Tricagrelor metabolite M4
- InChIKey: CUKVWGRPHNPILX-KXHPMJNSSA-N
- InChI: InChI=1S/C20H30N6O10S/c1-2-5-37-20-22-16(21)9-17(23-20)26(25-24-9)7-6-8(11(28)10(7)27)34-3-4-35-19-14(31)12(29)13(30)15(36-19)18(32)33/h7-8,10-15,19,27-31H,2-6H2,1H3,(H,32,33)(H2,21,22,23)/t7-,8+,10+,11-,12?,13?,14?,15?,19?/m1/s1
- SMILES: CCCSC1=NC(=C2C(=N1)N(N=N2)[C@@H]3C[C@@H]([C@H]([C@H]3O)O)OCCOC4C(C(C(C(O4)C(=O)O)O)O)O)N
- Exact Mass: 546.17441
- Molecular Formula: C20H30N6O10S
-
Compound CID:
169501829
169501829
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.