Desacetyl-N,O-didesmethyldiltiazem-sulfate
- InChIKey: FHXFNTOCOYYLMG-SJORKVTESA-N
- InChI: InChI=1S/C18H20N2O6S2/c1-19-10-11-20-14-4-2-3-5-15(14)27-17(16(21)18(20)22)12-6-8-13(9-7-12)26-28(23,24)25/h2-9,16-17,19,21H,10-11H2,1H3,(H,23,24,25)/t16-,17+/m1/s1
- SMILES: CNCCN1C2=CC=CC=C2S[C@H]([C@H](C1=O)O)C3=CC=C(C=C3)OS(=O)(=O)O
- Exact Mass: 424.07628
- Molecular Formula: C18H20N2O6S2
-
Compound CID:
169501853
169501853
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.