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CHEBI:234349 - corotoxigenin
| Formula | C23H32O5 |
| Net Charge | 0 |
| Average Mass | 388.504 |
| Monoisotopic Mass | 388.22497 |
| SMILES | [H][C@]1(O)CC[C@@]2(C=O)[C@@]([H])(CC[C@]3([H])[C@]2([H])CC[C@@]2(C)[C@]3(O)CC[C@]2([H])C2=CC(=O)OC2)C1 |
| InChI | InChI=1S/C23H32O5/c1-21-7-5-18-19(3-2-15-11-16(25)4-8-22(15,18)13-24)23(21,27)9-6-17(21)14-10-20(26)28-12-14/h10,13,15-19,25,27H,2-9,11-12H2,1H3/t15-,16-,17+,18-,19+,21+,22+,23-/m0/s1 |
| InChIKey | JNTNUSUPTSNMNJ-AULARHRYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Asclepias perennis (ncbitaxon:528296) | - | PubMed (39661060) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| corotoxigenin (CHEBI:234349) is a cardenolides (CHEBI:74634) |
| IUPAC Name |
|---|
| (3S,5S,8R,9S,10R,13R,14S,17R)-3,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-10-carbaldehyde |
| Registry Numbers | Sources |
|---|---|
| CAS:468-20-2 | SUBMITTER |
| Citations |
|---|