Details of Sarsaparilloside
| IUPAC | (2S,3R,4R,5R,6S)-2-[(2R,3S,4S,5R,6R)-4-hydroxy-6-[[(1R,2S,4S,6R,7S,8R,9S,12S,13S,16S,18R)-6-hydroxy-7,9,13-trimethyl-6-[(3S)-3-methyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-16-yl]oxy]-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol |
| Canonical Smiles | C[C@H]1[C@H]2[C@H](C[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC[C@H]5[C@@]4(CC[C@@H](C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)O)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)C)C)O[C@@]1(CC[C@H](C)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O |
| Inchi | SUHZCFHVHYUSEP-UVSPAHOSSA-N |
| PubChem ID | 441895 |
| Smiles | C[C@@H](CC[C@@]1(O)O[C@H]2C[C@H]3[C@@H]4CC[C@@H]5C[C@@H](O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2[C@@H]1C)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/C%5BC%40%40H%5D%28CC%5BC%40%40%5D1%28O%29O%5BC%40H%5D2C%5BC%40H%5D3%5BC%40%40H%5D4CC%5BC%40%40H%5D5C%5BC%40%40H%5D%28O%5BC%40%40H%5D6O%5BC%40H%5D%28CO%5BC%40%40H%5D7O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D7O%29%5BC%40%40H%5D%28O%5BC%40%40H%5D7O%5BC%40%40H%5D%28C%29%5BC%40H%5D%28O%29%5BC%40%40H%5D%28O%29%5BC%40H%5D7O%29%5BC%40H%5D%28O%29%5BC%40H%5D6O%5BC%40%40H%5D6O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D6O%29CC%5BC%40%5D5%28C%29%5BC%40H%5D4CC%5BC%40%5D3%28C%29%5BC%40H%5D2%5BC%40%40H%5D1C%29CO%5BC%40%40H%5D1O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D1O/file?format=sdf&get3d=True -- C%5BC%40%40H%5D%28CC%5BC%40%40%5D1%28O%29O%5BC%40H%5D2C%5BC%40H%5D3%5BC%40%40H%5D4CC%5BC%40%40H%5D5C%5BC%40%40H%5D%28O%5BC%40%40H%5D6O%5BC%40H%5D%28CO%5BC%40%40H%5D7O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D7O%29%5BC%40%40H%5D%28O%5BC%40%40H%5D7O%5BC%40%40H%5D%28C%29%5BC%40H%5D%28O%29%5BC%40%40H%5D%28O%29%5BC%40H%5D7O%29%5BC%40H%5D%28O%29%5BC%40H%5D6O%5BC%40%40H%5D6O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D6O%29CC%5BC%40%5D5%28C%29%5BC%40H%5D4CC%5BC%40%5D3%28C%29%5BC%40H%5D2%5BC%40%40H%5D1C%29CO%5BC%40%40H%5D1O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D1O could not be loaded.
| Class | Furostane steroids |
| Super Class | Steroids |
| Pathways | Terpenoids |