TPCN04258
![[object Object]](../../static/browser_molecular_png/TPCN04258.png)
| Name | Esculentoside D |
| Molecular Formula | C37H58O12 |
| Molecular Weight | 694.86 |
| CAS Registry Number | 89808-50-4 |
| SMILES | COC(=O)C1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Phytolaccaceae | Phytolacca acinosa | Roots | 0.003400% | J Liq Chromatogr Relat Technol 33(4): 563-571. | 10.1080/10826070903574659 |
| Phytolaccaceae | Phytolacca acinosa | Roots | 0.001700% | Nat Prod Res. 2011 Oct;25(18):1771-5 | 10.1080/14786419.2010.535155 |
Properties
| HBA | 12 | HBD | 7 |
| HeavyAtoms | 49 | AlogP | 2.15 |
| TPSA | 203.44 | RotatableBonds | 6 |
| FractionCSP3 | 0.89 | Rings | 6 |
| AromaticRings | 0 | AliphaticRings | 6 |