1alpha-hydroxylcinobufagin
- Other Name: (1alpha,3beta,5beta,15beta,16beta)-16-(Acetyloxy)-14,15-epoxy-1,3-dihydroxybufa-20,22-dienolide
- InChIKey: LSTXJZUCJIEQDL-VTBFSACKSA-N
- InChI: InChI=1S/C26H34O7/c1-13(27)32-22-21(14-4-7-20(30)31-12-14)24(2)9-8-17-18(26(24)23(22)33-26)6-5-15-10-16(28)11-19(29)25(15,17)3/h4,7,12,15-19,21-23,28-29H,5-6,8-11H2,1-3H3/t15-,16-,17+,18-,19+,21+,22-,23-,24-,25+,26-/m1/s1
- SMILES: CC(=O)O[C@@H]1[C@@H]([C@]2(CC[C@H]3[C@H]([C@@]24[C@@H]1O4)CC[C@H]5[C@@]3([C@H](C[C@@H](C5)O)O)C)C)C6=COC(=O)C=C6
- Exact Mass: 458.23045
- Molecular Formula: C26H34O7
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Compound CID:
118752991
118752991
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.