Details of Mimengoside A
| IUPAC | (2S,3R,4R,5R,6S)-2-[(2R,3S,4R,5R,6S)-4,5-dihydroxy-6-[(2R,3R,4S,5S,6R)-5-hydroxy-2-[[(1S,4S,5R,8R,9R,10S,13S,14R,17S,18R)-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-yl]oxy]-6-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl]oxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol |
| Canonical Smiles | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O[C@H]3[C@H]([C@H](O[C@H]([C@@H]3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O[C@H]5CC[C@]6([C@H]([C@]5(C)CO)CC[C@@]7([C@@H]6C=C[C@@]89[C@]7(CC[C@@]1([C@H]8CC(CC1)(C)C)CO9)C)C)C)C)O)CO)O)O)O |
| Inchi | FFKHYLGULXFXII-IVWPYUJTSA-N |
| PubChem ID | 101625627 |
| Smiles | C[C@@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@H]3[C@@H](O)[C@@H](C)O[C@@H](O[C@H]4CC[C@@]5(C)[C@@H](CC[C@]6(C)[C@@H]5C=C[C@]57OC[C@@]8(CCC(C)(C)C[C@H]85)CC[C@]76C)[C@]4(C)CO)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/C%5BC%40%40H%5D1O%5BC%40%40H%5D%28O%5BC%40%40H%5D2%5BC%40%40H%5D%28CO%29O%5BC%40%40H%5D%28O%5BC%40H%5D3%5BC%40%40H%5D%28O%29%5BC%40%40H%5D%28C%29O%5BC%40%40H%5D%28O%5BC%40H%5D4CC%5BC%40%40%5D5%28C%29%5BC%40%40H%5D%28CC%5BC%40%5D6%28C%29%5BC%40%40H%5D5C%3DC%5BC%40%5D57OC%5BC%40%40%5D8%28CCC%28C%29%28C%29C%5BC%40H%5D85%29CC%5BC%40%5D76C%29%5BC%40%5D4%28C%29CO%29%5BC%40%40H%5D3O%5BC%40%40H%5D3O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D3O%29%5BC%40H%5D%28O%29%5BC%40H%5D2O%29%5BC%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D1O/file?format=sdf&get3d=True -- C%5BC%40%40H%5D1O%5BC%40%40H%5D%28O%5BC%40%40H%5D2%5BC%40%40H%5D%28CO%29O%5BC%40%40H%5D%28O%5BC%40H%5D3%5BC%40%40H%5D%28O%29%5BC%40%40H%5D%28C%29O%5BC%40%40H%5D%28O%5BC%40H%5D4CC%5BC%40%40%5D5%28C%29%5BC%40%40H%5D%28CC%5BC%40%5D6%28C%29%5BC%40%40H%5D5C%3DC%5BC%40%5D57OC%5BC%40%40%5D8%28CCC%28C%29%28C%29C%5BC%40H%5D85%29CC%5BC%40%5D76C%29%5BC%40%5D4%28C%29CO%29%5BC%40%40H%5D3O%5BC%40%40H%5D3O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D3O%29%5BC%40H%5D%28O%29%5BC%40H%5D2O%29%5BC%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D1O could not be loaded.
| Class | Oleanane triterpenoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |