o-desmethylcarvedilol-glucuornide (m3, m38a, m38b)
- Other Name: O-Desmethylcarvedilol-glucuornide (M3, M38a, M38b)
- InChIKey: OWCPFBCPWWREQU-USZYGUOMSA-N
- InChI: InChI=1S/C27H32N2O10/c1-15(18-13-29-19-7-3-2-6-17(18)19)37-14-16(30)12-28-10-11-36-20-8-4-5-9-21(20)38-27-24(33)22(31)23(32)25(39-27)26(34)35/h2-9,13,16,22-25,27-33H,1,10-12,14H2,(H,34,35)/t16?,22-,23-,24+,25-,27+/m0/s1
- SMILES: C=C(C1=CNC2=CC=CC=C21)OCC(CNCCOC3=CC=CC=C3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O
- Exact Mass: 544.20570
- Molecular Formula: C27H32N2O10
-
Compound CID:
169502045
169502045
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.