doxepin n-glucuronide
- Other Name: [(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-(6-carboxy-3,4,5-trihydroxyoxan-2-yl)-dimethylazanium
- InChIKey: HIWVLLQQFXUDIX-GZTJUZNOSA-O
- InChI: InChI=1S/C25H29NO7/c1-26(2,24-22(29)20(27)21(28)23(33-24)25(30)31)13-7-11-17-16-9-4-3-8-15(16)14-32-19-12-6-5-10-18(17)19/h3-6,8-12,20-24,27-29H,7,13-14H2,1-2H3/p+1/b17-11+
- SMILES: C[N+](C)(CC/C=C/1\C2=CC=CC=C2COC3=CC=CC=C31)C4C(C(C(C(O4)C(=O)O)O)O)O
- Exact Mass: 456.20223
- Molecular Formula: C25H30NO7+
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Compound CID:
131637124
131637124
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.