chembl4525746
- Other Name: O-Demethyl muraglitazar glucuronide
- InChIKey: XPWHHVISGFEZFK-RIJOFNGHSA-N
- InChI: InChI=1S/C34H34N2O13/c1-19-25(35-31(46-19)21-5-3-2-4-6-21)15-16-45-23-11-7-20(8-12-23)17-36(34(44)47-24-13-9-22(37)10-14-24)18-26(38)48-33-29(41)27(39)28(40)30(49-33)32(42)43/h2-14,27-30,33,37,39-41H,15-18H2,1H3,(H,42,43)/t27-,28-,29+,30-,33+/m0/s1
- SMILES: CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3=CC=C(C=C3)CN(CC(=O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)C(=O)OC5=CC=C(C=C5)O
- Exact Mass: 678.20609
- Molecular Formula: C34H34N2O13
-
Compound CID:
146675112
146675112
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.