bromadiolone metabolite unk 1
- Other Name: Bromadiolone metabolite Unk 1
- InChIKey: IHDWCTCUZMKWJG-UHFFFAOYSA-N
- InChI: InChI=1S/C29H27BrO/c30-28-19-17-25(18-20-28)24-14-11-22(12-15-24)13-16-27(23-7-3-1-4-8-23)21-29(31)26-9-5-2-6-10-26/h1-12,14-15,17-20,27,29,31H,13,16,21H2
- SMILES: C1=CC=C(C=C1)C(CCC2=CC=C(C=C2)C3=CC=C(C=C3)Br)CC(C4=CC=CC=C4)O
- Exact Mass: 470.12453
- Molecular Formula: C29H27BrO
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Compound CID:
139595396
139595396
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.