TPCN05309
![[object Object]](../../static/browser_molecular_png/TPCN05309.png)
| Name | Polygalasaponin XXIX |
| Molecular Formula | C64H102O33 |
| Molecular Weight | 1399.49 |
| CAS Registry Number | 176182-02-8 |
| SMILES | CC1OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6O)C(C)(C(=O)O)C5CCC4(C)C2(CO)CC3)C(OC2OC(C)C(OC3OCC(OC4OCC(O)(COC5OC(CO)C(O)C(O)C5O)C4O)C(O)C3O)C(O)C2O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Polygalaceae | Polygala japonica | Roots | 0.006000% | Phytochemistry. 2008. 69, 1617-1624. | 10.1016/j.phytochem.2008.01.010 |
Properties
| HBA | 33 | HBD | 19 |
| HeavyAtoms | 97 | AlogP | -6.04 |
| TPSA | 529.27 | RotatableBonds | 17 |
| FractionCSP3 | 0.94 | Rings | 11 |
| AromaticRings | 0 | AliphaticRings | 11 |