dabigatran metabolite m500
- Other Name: (2R,3R,4R,5S)-6-[2-[(4-carbamimidoylanilino)methyl]-1-methylbenzimidazole-5-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
- InChIKey: GQOGBHBGKZPIIP-ZLDYTAISSA-N
- InChI: InChI=1S/C23H25N5O8/c1-28-14-7-4-11(22(34)36-23-18(31)16(29)17(30)19(35-23)21(32)33)8-13(14)27-15(28)9-26-12-5-2-10(3-6-12)20(24)25/h2-8,16-19,23,26,29-31H,9H2,1H3,(H3,24,25)(H,32,33)/t16-,17-,18+,19-,23?/m1/s1
- SMILES: CN1C2=C(C=C(C=C2)C(=O)OC3[C@H]([C@@H]([C@H]([C@@H](O3)C(=O)O)O)O)O)N=C1CNC4=CC=C(C=C4)C(=N)N
- Exact Mass: 499.17031
- Molecular Formula: C23H25N5O8
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Compound CID:
169501877
169501877
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.