s-4'-hydroxybupropion-glucuronide
- Other Name: S-4'-Hydroxybupropion-glucuronide
- InChIKey: PJVMORCDFQJQBG-IEGSMEOMSA-N
- InChI: InChI=1S/C19H26ClNO8/c1-8(21-19(2,3)4)12(22)9-5-6-11(10(20)7-9)28-18-15(25)13(23)14(24)16(29-18)17(26)27/h5-8,13-16,18,21,23-25H,1-4H3,(H,26,27)/t8-,13-,14-,15+,16-,18?/m0/s1
- SMILES: C[C@@H](C(=O)C1=CC(=C(C=C1)OC2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)Cl)NC(C)(C)C
- Exact Mass: 431.13469
- Molecular Formula: C19H26ClNO8
-
Compound CID:
169502060
169502060
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.