TPCN04309
![[object Object]](../../static/browser_molecular_png/TPCN04309.png)
| Name | Esculentoside C |
| Molecular Formula | C42H66O15 |
| Molecular Weight | 810.98 |
| CAS Registry Number | 65931-92-2 |
| SMILES | COC(=O)C1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)C(C)(CO)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Phytolaccaceae | Phytolacca acinosa | Roots | 0.001825% | J Liq Chromatogr Relat Technol 33(4): 563-571. | 10.1080/10826070903574659 |
| Phytolaccaceae | Phytolacca acinosa | Roots | 0.001000% | Nat Prod Res. 2011 Oct;25(18):1771-5 | 10.1080/14786419.2010.535155 |
Properties
| HBA | 15 | HBD | 8 |
| HeavyAtoms | 57 | AlogP | 1.65 |
| TPSA | 242.13 | RotatableBonds | 8 |
| FractionCSP3 | 0.90 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |