Details of Deutzicoside B
| IUPAC | (4aR,5R,6aR,6aS,6bR,10S,12aR,14bR)-5-hydroxy-10-[(2S,3R,4S,5S)-5-hydroxy-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
| Canonical Smiles | CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)C)CCC5(C4CC=C6C5(CC(C7(C6CC(CC7)(C)C)C(=O)O)O)C)C)C)O)OC8C(C(C(C(O8)CO)O)O)O)O)O)O |
| Inchi | KIGBZBGUCRFANQ-IEBUKCNUSA-N |
| PubChem ID | 195846 |
| Smiles | CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)O)C(O)CC45C)C3(C)C)OCC(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC1OC%28OC2C%28OC3CCC4%28C%29C%28CCC5%28C%29C4CC%3DC4C6CC%28C%29%28C%29CCC6%28C%28%3DO%29O%29C%28O%29CC45C%29C3%28C%29C%29OCC%28O%29C2OC2OC%28CO%29C%28O%29C%28O%29C2O%29C%28O%29C%28O%29C1O/file?format=sdf&get3d=True -- CC1OC%28OC2C%28OC3CCC4%28C%29C%28CCC5%28C%29C4CC%3DC4C6CC%28C%29%28C%29CCC6%28C%28%3DO%29O%29C%28O%29CC45C%29C3%28C%29C%29OCC%28O%29C2OC2OC%28CO%29C%28O%29C%28O%29C2O%29C%28O%29C%28O%29C1O could not be loaded.
| Class | Oleanane triterpenoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |
