2,5,6-trichloro-4-(glutathion-5-yl)-isophthalonitrile
- Other Name: 2,5,6-Trichloro-4-(glutathion-5-yl)-isophthalonitrile
- InChIKey: VJKDVQJEUQMXNR-UHFFFAOYSA-N
- InChI: InChI=1S/C18H16Cl3N5O7S/c19-13-7(3-22)14(20)15(21)16(8(13)4-23)34-6-10(17(30)25-5-11(27)28)26-33-12(29)2-1-9(24)18(31)32/h9-10,26H,1-2,5-6,24H2,(H,25,30)(H,27,28)(H,31,32)
- SMILES: C(CC(=O)ONC(CSC1=C(C(=C(C(=C1Cl)Cl)C#N)Cl)C#N)C(=O)NCC(=O)O)C(C(=O)O)N
- Exact Mass: 550.98360
- Molecular Formula: C18H16Cl3N5O7S
-
Compound CID:
139597464
139597464
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.