5'-hydroxyphenylcarvedilol-glucuronide (m30)
- Other Name: 5'-Hydroxyphenylcarvedilol-glucuronide (M30)
- InChIKey: JXCUKNPBRWPVAI-PADXFKBFSA-N
- InChI: InChI=1S/C30H34N2O11/c1-39-21-10-9-17(42-30-27(36)25(34)26(35)28(43-30)29(37)38)13-23(21)40-12-11-31-14-16(33)15-41-22-8-4-7-20-24(22)18-5-2-3-6-19(18)32-20/h2-10,13,16,25-28,30-36H,11-12,14-15H2,1H3,(H,37,38)/t16?,25-,26-,27+,28-,30+/m0/s1
- SMILES: COC1=C(C=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)OCCNCC(COC3=CC=CC4=C3C5=CC=CC=C5N4)O
- Exact Mass: 598.21626
- Molecular Formula: C30H34N2O11
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Compound CID:
169501942
169501942
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.