bh 517-t1so2
- Other Name: BH 517-T1SO2
- InChIKey: ISTHBMFBYWKVPJ-UHFFFAOYSA-N
- InChI: InChI=1S/C15H23NO4S/c1-2-4-12(16)15-13(17)7-11(8-14(15)18)10-5-3-6-21(19,20)9-10/h10-11,16-17H,2-9H2,1H3
- SMILES: CCCC(=N)C1=C(CC(CC1=O)C2CCCS(=O)(=O)C2)O
- Exact Mass: 313.13478
- Molecular Formula: C15H23NO4S
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Compound CID:
139595464
139595464
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.