isopropyl(2s)-7-cyano-3a,8b-dihydroxy-4-(pyridin-2-ylmethyl)-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indol-2-ylcarbamate
- Other Name: Carbamic acid, N-((2S)-7-cyano-1,2,3,3a,4,8b-hexahydro-3a,8b-dihydroxy-4-(2-pyridinylmethyl)cyclopent(b)indol-2-yl)-, 1-methylethyl ester
- InChIKey: PGOWXQHSMFTDQD-YTXWROIDSA-N
- InChI: InChI=1S/C22H24N4O4/c1-14(2)30-20(27)25-17-10-21(28)18-9-15(12-23)6-7-19(18)26(22(21,29)11-17)13-16-5-3-4-8-24-16/h3-9,14,17,28-29H,10-11,13H2,1-2H3,(H,25,27)/t17-,21?,22?/m0/s1
- SMILES: CC(C)OC(=O)N[C@H]1CC2(C3=C(C=CC(=C3)C#N)N(C2(C1)O)CC4=CC=CC=N4)O
- Exact Mass: 408.17976
- Molecular Formula: C22H24N4O4
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Compound CID:
118753382
118753382
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.