethoxy)-3,5-diiodobenzoyl)-
- InChIKey: BJXYXPYYKKUYMK-UHFFFAOYSA-N
- InChI: InChI=1S/C25H27I2NO5/c1-3-28(4-2)12-13-32-25-18(26)14-16(15-19(25)27)24(31)23-17-8-5-6-9-20(17)33-21(23)10-7-11-22(29)30/h5-6,8-9,14-15H,3-4,7,10-13H2,1-2H3,(H,29,30)
- SMILES: CCN(CC)CCOC1=C(C=C(C=C1I)C(=O)C2=C(OC3=CC=CC=C32)CCCC(=O)O)I
- Exact Mass: 674.99787
- Molecular Formula: C25H27I2NO5
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Compound CID:
118753280
118753280
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.