(2S,3S,4S,5R,6S)-6-[5-[3-[3-amino-1-[2-(difluoromethyl)-4-pyridinyl]-4-fluoroisoindol-1-yl]phenyl]imidazol-1-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
- InChIKey: AWTLKDTWTRYGGF-WXWOWMRGSA-N
- InChI: InChI=1S/C29H24F3N5O7/c30-17-6-2-5-16-20(17)26(33)36-29(16,15-7-8-35-18(10-15)25(31)32)14-4-1-3-13(9-14)19-11-34-12-37(19)44-28-23(40)21(38)22(39)24(43-28)27(41)42/h1-12,21-25,28,38-40H,(H2,33,36)(H,41,42)/t21-,22-,23+,24-,28-,29?/m0/s1
- SMILES: C1=CC(=CC(=C1)C2(C3=C(C(=CC=C3)F)C(=N2)N)C4=CC(=NC=C4)C(F)F)C5=CN=CN5O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O
- Exact Mass: 611.16278
- Molecular Formula: C29H24F3N5O7
-
Compound CID:
118753408
118753408
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.