Details of Swertiaside
| IUPAC | (1S,4aS,6R,7R,7aS)-6-(3-hydroxybenzoyl)oxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid |
| Canonical Smiles | C[C@H]1[C@@H](C[C@H]2[C@@H]1[C@@H](OC=C2C(=O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)OC(=O)C4=CC(=CC=C4)O |
| Inchi | BSMWQZICWPFTBG-IFJHVRIVSA-N |
| PubChem ID | 101285202 |
| Smiles | C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@H]1OC(=O)c1cccc(O)c1 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/C%5BC%40%40H%5D1%5BC%40H%5D2%5BC%40H%5D%28O%5BC%40%40H%5D3O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D3O%29OC%3DC%28C%28%3DO%29O%29%5BC%40H%5D2C%5BC%40H%5D1OC%28%3DO%29c1cccc%28O%29c1/file?format=sdf&get3d=True -- C%5BC%40%40H%5D1%5BC%40H%5D2%5BC%40H%5D%28O%5BC%40%40H%5D3O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D3O%29OC%3DC%28C%28%3DO%29O%29%5BC%40H%5D2C%5BC%40H%5D1OC%28%3DO%29c1cccc%28O%29c1 could not be loaded.
| Class | Iridoids monoterpenoids |
| Super Class | Monoterpenoids |
| Pathways | Terpenoids |
