Details of Cheirotoxin
| IUPAC | (3S,5S,8R,9S,10S,13R,14S,17R)-3-[(2R,3R,4S,6R)-3,4-dihydroxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde |
| Canonical Smiles | C[C@@H]1C([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CC[C@@]5([C@@H]4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C=O)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O |
| Inchi | CAYUJEAJKPLCAV-LPJFSPNFSA-N |
| PubChem ID | 201886 |
| Smiles | C[C@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)[C@H]4CC[C@]5(C)C(c6coc(O)c6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)C1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
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| Class | Cardenolides |
| Super Class | Steroids |
| Pathways | Terpenoids |