TPCN04231
![[object Object]](../../static/browser_molecular_png/TPCN04231.png)
| Name | Phytolaccoside B;Esculentoside B |
| Molecular Formula | C36H56O11 |
| Molecular Weight | 664.83 |
| CAS Registry Number | 60820-94-2 |
| SMILES | COC(=O)C1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OCC(O)C(O)C6O)C(C)(CO)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Phytolaccaceae | Phytolacca acinosa | Roots | 0.010500% | Nat Prod Res. 2011 Oct;25(18):1771-5 | 10.1080/14786419.2010.535155 |
| Phytolaccaceae | Phytolacca acinosa | Roots | 0.005450% | J Liq Chromatogr Relat Technol 33(4): 563-571. | 10.1080/10826070903574659 |
| Phytolaccaceae | Phytolacca acinosa | Roots | 0.000260% | J Asian Nat Prod Res. 2009. 11, 433-438. | 10.1080/10286020902849266. |
Properties
| HBA | 11 | HBD | 6 |
| HeavyAtoms | 47 | AlogP | 2.79 |
| TPSA | 183.21 | RotatableBonds | 5 |
| FractionCSP3 | 0.89 | Rings | 6 |
| AromaticRings | 0 | AliphaticRings | 6 |