(2S,3S,4S,5R,6R)-6-((R)-1-(4-(4-fluoro-2-methyl-1H-indol-5-yloxy)-5-methylpyrrolo[1,2-f][1,2,4]triazin-6-yloxy)propan-2-yloxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
- Other Name: (2S,3S,4S,5R,6R)-6-[(2R)-1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
- InChIKey: TYHCOOSLCVMBBW-IYYXUBSOSA-N
- InChI: InChI=1S/C25H27FN4O9/c1-10-6-13-14(29-10)4-5-15(17(13)26)38-23-18-12(3)16(7-30(18)28-9-27-23)36-8-11(2)37-25-21(33)19(31)20(32)22(39-25)24(34)35/h4-7,9,11,19-22,25,29,31-33H,8H2,1-3H3,(H,34,35)/t11-,19+,20+,21-,22+,25-/m1/s1
- SMILES: CC1=CC2=C(N1)C=CC(=C2F)OC3=NC=NN4C3=C(C(=C4)OC[C@@H](C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)C
- Exact Mass: 546.17621
- Molecular Formula: C25H27FN4O9
-
Compound CID:
51353032
51353032
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.