(2s,3s,4s,5r)-6-[4-(3-ethynylanilino)-7-(2-methoxyethoxy)quinazolin-6-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
- Other Name: (2S,3S,4S,5R)-6-[4-(3-ethynylanilino)-7-(2-methoxyethoxy)quinazolin-6-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
- InChIKey: ZJUVNHXXORUWLK-PZYOUWLLSA-N
- InChI: InChI=1S/C25H25N3O9/c1-3-13-5-4-6-14(9-13)28-23-15-10-18(17(35-8-7-34-2)11-16(15)26-12-27-23)36-25-21(31)19(29)20(30)22(37-25)24(32)33/h1,4-6,9-12,19-22,25,29-31H,7-8H2,2H3,(H,32,33)(H,26,27,28)/t19-,20-,21+,22-,25?/m0/s1
- SMILES: COCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)OC4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O
- Exact Mass: 511.15908
- Molecular Formula: C25H25N3O9
-
Compound CID:
154700142
154700142
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.