Details of Saikosaponin I
| IUPAC | 2-[4,5-dihydroxy-6-[[8-hydroxy-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a-dodecahydropicen-3-yl]oxy]-2-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol |
| Canonical Smiles | CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3CCC4(C(C3(C)C)CCC5(C4=CC=C6C5(CC(C7(C6CC(CC7)(C)C)CO)O)C)C)C)COC8C(C(C(C(O8)CO)O)O)O)O)O)O |
| Inchi | CMCKJNVAUXCQCZ-UHFFFAOYSA-N |
| PubChem ID | 73817573 |
| Smiles | CC1OC(OC2C(COC3OC(CO)C(O)C(O)C3O)OC(OC3CCC4(C)C5=CC=C6C7CC(C)(C)CCC7(CO)C(O)CC6(C)C5(C)CCC4C3(C)C)C(O)C2O)C(O)C(O)C1O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC1OC%28OC2C%28COC3OC%28CO%29C%28O%29C%28O%29C3O%29OC%28OC3CCC4%28C%29C5%3DCC%3DC6C7CC%28C%29%28C%29CCC7%28CO%29C%28O%29CC6%28C%29C5%28C%29CCC4C3%28C%29C%29C%28O%29C2O%29C%28O%29C%28O%29C1O/file?format=sdf&get3d=True -- CC1OC%28OC2C%28COC3OC%28CO%29C%28O%29C%28O%29C3O%29OC%28OC3CCC4%28C%29C5%3DCC%3DC6C7CC%28C%29%28C%29CCC7%28CO%29C%28O%29CC6%28C%29C5%28C%29CCC4C3%28C%29C%29C%28O%29C2O%29C%28O%29C%28O%29C1O could not be loaded.
| Class | Oleanane triterpenoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |
