Details of Agavoside F
| IUPAC | 16-[5-[3,4-dihydroxy-5-[5-hydroxy-6-(hydroxymethyl)-4-[4-hydroxy-6-methyl-3,5-bis[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-10-one |
| Canonical Smiles | CC1CCC2(C(C3C(O2)CC4C3(C(=O)CC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)OC9C(C(C(C(O9)CO)O)OC2C(C(C(C(O2)C)OC2C(C(C(C(O2)C)O)O)O)O)OC2C(C(C(C(O2)C)O)O)O)OC2C(C(C(CO2)O)O)O)O)O)O)O)C)C)C)OC1 |
| Inchi | JNWOJVVOILIUQX-UHFFFAOYSA-N |
| PubChem ID | 85112556 |
| Smiles | CC1CCC2(OC1)OC1CC3C4CCC5CC(OC6OC(CO)C(OC7OC(CO)C(OC8OC(CO)C(O)C(OC9OC(C)C(OC%10OC(C)C(O)C(O)C%10O)C(O)C9OC9OC(C)C(O)C(O)C9O)C8OC8OCC(O)C(O)C8O)C(O)C7O)C(O)C6O)CCC5(C)C4CC(=O)C3(C)C1C2C |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC1CCC2%28OC1%29OC1CC3C4CCC5CC%28OC6OC%28CO%29C%28OC7OC%28CO%29C%28OC8OC%28CO%29C%28O%29C%28OC9OC%28C%29C%28OC%10OC%28C%29C%28O%29C%28O%29C%10O%29C%28O%29C9OC9OC%28C%29C%28O%29C%28O%29C9O%29C8OC8OCC%28O%29C%28O%29C8O%29C%28O%29C7O%29C%28O%29C6O%29CCC5%28C%29C4CC%28%3DO%29C3%28C%29C1C2C/file?format=sdf&get3d=True -- CC1CCC2%28OC1%29OC1CC3C4CCC5CC%28OC6OC%28CO%29C%28OC7OC%28CO%29C%28OC8OC%28CO%29C%28O%29C%28OC9OC%28C%29C%28OC%10OC%28C%29C%28O%29C%28O%29C%10O%29C%28O%29C9OC9OC%28C%29C%28O%29C%28O%29C9O%29C8OC8OCC%28O%29C%28O%29C8O%29C%28O%29C7O%29C%28O%29C6O%29CCC5%28C%29C4CC%28%3DO%29C3%28C%29C1C2C could not be loaded.
| Class | Spirostane steroids |
| Super Class | Steroids |
| Pathways | Terpenoids |
