Hydroxy-O-demethylated silybin
- InChIKey: ZRHINALQVLVHML-VCFYHUQZSA-N
- InChI: InChI=1S/C24H20O11/c25-8-18-23(10-3-13(28)20(30)14(29)4-10)34-16-5-9(1-2-15(16)33-18)24-22(32)21(31)19-12(27)6-11(26)7-17(19)35-24/h1-7,18,22-30,32H,8H2/t18-,22+,23-,24-/m1/s1
- SMILES: C1=CC2=C(C=C1[C@@H]3[C@H](C(=O)C4=C(C=C(C=C4O3)O)O)O)O[C@@H]([C@H](O2)CO)C5=CC(=C(C(=C5)O)O)O
- Exact Mass: 484.10056
- Molecular Formula: C24H20O11
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Compound CID:
169502283
169502283
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.