6î²-hydroxy-7î±-thiomethyl-sulfinylspironolactone
- Other Name: 6beta-Hydroxy-7alpha-thiomethyl-sulfinylspironolactone
- InChIKey: DSLQBQANGUTBNA-YTVCVYBMSA-N
- InChI: InChI=1S/C23H32O5S/c1-21-8-4-13(24)12-16(21)19(26)20(29(3)27)18-14(21)5-9-22(2)15(18)6-10-23(22)11-7-17(25)28-23/h12,14-15,18-20,26H,4-11H2,1-3H3/t14-,15-,18+,19-,20-,21+,22-,23+,29+/m0/s1
- SMILES: C[C@]12CCC(=O)C=C1[C@@H]([C@H]([C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@]45CCC(=O)O5)C)[S@](=O)C)O
- Exact Mass: 420.19705
- Molecular Formula: C23H32O5S
-
Compound CID:
169501841
169501841
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.