meta-o-dealkylated lactam-glucuronide
- Other Name: Meta-O-dealkylated lactam-glucuronide
- InChIKey: YTKPDRAZWUMWAB-VHHJDAJTSA-N
- InChI: InChI=1S/C21H25F3N2O10/c22-21(23,24)8-34-12-5-4-10(35-20-16(30)14(28)15(29)17(36-20)19(32)33)6-11(12)18(31)25-7-9-2-1-3-13(27)26-9/h4-6,9,14-17,20,28-30H,1-3,7-8H2,(H,25,31)(H,26,27)(H,32,33)/t9?,14-,15-,16+,17-,20+/m0/s1
- SMILES: C1CC(NC(=O)C1)CNC(=O)C2=C(C=CC(=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)OCC(F)(F)F
- Exact Mass: 522.14613
- Molecular Formula: C21H25F3N2O10
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Compound CID:
169502251
169502251
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.