Tricagrelor metabolite M6
- InChIKey: UHTYXLPFHIMWAN-XRRTYTDFSA-N
- InChI: InChI=1S/C27H32F2N6O9S/c1-2-5-45-27-31-23(30-13-7-10(13)9-3-4-11(28)12(29)6-9)16-24(32-27)35(34-33-16)14-8-15(18(37)17(14)36)43-26-21(40)19(38)20(39)22(44-26)25(41)42/h3-4,6,10,13-15,17-22,26,36-40H,2,5,7-8H2,1H3,(H,41,42)(H,30,31,32)/t10-,13+,14+,15-,17-,18+,19?,20?,21?,22?,26?/m0/s1
- SMILES: CCCSC1=NC(=C2C(=N1)N(N=N2)[C@@H]3C[C@@H]([C@H]([C@H]3O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)N[C@@H]5C[C@H]5C6=CC(=C(C=C6)F)F
- Exact Mass: 654.19195
- Molecular Formula: C27H32F2N6O9S
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Compound CID:
169502161
169502161
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.