Details of Beesioside II
| IUPAC | [(1S,3R,6S,8R,11R,12S,13R,14R,15R,16S)-13-acetyloxy-14-hydroxy-15-[(2S,5R)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12-trimethyl-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-16-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]methyl acetate |
| Canonical Smiles | CC(=O)OC[C@]12CC[C@@]34C[C@@]35CC[C@@H](C([C@@H]5CC[C@H]4[C@@]1([C@H]([C@@H]([C@@H]2[C@@]6(CC[C@@H](O6)C(C)(C)O)C)O)OC(=O)C)C)(C)C)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O |
| Inchi | TVJIGVYTXZVMBU-JYXUTFFHSA-N |
| PubChem ID | 101321327 |
| Smiles | CC(=O)OC[C@]12CC[C@@]34C[C@@]35CC[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)C(C)(C)[C@@H]5CC[C@H]4[C@]1(C)[C@@H](OC(C)=O)[C@H](O)[C@@H]2[C@]1(C)CC[C@H](C(C)(C)O)O1 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC%28%3DO%29OC%5BC%40%5D12CC%5BC%40%40%5D34C%5BC%40%40%5D35CC%5BC%40H%5D%28O%5BC%40%40H%5D3OC%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D3O%29C%28C%29%28C%29%5BC%40%40H%5D5CC%5BC%40H%5D4%5BC%40%5D1%28C%29%5BC%40%40H%5D%28OC%28C%29%3DO%29%5BC%40H%5D%28O%29%5BC%40%40H%5D2%5BC%40%5D1%28C%29CC%5BC%40H%5D%28C%28C%29%28C%29O%29O1/file?format=sdf&get3d=True -- CC%28%3DO%29OC%5BC%40%5D12CC%5BC%40%40%5D34C%5BC%40%40%5D35CC%5BC%40H%5D%28O%5BC%40%40H%5D3OC%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D3O%29C%28C%29%28C%29%5BC%40%40H%5D5CC%5BC%40H%5D4%5BC%40%5D1%28C%29%5BC%40%40H%5D%28OC%28C%29%3DO%29%5BC%40H%5D%28O%29%5BC%40%40H%5D2%5BC%40%5D1%28C%29CC%5BC%40H%5D%28C%28C%29%28C%29O%29O1 could not be loaded.
| Class | Cycloartane triterpenoids, Small peptides |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |