TPCN05446
![[object Object]](../../static/browser_molecular_png/TPCN05446.png)
| Name | Ixeris saponin C |
| Molecular Formula | C53H86O24 |
| Molecular Weight | 1107.25 |
| CAS Registry Number | 729598-55-4 |
| SMILES | CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7O)C6O)C(C)(CO)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Ixeris sonchifolia | Whole plants | 0.000733% | Planta Med. 2003. 69, 1036-1042. | 10.1055/s-2003-45154 |
Properties
| HBA | 24 | HBD | 15 |
| HeavyAtoms | 77 | AlogP | -3.45 |
| TPSA | 394.36 | RotatableBonds | 12 |
| FractionCSP3 | 0.94 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |