TPCN05501
![[object Object]](../../static/browser_molecular_png/TPCN05501.png)
| Name | Saponin PH;2??,3??,23-trihydroxy-30-norolean-12,20(29)- dien-28-oic acid O-??-L-rhamnopyranosyl-(1??4)-O-??-D-glucopyranosyl-(1??6)-??-D-glucopyranosyl ester |
| Molecular Formula | C47H74O19 |
| Molecular Weight | 943.09 |
| CAS Registry Number | 60394-25-4 |
| SMILES | C=C1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Lardizabalaceae | Akebia trifoliata | Peels | 0.007120% | Chem Pharm Bull (Tokyo) . 2012;60(10):1264-74 | 10.1248/cpb.c12-00448 |
| Lardizabalaceae | Akebia trifoliata | Stems | 0.000400% | Phytochemistry. 2006. 67, 2697-2705. | 10.1016/j.phytochem.2006.09.003. |
Properties
| HBA | 19 | HBD | 12 |
| HeavyAtoms | 66 | AlogP | -1.36 |
| TPSA | 315.21 | RotatableBonds | 9 |
| FractionCSP3 | 0.89 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |